data_2kp0_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 2kp0 _Structure_validation_residue.Date_analyzed 2016-10-07 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . 0.458 ' O ' ' SG ' ' A' ' 7' ' ' CYS . 11.4 t . . . . . 0 N--CA 1.49 1.546 0 CA-C-O 121.25 0.548 . . . . 0.0 110.206 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 3' ' ' ASN . . . . . 0.467 ' O ' ' HB2' ' A' ' 7' ' ' CYS . 15.7 m120 48.0 84.22 0.03 OUTLIER 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.211 -0.931 . . . . 0.0 110.107 -179.96 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -52.02 -25.77 9.24 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.296 -0.877 . . . . 0.0 110.688 -179.824 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . 0.465 ' O ' ' HB2' ' A' ' 9' ' ' LEU . 0.0 OUTLIER -79.39 -45.24 19.91 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.073 -1.017 . . . . 0.0 110.481 -179.694 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -79.6 -18.4 51.7 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.193 -0.942 . . . . 0.0 110.218 -179.887 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . 0.469 ' O ' ' HB2' ' A' ' 11' ' ' CYS . 0.5 OUTLIER -83.53 -43.36 15.81 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.301 -0.874 . . . . 0.0 110.08 179.849 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' SER . . . . . 0.452 ' O ' HG13 ' A' ' 12' ' ' ILE . 86.0 p -72.17 -39.64 68.53 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.266 -0.896 . . . . 0.0 110.335 -179.92 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . 0.465 ' HB2' ' O ' ' A' ' 5' ' ' ARG . 0.2 OUTLIER -63.14 -51.4 66.65 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.248 -0.907 . . . . 0.0 110.343 -179.84 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -62.85 -35.95 81.64 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.261 -0.899 . . . . 0.0 110.457 -179.793 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.469 ' HB2' ' O ' ' A' ' 7' ' ' CYS . 0.5 OUTLIER -73.39 -43.83 59.74 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.109 -0.995 . . . . 0.0 110.425 -179.942 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . 0.452 HG13 ' O ' ' A' ' 8' ' ' SER . 47.6 mt -63.42 -23.18 32.65 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.614 0 O-C-N 121.185 -0.947 . . . . 0.0 109.885 179.906 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 1.9 ttt -80.22 -39.52 28.92 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.318 -0.864 . . . . 0.0 109.859 179.62 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 40.4 mtmt -54.03 -29.61 44.4 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.251 -0.905 . . . . 0.0 110.076 179.752 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 128.44 5.82 4.93 Favored Glycine 0 N--CA 1.491 2.321 0 N-CA-C 109.839 -1.304 . . . . 0.0 109.839 179.852 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 25.7 m-85 -80.37 -177.97 6.42 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.149 -1.206 . . . . 0.0 110.143 -179.975 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . 0.477 ' HB3' ' CD2' ' A' ' 18' ' ' PHE . 3.5 t-20 -108.31 -51.39 2.9 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.189 -0.945 . . . . 0.0 110.174 -179.915 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . 0.564 ' CE1' ' CB ' ' A' ' 29' ' ' ARG . 8.9 p90 -151.42 159.07 44.4 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.283 -0.886 . . . . 0.0 110.372 -179.917 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . 0.516 ' CA ' ' HA ' ' A' ' 28' ' ' CYS . . . -153.42 -162.05 10.77 Favored Glycine 0 N--CA 1.49 2.279 0 N-CA-C 109.372 -1.491 . . . . 0.0 109.372 179.938 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.457 ' HB3' ' O ' ' A' ' 19' ' ' GLY . 1.6 pttt 176.79 160.94 0.39 Allowed 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.288 -1.125 . . . . 0.0 110.275 179.891 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 74.1 m -82.92 137.81 34.08 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.153 -0.967 . . . . 0.0 110.086 179.899 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.489 ' O ' ' N ' ' A' ' 25' ' ' SER . 41.7 t -131.85 131.11 61.96 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.568 0 O-C-N 121.271 -0.893 . . . . 0.0 110.208 179.951 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . 0.426 ' C ' ' O ' ' A' ' 22' ' ' VAL . 0.8 OUTLIER 42.88 40.97 2.36 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.287 -0.883 . . . . 0.0 110.288 179.955 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 72.47 27.17 70.11 Favored Glycine 0 N--CA 1.491 2.35 0 N-CA-C 109.728 -1.349 . . . . 0.0 109.728 179.964 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' SER . . . . . 0.489 ' N ' ' O ' ' A' ' 22' ' ' VAL . 13.3 m -121.06 -173.37 2.59 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.217 -1.167 . . . . 0.0 110.112 179.927 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 16.9 t -134.68 101.16 4.84 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.284 -0.885 . . . . 0.0 110.312 -179.959 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 12.3 mm100 -118.61 154.37 32.76 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.253 -0.904 . . . . 0.0 110.154 179.954 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . 0.516 ' HA ' ' CA ' ' A' ' 19' ' ' GLY . 64.0 m -139.24 168.22 20.32 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.235 -0.916 . . . . 0.0 110.095 -179.944 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . 0.564 ' CB ' ' CE1' ' A' ' 18' ' ' PHE . 0.2 OUTLIER -128.81 154.65 46.21 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.131 -0.981 . . . . 0.0 110.419 -179.8 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.491 1.612 0 O-C-N 121.374 -0.828 . . . . 0.0 110.091 179.915 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 18.3 p . . . . . 0 N--CA 1.491 1.578 0 CA-C-O 121.244 0.545 . . . . 0.0 110.071 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 90.4 m-20 -114.6 146.26 41.02 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.185 -0.947 . . . . 0.0 110.319 -179.753 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 28.8 m-20 -64.96 -24.44 67.52 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.23 -0.919 . . . . 0.0 109.954 179.802 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.05 -54.07 12.46 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.352 -0.843 . . . . 0.0 110.274 -179.973 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 8.6 t0 -78.58 -4.66 49.93 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.356 -0.84 . . . . 0.0 109.783 179.822 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 5.1 t -95.15 -50.77 4.92 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.422 -0.799 . . . . 0.0 109.548 179.454 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 7.1 m -65.78 -39.8 91.34 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.365 -0.834 . . . . 0.0 109.906 179.633 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 6.5 mt -54.32 -39.24 66.85 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.193 -0.942 . . . . 0.0 110.015 179.828 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -72.25 -35.24 68.75 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.294 -0.878 . . . . 0.0 110.106 179.911 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.451 ' O ' ' HB2' ' A' ' 16' ' ' TYR . 92.0 m -66.57 -42.29 87.24 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.325 -0.859 . . . . 0.0 109.942 179.891 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 23.7 mt -67.43 -35.47 73.56 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.588 0 O-C-N 121.265 -0.897 . . . . 0.0 110.217 179.965 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 3.6 ttt -63.79 -46.33 85.69 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.232 -0.918 . . . . 0.0 110.186 179.996 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -59.19 -21.17 59.04 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.244 -0.91 . . . . 0.0 110.279 -179.941 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 115.63 7.86 15.1 Favored Glycine 0 N--CA 1.49 2.275 0 N-CA-C 109.606 -1.398 . . . . 0.0 109.606 179.849 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' TYR . . . . . 0.451 ' HB2' ' O ' ' A' ' 11' ' ' CYS . 24.7 m-85 -91.02 -159.33 0.62 Allowed 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.134 -1.215 . . . . 0.0 110.3 -179.986 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . 0.456 ' HB3' ' CD2' ' A' ' 18' ' ' PHE . 4.8 m-80 -116.88 -70.98 0.76 Allowed 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.209 -0.932 . . . . 0.0 110.372 -179.939 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . 0.503 ' CE1' ' HB2' ' A' ' 29' ' ' ARG . 14.8 p90 -128.42 -177.67 4.26 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.21 -0.931 . . . . 0.0 110.274 -179.862 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -151.53 -164.84 12.46 Favored Glycine 0 N--CA 1.49 2.258 0 N-CA-C 109.332 -1.507 . . . . 0.0 109.332 179.975 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.454 ' O ' ' HA ' ' A' ' 26' ' ' CYS . 0.3 OUTLIER -162.16 147.54 12.89 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.15 -1.206 . . . . 0.0 110.3 179.989 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . 0.477 ' C ' ' CG2' ' A' ' 22' ' ' VAL . 0.8 OUTLIER -82.3 139.08 34.37 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.353 -0.842 . . . . 0.0 110.385 -179.99 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.477 ' CG2' ' C ' ' A' ' 21' ' ' CYS . 15.1 t -151.57 112.25 0.46 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.607 0 O-C-N 121.303 -0.873 . . . . 0.0 110.255 -179.987 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . 0.457 ' HB2' ' O ' ' A' ' 22' ' ' VAL . 83.7 mtt180 61.02 73.38 0.48 Allowed 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.253 -0.904 . . . . 0.0 110.347 179.974 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . 0.419 ' C ' ' O ' ' A' ' 23' ' ' ARG . . . 42.65 28.12 0.6 Allowed Glycine 0 N--CA 1.492 2.386 0 N-CA-C 109.611 -1.396 . . . . 0.0 109.611 179.893 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' SER . . . . . 0.407 ' N ' ' O ' ' A' ' 23' ' ' ARG . 0.5 OUTLIER -141.22 -163.74 1.61 Allowed 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.276 -1.132 . . . . 0.0 110.041 179.971 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . 0.455 ' SG ' ' HA ' ' A' ' 21' ' ' CYS . 0.5 OUTLIER -167.07 142.86 4.24 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.234 -0.916 . . . . 0.0 110.171 179.917 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 6.3 mm-40 -119.84 176.18 5.53 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.387 -0.821 . . . . 0.0 110.302 -179.92 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 85.4 m -120.47 135.46 55.05 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.346 -0.846 . . . . 0.0 109.956 179.885 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . 0.503 ' HB2' ' CE1' ' A' ' 18' ' ' PHE . 0.4 OUTLIER -120.53 150.35 40.99 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.26 -0.9 . . . . 0.0 110.395 -179.815 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 5.4 ttt180 . . . . . 0 N--CA 1.492 1.628 0 O-C-N 121.313 -0.867 . . . . 0.0 109.964 179.994 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . 0.456 ' SG ' ' O ' ' A' ' 25' ' ' SER . 45.8 t . . . . . 0 N--CA 1.491 1.605 0 CA-C-O 121.179 0.514 . . . . 0.0 110.246 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 66.5 m-80 -116.62 140.79 49.0 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.337 -0.852 . . . . 0.0 110.113 -179.98 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' ASP . . . . . 0.463 ' O ' ' OG ' ' A' ' 8' ' ' SER . 2.8 m-20 -63.05 -13.4 35.39 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.249 -0.907 . . . . 0.0 110.096 179.994 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . 0.449 ' O ' ' HB2' ' A' ' 9' ' ' LEU . 0.0 OUTLIER -80.89 -40.05 25.32 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.373 -0.83 . . . . 0.0 110.2 179.994 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . 0.415 ' O ' ' CB ' ' A' ' 10' ' ' ASP . 1.0 OUTLIER -79.62 -29.29 41.02 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.175 -0.953 . . . . 0.0 110.146 -179.958 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -76.38 -47.2 24.1 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.183 -0.948 . . . . 0.0 110.039 179.873 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' SER . . . . . 0.463 ' OG ' ' O ' ' A' ' 4' ' ' ASP . 7.3 m -65.85 -39.81 91.12 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.192 -0.942 . . . . 0.0 109.994 179.884 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . 0.449 ' HB2' ' O ' ' A' ' 5' ' ' ARG . 4.0 mt -73.77 -36.57 65.09 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.32 -0.862 . . . . 0.0 110.164 179.775 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . 0.415 ' CB ' ' O ' ' A' ' 6' ' ' ASP . 36.9 t0 -76.43 -42.32 44.43 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.239 -0.913 . . . . 0.0 110.126 179.909 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.449 ' O ' ' HB2' ' A' ' 16' ' ' TYR . 93.9 m -67.28 -40.81 86.19 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.244 -0.91 . . . . 0.0 110.174 179.992 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 44.7 mt -66.23 -40.0 85.77 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.616 0 O-C-N 121.307 -0.871 . . . . 0.0 110.267 179.932 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' MET . . . . . 0.412 ' HB2' ' O ' ' A' ' 9' ' ' LEU . 2.3 ttp -68.29 -34.58 76.41 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.255 -0.903 . . . . 0.0 110.205 -179.994 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -64.05 -19.1 64.97 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.321 -0.862 . . . . 0.0 110.178 -179.991 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . 0.445 ' O ' ' NH1' ' A' ' 30' ' ' ARG . . . 109.91 16.42 10.7 Favored Glycine 0 N--CA 1.49 2.263 0 N-CA-C 109.662 -1.375 . . . . 0.0 109.662 -179.985 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' TYR . . . . . 0.449 ' HB2' ' O ' ' A' ' 11' ' ' CYS . 31.5 m-85 -97.36 -160.92 0.83 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.311 -1.111 . . . . 0.0 110.178 -179.873 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . 0.421 ' OD1' ' CD2' ' A' ' 18' ' ' PHE . 2.9 t-20 -119.4 -64.47 1.27 Allowed 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.237 -0.915 . . . . 0.0 110.272 -179.881 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . 0.574 ' CE1' ' HB3' ' A' ' 29' ' ' ARG . 6.6 p90 -143.77 145.28 32.26 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.184 -0.947 . . . . 0.0 110.289 -179.897 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . 0.437 ' HA3' ' HA ' ' A' ' 28' ' ' CYS . . . -132.99 -150.1 6.31 Favored Glycine 0 N--CA 1.491 2.331 0 N-CA-C 109.736 -1.345 . . . . 0.0 109.736 -179.965 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -170.66 173.52 5.36 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.185 -1.186 . . . . 0.0 110.229 -179.949 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 9.7 m -104.42 125.64 50.81 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.255 -0.903 . . . . 0.0 110.13 179.852 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.457 ' HB ' ' HB2' ' A' ' 25' ' ' SER . 9.9 t -86.81 43.12 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.633 0 O-C-N 121.2 -0.938 . . . . 0.0 110.037 179.858 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 3.4 mtm180 54.13 33.8 18.66 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.324 -0.86 . . . . 0.0 110.362 179.731 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 158.13 -19.36 0.34 Allowed Glycine 0 N--CA 1.491 2.319 0 C-N-CA 119.767 -1.206 . . . . 0.0 110.086 179.802 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' SER . . . . . 0.457 ' HB2' ' HB ' ' A' ' 22' ' ' VAL . 22.6 m -127.66 -176.55 3.79 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 120.993 -1.298 . . . . 0.0 110.681 -179.824 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . 0.45 ' SG ' ' SG ' ' A' ' 2' ' ' CYS . 0.1 OUTLIER -134.58 120.14 19.27 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.442 -0.787 . . . . 0.0 109.887 -179.863 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 1.8 mm-40 -118.68 167.2 11.88 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.202 -0.936 . . . . 0.0 110.494 -179.754 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . 0.437 ' HA ' ' HA3' ' A' ' 19' ' ' GLY . 17.7 m -136.52 152.05 50.1 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.206 -0.934 . . . . 0.0 109.97 179.849 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . 0.574 ' HB3' ' CE1' ' A' ' 18' ' ' PHE . 0.0 OUTLIER -132.5 152.03 51.69 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.155 -0.966 . . . . 0.0 110.398 -179.868 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.445 ' NH1' ' O ' ' A' ' 15' ' ' GLY . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.665 0 O-C-N 121.303 -0.873 . . . . 0.0 110.036 179.889 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . 0.429 ' HB2' ' SG ' ' A' ' 26' ' ' CYS . 23.3 p . . . . . 0 N--CA 1.491 1.611 0 CA-C-O 121.281 0.562 . . . . 0.0 110.342 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 3' ' ' ASN . . . . . 0.455 ' O ' ' SG ' ' A' ' 7' ' ' CYS . 0.1 OUTLIER -112.6 110.22 20.25 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.159 -0.963 . . . . 0.0 110.226 179.955 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' ASP . . . . . 0.507 ' N ' ' OD1' ' A' ' 4' ' ' ASP . 0.8 OUTLIER -50.9 -35.46 33.11 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.291 -0.881 . . . . 0.0 110.32 -179.901 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -62.31 -49.04 77.19 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.201 -0.937 . . . . 0.0 110.195 -179.945 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . 0.441 ' O ' ' HB2' ' A' ' 10' ' ' ASP . 0.3 OUTLIER -79.2 -6.65 57.09 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.314 -0.866 . . . . 0.0 110.0 179.873 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . 0.455 ' SG ' ' O ' ' A' ' 3' ' ' ASN . 87.4 m -89.81 -40.29 12.55 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.227 -0.921 . . . . 0.0 109.915 179.634 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 8.5 t -77.49 -39.24 47.07 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.297 -0.877 . . . . 0.0 110.082 179.693 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 12.7 mt -72.54 -38.78 67.89 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.309 -0.869 . . . . 0.0 110.063 179.875 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . 0.465 ' O ' ' HG2' ' A' ' 14' ' ' LYS . 12.1 t70 -69.41 -43.21 73.87 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.293 -0.88 . . . . 0.0 109.999 179.821 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 53.4 m -65.95 -40.36 91.27 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.289 -0.882 . . . . 0.0 109.733 179.82 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . 0.419 HD13 HG22 ' A' ' 12' ' ' ILE . 27.1 mt -63.73 -32.1 55.63 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.509 0 O-C-N 121.286 -0.884 . . . . 0.0 109.494 179.411 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -65.27 -45.06 85.99 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.367 -0.833 . . . . 0.0 109.694 179.506 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . 0.465 ' HG2' ' O ' ' A' ' 10' ' ' ASP . 11.8 mmmm -57.61 -17.57 15.14 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.34 -0.85 . . . . 0.0 109.855 179.621 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 107.02 40.07 1.89 Allowed Glycine 0 N--CA 1.491 2.328 0 N-CA-C 109.222 -1.551 . . . . 0.0 109.222 -179.712 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 12.3 m-85 -121.88 -165.54 1.27 Allowed 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.346 -1.091 . . . . 0.0 110.418 -179.74 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . 0.568 ' HB3' ' CD2' ' A' ' 18' ' ' PHE . 9.5 m-80 -98.11 -53.54 3.34 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.33 -0.856 . . . . 0.0 110.154 179.904 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . 0.568 ' CD2' ' HB3' ' A' ' 17' ' ' ASN . 11.0 p90 -161.27 -171.11 2.89 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.194 -0.941 . . . . 0.0 110.268 179.848 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -140.64 -179.23 17.95 Favored Glycine 0 N--CA 1.491 2.34 0 N-CA-C 109.639 -1.384 . . . . 0.0 109.639 179.985 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -149.41 151.17 33.59 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.254 -1.145 . . . . 0.0 110.387 179.978 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . 0.434 ' SG ' ' SG ' ' A' ' 26' ' ' CYS . 0.8 OUTLIER -89.88 132.49 35.26 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.228 -0.92 . . . . 0.0 110.245 -179.971 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.522 ' O ' ' CB ' ' A' ' 25' ' ' SER . 99.1 t -136.31 100.93 2.43 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.594 0 O-C-N 121.271 -0.893 . . . . 0.0 110.317 -179.941 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 50.92 80.3 0.08 Allowed 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.266 -0.896 . . . . 0.0 110.431 179.843 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 47.78 23.71 2.55 Favored Glycine 0 N--CA 1.49 2.278 0 N-CA-C 109.696 -1.362 . . . . 0.0 109.696 179.866 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' SER . . . . . 0.522 ' CB ' ' O ' ' A' ' 22' ' ' VAL . 1.2 t -127.16 173.67 9.53 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.217 -1.167 . . . . 0.0 110.137 179.968 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . 0.434 ' SG ' ' SG ' ' A' ' 21' ' ' CYS . 0.0 OUTLIER -158.47 123.57 4.32 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.227 -0.921 . . . . 0.0 110.318 179.919 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 25.1 mm-40 -120.28 -175.06 2.92 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.223 -0.923 . . . . 0.0 110.34 179.878 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 56.8 m -119.99 145.66 46.59 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.214 -0.929 . . . . 0.0 110.123 179.931 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . 0.565 ' CB ' ' CE1' ' A' ' 18' ' ' PHE . 0.4 OUTLIER -126.99 165.04 20.17 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.167 -0.958 . . . . 0.0 110.141 -179.905 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.493 1.678 0 O-C-N 121.25 -0.906 . . . . 0.0 110.23 -179.979 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . 0.439 ' SG ' ' O ' ' A' ' 25' ' ' SER . 6.5 t . . . . . 0 N--CA 1.49 1.57 0 CA-C-O 121.18 0.514 . . . . 0.0 110.171 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 2.8 m-80 -110.13 140.21 44.46 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.296 -0.878 . . . . 0.0 110.195 179.962 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -51.13 -43.44 61.17 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.203 -0.936 . . . . 0.0 110.182 -179.945 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 21.6 mtp180 -72.74 -42.81 63.69 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.253 -0.904 . . . . 0.0 110.203 179.998 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 1.3 t0 -79.92 3.93 18.36 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.36 -0.838 . . . . 0.0 110.154 179.964 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 8.6 t -107.21 -31.85 8.05 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.214 -0.929 . . . . 0.0 110.222 -179.966 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' SER . . . . . 0.458 ' O ' HG13 ' A' ' 12' ' ' ILE . 36.7 t -93.12 -31.19 14.9 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.267 -0.895 . . . . 0.0 110.218 179.941 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 34.5 mt -57.2 -57.83 10.88 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.176 -0.953 . . . . 0.0 110.139 -179.992 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -62.7 -38.54 90.82 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.33 -0.856 . . . . 0.0 110.237 -179.997 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -66.21 -38.32 87.68 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.246 -0.909 . . . . 0.0 110.02 -179.984 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . 0.458 HG13 ' O ' ' A' ' 8' ' ' SER . 11.0 mt -63.94 -34.3 67.51 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.549 0 O-C-N 121.292 -0.88 . . . . 0.0 109.669 179.587 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 36.9 mtt -67.9 -38.86 83.49 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.411 -0.806 . . . . 0.0 110.068 179.68 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 33.8 mtmt -55.07 -33.28 62.62 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.303 -0.873 . . . . 0.0 110.378 -179.882 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 130.69 2.07 4.92 Favored Glycine 0 N--CA 1.491 2.31 0 N-CA-C 109.871 -1.291 . . . . 0.0 109.871 179.948 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 81.2 m-85 -79.41 -178.02 6.05 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.063 -1.257 . . . . 0.0 110.214 -179.96 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . 0.487 ' HB3' ' CD2' ' A' ' 18' ' ' PHE . 1.5 t-20 -103.73 -66.09 0.97 Allowed 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.287 -0.883 . . . . 0.0 110.272 -179.976 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . 0.506 ' CE1' ' HB2' ' A' ' 29' ' ' ARG . 7.2 p90 -138.58 159.07 43.0 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.164 -0.96 . . . . 0.0 110.387 -179.958 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . 0.524 ' CA ' ' HA ' ' A' ' 28' ' ' CYS . . . -156.64 172.35 34.33 Favored Glycine 0 N--CA 1.489 2.22 0 N-CA-C 109.816 -1.314 . . . . 0.0 109.816 179.992 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -143.2 166.8 23.71 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.333 -1.098 . . . . 0.0 110.14 179.923 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . 0.474 ' HA ' ' O ' ' A' ' 25' ' ' SER . 47.0 t -98.94 116.04 30.27 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.222 -0.924 . . . . 0.0 110.079 179.863 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.51 ' O ' ' N ' ' A' ' 24' ' ' GLY . 41.1 t -80.22 82.86 1.25 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.676 0 O-C-N 121.155 -0.965 . . . . 0.0 110.085 -179.933 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 61.73 -77.03 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.298 -0.876 . . . . 0.0 109.895 -179.927 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . 0.51 ' N ' ' O ' ' A' ' 22' ' ' VAL . . . -127.24 39.32 1.97 Allowed Glycine 0 N--CA 1.489 2.183 0 N-CA-C 109.285 -1.526 . . . . 0.0 109.285 179.711 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' SER . . . . . 0.474 ' O ' ' HA ' ' A' ' 21' ' ' CYS . 0.3 OUTLIER -147.01 172.97 12.9 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.326 -1.102 . . . . 0.0 110.039 -179.951 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 49.3 t -134.85 98.31 3.99 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.201 -0.937 . . . . 0.0 110.248 -179.884 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.408 ' C ' ' SG ' ' A' ' 28' ' ' CYS . 4.6 mm-40 -105.43 157.99 16.97 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.292 -0.88 . . . . 0.0 109.915 179.943 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . 0.524 ' HA ' ' CA ' ' A' ' 19' ' ' GLY . 34.3 m -142.65 170.72 15.17 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.079 -1.013 . . . . 0.0 110.541 -179.803 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . 0.506 ' HB2' ' CE1' ' A' ' 18' ' ' PHE . 27.9 mmt180 -142.1 164.72 29.41 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.388 -0.82 . . . . 0.0 110.304 -179.75 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 54.3 mtp180 . . . . . 0 N--CA 1.491 1.6 0 O-C-N 121.282 -0.886 . . . . 0.0 110.139 179.973 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . 0.452 ' HA ' ' HB2' ' A' ' 26' ' ' CYS . 12.1 t . . . . . 0 N--CA 1.491 1.611 0 CA-C-O 121.293 0.568 . . . . 0.0 110.288 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 3' ' ' ASN . . . . . 0.41 ' O ' ' N ' ' A' ' 7' ' ' CYS . 1.4 m-20 -145.92 131.57 18.89 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.215 -0.928 . . . . 0.0 110.11 179.861 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' ASP . . . . . 0.447 ' O ' ' OG ' ' A' ' 8' ' ' SER . 65.6 m-20 -50.87 -37.25 42.31 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.219 -0.926 . . . . 0.0 110.259 179.997 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . 0.463 ' O ' ' HB2' ' A' ' 9' ' ' LEU . 0.0 OUTLIER -73.44 -41.54 63.1 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.307 -0.871 . . . . 0.0 110.147 179.999 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 33.8 m-20 -80.0 -22.75 42.11 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.227 -0.921 . . . . 0.0 110.308 -179.944 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . 0.41 ' N ' ' O ' ' A' ' 3' ' ' ASN . 41.4 m -76.36 -36.24 58.28 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.395 -0.816 . . . . 0.0 110.091 -179.914 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' SER . . . . . 0.447 ' OG ' ' O ' ' A' ' 4' ' ' ASP . 0.7 OUTLIER -85.02 -33.69 22.48 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.242 -0.912 . . . . 0.0 110.517 -179.703 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . 0.463 ' HB2' ' O ' ' A' ' 5' ' ' ARG . 0.7 OUTLIER -71.59 -52.95 15.43 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.173 -0.954 . . . . 0.0 110.322 -179.838 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 2.3 t0 -62.69 -24.71 67.79 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.193 -0.942 . . . . 0.0 110.147 179.899 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.402 ' SG ' ' O ' ' A' ' 7' ' ' CYS . 3.6 m -78.96 -45.65 19.94 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.185 -0.947 . . . . 0.0 110.287 -179.986 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . 0.44 HG13 ' O ' ' A' ' 8' ' ' SER . 64.2 mt -63.57 -30.25 49.36 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.626 0 O-C-N 121.123 -0.985 . . . . 0.0 110.222 179.991 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' MET . . . . . 0.458 ' HG3' ' O ' ' A' ' 9' ' ' LEU . 11.9 mtp -84.24 -27.35 28.0 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.272 -0.893 . . . . 0.0 110.178 179.832 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -78.93 -27.17 43.68 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.254 -0.904 . . . . 0.0 110.29 179.942 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 121.88 17.69 3.73 Favored Glycine 0 N--CA 1.492 2.415 0 N-CA-C 109.634 -1.387 . . . . 0.0 109.634 179.87 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' TYR . . . . . 0.456 ' HB3' ' SG ' ' A' ' 28' ' ' CYS . 45.0 m-85 -100.22 -170.45 1.87 Allowed 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.242 -1.152 . . . . 0.0 110.263 -179.99 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . 0.546 ' HB3' ' CD2' ' A' ' 18' ' ' PHE . 2.4 m120 -122.54 -56.92 1.77 Allowed 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.274 -0.891 . . . . 0.0 110.241 179.929 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . 0.554 ' CE1' ' HB3' ' A' ' 29' ' ' ARG . 11.6 p90 -147.33 153.88 40.23 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.188 -0.945 . . . . 0.0 110.186 -179.922 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . 0.527 ' CA ' ' HA ' ' A' ' 28' ' ' CYS . . . -136.74 -146.86 5.24 Favored Glycine 0 N--CA 1.492 2.367 0 N-CA-C 109.745 -1.342 . . . . 0.0 109.745 -179.924 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 175.04 141.99 0.05 Allowed 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.27 -1.135 . . . . 0.0 110.209 -179.957 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . 0.49 ' HA ' ' HA ' ' A' ' 26' ' ' CYS . 0.1 OUTLIER -97.04 125.61 41.61 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.203 -0.935 . . . . 0.0 110.456 -179.868 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.402 ' O ' ' CG1' ' A' ' 22' ' ' VAL . 60.7 t -94.39 45.47 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.564 0 O-C-N 121.348 -0.845 . . . . 0.0 109.964 179.812 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 61.32 84.85 0.13 Allowed 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.321 -0.862 . . . . 0.0 110.384 -179.96 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 103.63 -20.17 42.59 Favored Glycine 0 N--CA 1.491 2.34 0 N-CA-C 109.782 -1.327 . . . . 0.0 109.782 179.756 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' SER . . . . . 0.458 ' O ' ' HA ' ' A' ' 21' ' ' CYS . 3.0 t -132.2 162.21 31.5 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.122 -1.222 . . . . 0.0 110.33 -179.875 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . 0.49 ' HA ' ' HA ' ' A' ' 21' ' ' CYS . 18.2 t -138.7 123.34 18.58 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.288 -0.883 . . . . 0.0 110.426 -179.926 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 76.9 mt-30 -108.74 175.2 5.55 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.344 -0.847 . . . . 0.0 110.085 179.872 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . 0.527 ' HA ' ' CA ' ' A' ' 19' ' ' GLY . 6.9 t -148.68 156.4 42.33 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.298 -0.876 . . . . 0.0 110.431 -179.856 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . 0.554 ' HB3' ' CE1' ' A' ' 18' ' ' PHE . 6.2 mmm-85 -144.53 137.14 26.62 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.244 -0.91 . . . . 0.0 110.215 179.903 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.443 ' HG3' ' CD2' ' A' ' 16' ' ' TYR . 1.7 mpp_? . . . . . 0 N--CA 1.491 1.598 0 O-C-N 121.302 -0.874 . . . . 0.0 110.177 -179.958 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . 0.464 ' O ' ' HB2' ' A' ' 21' ' ' CYS . 17.7 p . . . . . 0 N--CA 1.492 1.63 0 CA-C-O 121.271 0.558 . . . . 0.0 110.182 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 3' ' ' ASN . . . . . 0.417 ' OD1' ' O ' ' A' ' 3' ' ' ASN . 53.2 p-10 -51.98 154.89 2.0 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.178 -0.951 . . . . 0.0 110.132 179.994 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' ASP . . . . . 0.466 ' OD2' ' HG2' ' A' ' 20' ' ' LYS . 0.6 OUTLIER -65.23 -15.93 62.99 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.358 -0.839 . . . . 0.0 110.385 -179.798 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . 0.43 ' O ' HD13 ' A' ' 9' ' ' LEU . 0.0 OUTLIER -75.33 -54.45 7.06 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.271 -0.893 . . . . 0.0 110.522 -179.788 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 2.1 t0 -79.77 -25.85 40.85 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.255 -0.903 . . . . 0.0 110.674 -179.683 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . 0.4 ' O ' ' SG ' ' A' ' 11' ' ' CYS . 30.9 t -76.76 -33.83 58.06 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.204 -0.935 . . . . 0.0 110.25 -179.868 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' SER . . . . . 0.453 ' HB3' ' O ' ' A' ' 4' ' ' ASP . 22.7 p -79.58 -43.19 23.43 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.182 -0.949 . . . . 0.0 110.317 179.939 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . 0.43 HD13 ' O ' ' A' ' 5' ' ' ARG . 0.2 OUTLIER -53.49 -42.04 66.87 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.258 -0.901 . . . . 0.0 110.203 -179.982 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 3.3 t70 -63.45 -27.19 69.11 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.298 -0.876 . . . . 0.0 110.097 179.733 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.4 ' SG ' ' O ' ' A' ' 7' ' ' CYS . 79.4 m -71.51 -41.4 69.3 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.271 -0.893 . . . . 0.0 110.107 -179.983 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 36.1 mt -63.65 -45.62 96.98 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.576 0 O-C-N 121.316 -0.865 . . . . 0.0 110.034 179.851 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 1.2 ttp -64.28 -31.42 72.62 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.243 -0.911 . . . . 0.0 109.98 179.767 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.47 -32.16 66.01 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.34 -0.85 . . . . 0.0 110.152 -179.945 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 137.3 -7.41 3.71 Favored Glycine 0 N--CA 1.491 2.323 0 N-CA-C 109.509 -1.436 . . . . 0.0 109.509 -179.904 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 26.2 m-85 -87.89 -170.12 2.86 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.321 -1.105 . . . . 0.0 110.15 -179.888 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 35.2 t-20 -120.61 -40.81 2.63 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.333 -0.854 . . . . 0.0 110.237 179.864 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . 0.605 ' CE2' ' CB ' ' A' ' 29' ' ' ARG . 38.4 p90 -146.58 146.96 30.64 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.342 -0.849 . . . . 0.0 110.193 179.829 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . 0.42 ' CA ' ' HA ' ' A' ' 28' ' ' CYS . . . -137.34 -173.01 12.73 Favored Glycine 0 N--CA 1.491 2.302 0 N-CA-C 109.524 -1.43 . . . . 0.0 109.524 -179.937 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.466 ' HG2' ' OD2' ' A' ' 4' ' ' ASP . 0.0 OUTLIER -161.96 159.25 26.32 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.191 -1.182 . . . . 0.0 110.258 179.963 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . 0.464 ' HB2' ' O ' ' A' ' 2' ' ' CYS . 40.7 t -87.43 139.47 30.52 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.29 -0.881 . . . . 0.0 110.018 -179.977 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.474 ' HB ' ' HB2' ' A' ' 25' ' ' SER . 43.0 t -117.89 92.49 2.15 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.684 0 O-C-N 121.154 -0.966 . . . . 0.0 110.679 -179.8 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER 50.66 53.87 12.2 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.477 -0.764 . . . . 0.0 111.108 179.328 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 89.97 15.98 56.86 Favored Glycine 0 N--CA 1.491 2.345 0 C-N-CA 119.886 -1.15 . . . . 0.0 110.312 179.205 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' SER . . . . . 0.474 ' HB2' ' HB ' ' A' ' 22' ' ' VAL . 1.1 m -122.04 178.99 4.67 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.006 -1.29 . . . . 0.0 110.134 179.719 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 46.0 t -145.75 95.03 2.58 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.258 -0.901 . . . . 0.0 110.32 -179.911 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -105.64 178.42 4.57 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.333 -0.855 . . . . 0.0 110.195 179.83 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . 0.42 ' HA ' ' CA ' ' A' ' 19' ' ' GLY . 82.0 m -134.69 150.33 50.6 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.259 -0.901 . . . . 0.0 110.284 -179.962 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . 0.605 ' CB ' ' CE2' ' A' ' 18' ' ' PHE . 10.1 mtt180 -122.59 146.37 47.49 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.259 -0.901 . . . . 0.0 110.1 -179.972 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.444 ' O ' ' CZ ' ' A' ' 18' ' ' PHE . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.581 0 O-C-N 121.217 -0.927 . . . . 0.0 110.19 179.985 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . 0.45 ' SG ' ' HB2' ' A' ' 26' ' ' CYS . 48.9 t . . . . . 0 N--CA 1.491 1.608 0 CA-C-O 121.241 0.544 . . . . 0.0 110.257 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -82.41 139.34 34.08 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.197 -0.939 . . . . 0.0 110.24 179.941 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 46.7 m-20 -66.85 -30.92 71.22 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.195 -0.941 . . . . 0.0 110.118 179.912 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . 0.429 ' O ' ' CD1' ' A' ' 9' ' ' LEU . 6.5 mtp180 -75.98 -41.84 50.12 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.277 -0.89 . . . . 0.0 110.098 179.868 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -79.64 -23.04 42.84 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.253 -0.904 . . . . 0.0 110.323 179.967 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 46.7 t -78.75 -38.06 39.71 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.21 -0.931 . . . . 0.0 110.145 179.877 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 38.1 t -75.06 -42.05 57.72 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.245 -0.909 . . . . 0.0 110.079 179.879 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . 0.429 ' CD1' ' O ' ' A' ' 5' ' ' ARG . 61.5 mt -53.86 -47.02 71.42 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.306 -0.871 . . . . 0.0 110.292 -179.963 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . 0.46 ' O ' ' HG3' ' A' ' 14' ' ' LYS . 5.5 m-20 -62.66 -38.82 91.83 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.272 -0.893 . . . . 0.0 110.108 179.959 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.443 ' O ' ' HB2' ' A' ' 16' ' ' TYR . 87.5 m -66.69 -39.13 87.97 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.285 -0.885 . . . . 0.0 110.042 179.94 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . 0.446 HD13 HG23 ' A' ' 12' ' ' ILE . 17.1 mt -63.67 -33.23 60.43 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.633 0 O-C-N 121.356 -0.84 . . . . 0.0 110.187 -179.865 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' MET . . . . . 0.474 ' HA ' ' CE ' ' A' ' 13' ' ' MET . 0.3 OUTLIER -71.28 -39.94 71.21 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.321 -0.862 . . . . 0.0 110.198 -179.977 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . 0.46 ' HG3' ' O ' ' A' ' 10' ' ' ASP . 1.1 mtmm -59.42 -14.58 12.72 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.126 -0.984 . . . . 0.0 110.218 -179.852 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 108.2 11.86 23.05 Favored Glycine 0 N--CA 1.49 2.262 0 N-CA-C 109.452 -1.459 . . . . 0.0 109.452 -179.931 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' TYR . . . . . 0.443 ' HB2' ' O ' ' A' ' 11' ' ' CYS . 5.8 m-85 -93.69 -165.08 1.26 Allowed 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.209 -1.171 . . . . 0.0 110.202 179.953 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -113.56 -62.12 1.64 Allowed 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.32 -0.863 . . . . 0.0 109.907 179.888 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . 0.469 ' CE1' ' HB2' ' A' ' 29' ' ' ARG . 1.0 OUTLIER -133.09 159.97 38.54 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.36 -0.837 . . . . 0.0 110.017 179.777 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -137.46 173.61 22.19 Favored Glycine 0 N--CA 1.491 2.306 0 N-CA-C 109.638 -1.385 . . . . 0.0 109.638 -179.799 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 19.3 ttpt -153.35 144.92 23.31 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.278 -1.13 . . . . 0.0 110.0 -179.919 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . 0.463 ' HA ' ' O ' ' A' ' 25' ' ' SER . 83.5 m -84.1 153.75 23.57 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.248 -0.907 . . . . 0.0 110.323 -179.93 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.538 ' O ' ' CG ' ' A' ' 23' ' ' ARG . 58.1 t -150.16 145.52 17.14 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.557 0 O-C-N 121.279 -0.888 . . . . 0.0 110.155 179.947 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . 0.538 ' CG ' ' O ' ' A' ' 22' ' ' VAL . 16.1 ptt180 38.22 33.46 0.06 Allowed 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.632 -0.667 . . . . 0.0 110.697 179.998 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . 0.408 ' N ' ' O ' ' A' ' 22' ' ' VAL . . . 79.91 37.55 22.13 Favored Glycine 0 N--CA 1.489 2.231 0 N-CA-C 109.523 -1.431 . . . . 0.0 109.523 -179.938 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' SER . . . . . 0.485 ' N ' ' O ' ' A' ' 22' ' ' VAL . 7.7 t -138.05 -168.85 2.44 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.268 -1.136 . . . . 0.0 110.173 179.999 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . 0.45 ' HB2' ' SG ' ' A' ' 2' ' ' CYS . 49.4 t -141.15 120.16 12.8 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.26 -0.9 . . . . 0.0 110.265 -179.959 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 24.6 mt-30 -118.75 166.15 13.13 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.232 -0.918 . . . . 0.0 110.208 -179.988 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 18.1 m -128.81 148.59 50.89 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.255 -0.903 . . . . 0.0 110.091 -179.904 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . 0.469 ' HB2' ' CE1' ' A' ' 18' ' ' PHE . 8.4 mmm-85 -129.02 168.02 16.65 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.182 -0.949 . . . . 0.0 110.299 179.969 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 15.2 mtm180 . . . . . 0 N--CA 1.491 1.58 0 O-C-N 121.334 -0.854 . . . . 0.0 110.331 -179.987 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 16.3 p . . . . . 0 N--CA 1.49 1.567 0 CA-C-O 121.268 0.556 . . . . 0.0 110.195 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 6.2 m120 -100.32 128.05 46.48 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.142 -0.974 . . . . 0.0 110.305 -179.889 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -66.41 -48.56 69.67 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.306 -0.871 . . . . 0.0 110.044 179.909 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . 0.446 ' O ' ' CD1' ' A' ' 9' ' ' LEU . 1.5 ttt85 -62.53 -35.89 80.87 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.295 -0.878 . . . . 0.0 109.723 179.701 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 1.9 t0 -79.53 -20.97 45.83 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.357 -0.839 . . . . 0.0 109.563 179.47 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . 0.417 ' O ' ' HB2' ' A' ' 11' ' ' CYS . 7.5 t -80.34 -45.71 17.33 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.432 -0.793 . . . . 0.0 109.874 179.639 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' SER . . . . . 0.448 ' HB3' HD12 ' A' ' 12' ' ' ILE . 0.4 OUTLIER -68.35 -44.28 75.58 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.428 -0.795 . . . . 0.0 110.207 -179.971 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . 0.446 ' CD1' ' O ' ' A' ' 5' ' ' ARG . 0.2 OUTLIER -53.99 -43.43 69.99 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.272 -0.893 . . . . 0.0 110.023 179.939 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . 0.47 ' O ' ' HG3' ' A' ' 14' ' ' LYS . 11.5 t0 -74.02 -43.5 57.75 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.319 -0.863 . . . . 0.0 110.255 179.953 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.417 ' HB2' ' O ' ' A' ' 7' ' ' CYS . 0.0 OUTLIER -66.48 -39.95 89.04 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.166 -0.959 . . . . 0.0 110.433 -179.779 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . 0.448 HD12 ' HB3' ' A' ' 8' ' ' SER . 14.3 mt -63.4 -47.05 93.65 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.672 0 O-C-N 121.141 -0.975 . . . . 0.0 110.034 179.962 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -64.41 -25.32 67.97 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.156 -0.965 . . . . 0.0 109.83 179.719 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . 0.47 ' HG3' ' O ' ' A' ' 10' ' ' ASP . 3.4 mttt -73.29 -36.75 66.36 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.293 -0.879 . . . . 0.0 110.151 179.78 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 147.47 -13.78 1.4 Allowed Glycine 0 N--CA 1.491 2.349 0 N-CA-C 109.666 -1.374 . . . . 0.0 109.666 179.941 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' TYR . . . . . 0.47 ' CE2' ' HD2' ' A' ' 30' ' ' ARG . 85.6 m-85 -74.05 -168.7 0.65 Allowed 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.117 -1.225 . . . . 0.0 110.299 179.997 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . 0.553 ' HB3' ' CD2' ' A' ' 18' ' ' PHE . 0.7 OUTLIER -132.12 -53.06 0.97 Allowed 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.193 -0.942 . . . . 0.0 110.339 -179.967 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . 0.578 ' CE1' ' HB2' ' A' ' 29' ' ' ARG . 9.4 p90 -141.62 152.82 44.33 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.138 -0.977 . . . . 0.0 110.428 179.928 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -148.72 -152.18 5.65 Favored Glycine 0 N--CA 1.489 2.222 0 N-CA-C 109.565 -1.414 . . . . 0.0 109.565 179.977 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.47 ' O ' ' HA ' ' A' ' 26' ' ' CYS . 0.0 OUTLIER -174.18 149.42 1.42 Allowed 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.267 -1.137 . . . . 0.0 110.096 -179.989 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -90.14 129.04 36.47 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.258 -0.901 . . . . 0.0 110.322 179.977 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.453 ' N ' ' O ' ' A' ' 25' ' ' SER . 54.0 t -111.08 94.1 2.91 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.58 0 O-C-N 121.264 -0.898 . . . . 0.0 110.33 -179.955 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . 0.448 ' HB2' ' O ' ' A' ' 22' ' ' VAL . 5.4 mtt-85 61.32 -88.67 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.328 -0.858 . . . . 0.0 110.506 179.863 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -119.94 24.21 7.97 Favored Glycine 0 N--CA 1.489 2.197 0 N-CA-C 109.784 -1.327 . . . . 0.0 109.784 -179.703 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' SER . . . . . 0.453 ' O ' ' N ' ' A' ' 22' ' ' VAL . 0.3 OUTLIER -147.98 -174.54 4.59 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.165 -1.197 . . . . 0.0 110.076 179.856 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . 0.47 ' HA ' ' O ' ' A' ' 20' ' ' LYS . 9.2 t -149.67 150.7 32.54 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.257 -0.902 . . . . 0.0 110.48 179.942 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.43 ' O ' ' SG ' ' A' ' 28' ' ' CYS . 12.5 mt-30 -113.5 175.25 5.53 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.381 -0.824 . . . . 0.0 109.763 179.64 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . 0.43 ' SG ' ' O ' ' A' ' 27' ' ' GLN . 7.5 m -155.66 141.4 18.0 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.214 -0.929 . . . . 0.0 110.339 -179.883 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . 0.578 ' HB2' ' CE1' ' A' ' 18' ' ' PHE . 1.0 OUTLIER -134.1 137.63 44.71 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.31 -0.869 . . . . 0.0 110.109 -179.974 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.47 ' HD2' ' CE2' ' A' ' 16' ' ' TYR . 0.4 OUTLIER . . . . . 0 N--CA 1.492 1.662 0 O-C-N 121.299 -0.876 . . . . 0.0 110.415 -179.811 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . 0.453 ' SG ' ' HB2' ' A' ' 26' ' ' CYS . 39.6 t . . . . . 0 N--CA 1.492 1.642 0 CA-C-O 121.199 0.523 . . . . 0.0 110.124 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 10.8 m120 -83.56 115.15 21.98 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.308 -0.87 . . . . 0.0 110.136 179.96 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -58.03 -21.74 46.57 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.267 -0.896 . . . . 0.0 110.147 179.96 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . 0.443 ' O ' ' HB2' ' A' ' 9' ' ' LEU . 0.0 OUTLIER -78.51 -45.62 21.54 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.21 -0.931 . . . . 0.0 110.097 179.975 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 21.0 m-20 -79.03 -18.41 53.6 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.244 -0.91 . . . . 0.0 109.818 179.791 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . 0.473 ' O ' ' HB2' ' A' ' 11' ' ' CYS . 8.1 t -78.37 -54.08 6.58 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.345 -0.847 . . . . 0.0 109.947 179.801 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' SER . . . . . 0.451 ' O ' HG13 ' A' ' 12' ' ' ILE . 0.3 OUTLIER -64.58 -42.03 95.88 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.288 -0.882 . . . . 0.0 110.133 179.932 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . 0.443 ' HB2' ' O ' ' A' ' 5' ' ' ARG . 0.3 OUTLIER -54.05 -51.85 62.73 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.146 -0.971 . . . . 0.0 110.231 -179.997 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 2.4 t0 -69.36 -38.77 78.24 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.278 -0.889 . . . . 0.0 110.417 -179.923 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.473 ' HB2' ' O ' ' A' ' 7' ' ' CYS . 0.1 OUTLIER -66.58 -39.79 88.62 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.159 -0.963 . . . . 0.0 110.132 -179.957 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . 0.451 HG13 ' O ' ' A' ' 8' ' ' SER . 15.5 mt -63.63 -38.72 83.0 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.563 0 O-C-N 121.278 -0.889 . . . . 0.0 109.833 179.87 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 2.6 mmm -69.87 -28.87 66.01 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.271 -0.893 . . . . 0.0 109.999 179.715 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -67.15 -32.06 72.91 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.255 -0.903 . . . . 0.0 110.205 179.836 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 138.25 -7.51 3.44 Favored Glycine 0 N--CA 1.491 2.313 0 N-CA-C 109.581 -1.408 . . . . 0.0 109.581 -179.823 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 97.2 m-85 -80.09 -163.73 0.59 Allowed 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.135 -1.215 . . . . 0.0 110.242 179.914 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . 0.585 ' HB3' ' CD2' ' A' ' 18' ' ' PHE . 0.7 OUTLIER -133.11 -63.31 0.77 Allowed 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.297 -0.877 . . . . 0.0 110.203 179.871 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . 0.585 ' CD2' ' HB3' ' A' ' 17' ' ' ASN . 5.4 p90 -133.89 145.75 49.92 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.12 -0.988 . . . . 0.0 110.38 179.78 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . 0.478 ' CA ' ' HA ' ' A' ' 28' ' ' CYS . . . -140.29 -150.51 5.47 Favored Glycine 0 N--CA 1.489 2.219 0 N-CA-C 109.529 -1.428 . . . . 0.0 109.529 -179.973 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 4.1 tttm -173.61 152.97 2.18 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.179 -1.189 . . . . 0.0 110.265 179.932 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . 0.433 ' SG ' ' SG ' ' A' ' 26' ' ' CYS . 22.1 m -91.31 144.27 25.78 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.346 -0.846 . . . . 0.0 110.315 179.969 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.419 ' O ' ' HB2' ' A' ' 23' ' ' ARG . 39.2 t -139.25 115.73 9.92 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.67 0 O-C-N 121.323 -0.86 . . . . 0.0 110.159 179.919 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . 0.419 ' HB2' ' O ' ' A' ' 22' ' ' VAL . 0.1 OUTLIER 56.31 -92.85 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.344 -0.848 . . . . 0.0 110.3 179.939 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -131.65 23.62 4.21 Favored Glycine 0 N--CA 1.49 2.238 0 N-CA-C 109.456 -1.457 . . . . 0.0 109.456 -179.955 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 4.0 t -142.34 172.47 12.65 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.226 -1.161 . . . . 0.0 109.931 179.872 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . 0.453 ' HB2' ' SG ' ' A' ' 2' ' ' CYS . 1.0 OUTLIER -138.46 145.37 40.8 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.084 -1.01 . . . . 0.0 110.837 -179.749 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.45 ' O ' ' SG ' ' A' ' 28' ' ' CYS . 14.1 mm-40 -119.97 170.18 9.5 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.34 -0.85 . . . . 0.0 109.791 179.572 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . 0.478 ' HA ' ' CA ' ' A' ' 19' ' ' GLY . 96.6 m -150.4 157.93 43.59 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.076 -1.015 . . . . 0.0 110.452 -179.949 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . 0.574 ' HB2' ' CE1' ' A' ' 18' ' ' PHE . 9.7 mtp180 -128.96 159.59 35.38 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.207 -0.933 . . . . 0.0 110.395 179.967 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.583 0 O-C-N 121.205 -0.935 . . . . 0.0 110.143 179.866 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . 0.439 ' O ' ' CB ' ' A' ' 3' ' ' ASN . 16.4 p . . . . . 0 N--CA 1.491 1.576 0 CA-C-O 121.233 0.539 . . . . 0.0 110.025 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 3' ' ' ASN . . . . . 0.439 ' CB ' ' O ' ' A' ' 2' ' ' CYS . 1.0 OUTLIER 66.16 84.78 0.15 Allowed 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.272 -0.893 . . . . 0.0 109.872 -179.829 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -53.02 -40.42 63.86 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.314 -0.866 . . . . 0.0 110.372 -179.792 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . 0.404 ' O ' HD11 ' A' ' 9' ' ' LEU . 8.0 ptm180 -62.35 -36.35 81.95 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.172 -0.955 . . . . 0.0 110.093 -179.916 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 22.7 t0 -81.16 -12.75 59.13 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.232 -0.917 . . . . 0.0 109.915 179.717 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . 0.416 ' O ' ' SG ' ' A' ' 11' ' ' CYS . 0.8 OUTLIER -82.44 -39.76 22.14 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.324 -0.86 . . . . 0.0 110.095 179.923 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' SER . . . . . 0.418 ' OG ' HD13 ' A' ' 12' ' ' ILE . 2.2 t -84.52 -35.15 23.09 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.312 -0.867 . . . . 0.0 110.001 179.918 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . 0.404 HD11 ' O ' ' A' ' 5' ' ' ARG . 5.6 mt -65.01 -46.91 79.41 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.353 -0.842 . . . . 0.0 109.992 179.808 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -64.16 -39.78 94.72 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.166 -0.959 . . . . 0.0 110.062 179.767 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.416 ' SG ' ' O ' ' A' ' 7' ' ' CYS . 82.5 m -67.37 -41.28 85.33 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.282 -0.886 . . . . 0.0 110.21 179.807 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . 0.418 HD13 ' OG ' ' A' ' 8' ' ' SER . 53.6 mt -66.81 -44.0 89.4 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.603 0 O-C-N 121.297 -0.877 . . . . 0.0 110.258 179.981 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -69.1 -20.24 64.07 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.14 -0.975 . . . . 0.0 110.096 -179.962 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.61 -21.48 60.31 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.266 -0.896 . . . . 0.0 110.253 -179.961 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 124.32 -1.0 8.9 Favored Glycine 0 N--CA 1.491 2.328 0 N-CA-C 109.749 -1.341 . . . . 0.0 109.749 179.823 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' TYR . . . . . 0.445 ' N ' ' CD1' ' A' ' 16' ' ' TYR . 30.4 m-85 -89.09 -158.69 0.52 Allowed 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.138 -1.213 . . . . 0.0 110.236 -179.998 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . 0.576 ' HB3' ' CD2' ' A' ' 18' ' ' PHE . 5.3 t30 -120.1 -40.7 2.69 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.146 -0.971 . . . . 0.0 110.239 179.978 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . 0.576 ' CD2' ' HB3' ' A' ' 17' ' ' ASN . 12.3 p90 -157.1 158.01 35.6 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.127 -0.983 . . . . 0.0 110.404 179.874 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . 0.441 ' O ' ' HB3' ' A' ' 20' ' ' LYS . . . -138.88 -165.12 10.15 Favored Glycine 0 N--CA 1.492 2.37 0 N-CA-C 109.427 -1.469 . . . . 0.0 109.427 179.993 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.441 ' HB3' ' O ' ' A' ' 19' ' ' GLY . 0.0 OUTLIER -176.75 163.04 2.25 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.264 -1.139 . . . . 0.0 110.207 179.965 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . 0.524 ' O ' ' CG2' ' A' ' 22' ' ' VAL . 2.8 t -92.03 155.7 17.92 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.331 -0.856 . . . . 0.0 110.375 -179.93 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.524 ' CG2' ' O ' ' A' ' 21' ' ' CYS . 73.0 t -157.48 103.63 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.567 0 O-C-N 121.319 -0.863 . . . . 0.0 110.027 179.785 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . 0.44 ' HB2' ' O ' ' A' ' 22' ' ' VAL . 0.0 OUTLIER 57.87 66.15 1.18 Allowed 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.219 -0.926 . . . . 0.0 110.122 -179.854 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 50.48 44.59 45.93 Favored Glycine 0 N--CA 1.491 2.344 0 N-CA-C 109.499 -1.44 . . . . 0.0 109.499 -179.975 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' SER . . . . . 0.405 ' O ' ' SG ' ' A' ' 21' ' ' CYS . 0.2 OUTLIER -142.26 164.91 28.86 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.203 -1.175 . . . . 0.0 110.209 179.988 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -134.93 111.21 9.65 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.242 -0.911 . . . . 0.0 110.09 179.938 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -117.77 168.06 10.81 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.368 -0.833 . . . . 0.0 110.273 -179.793 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 23.3 m -124.44 142.71 51.1 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.301 -0.875 . . . . 0.0 110.05 179.84 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . 0.509 ' CZ ' ' HA ' ' A' ' 29' ' ' ARG . 3.8 mmp_? -129.72 136.43 49.66 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.194 -0.942 . . . . 0.0 110.25 -179.933 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 10.4 mtp85 . . . . . 0 N--CA 1.492 1.649 0 O-C-N 121.242 -0.911 . . . . 0.0 110.226 -179.941 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . 0.415 ' C ' ' SG ' ' A' ' 21' ' ' CYS . 7.2 t . . . . . 0 N--CA 1.492 1.652 0 CA-C-O 121.317 0.58 . . . . 0.0 110.115 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 3' ' ' ASN . . . . . 0.469 ' O ' ' HB3' ' A' ' 7' ' ' CYS . 0.8 OUTLIER -126.44 129.61 49.05 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.387 -0.821 . . . . 0.0 110.036 -179.971 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 10.4 m-20 -54.64 -41.9 70.63 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.275 -0.89 . . . . 0.0 110.675 -179.749 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . 0.461 ' O ' ' HB2' ' A' ' 9' ' ' LEU . 3.0 ttt180 -81.88 -35.34 29.35 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.13 -0.981 . . . . 0.0 110.264 -179.808 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . 0.452 ' O ' ' HB2' ' A' ' 10' ' ' ASP . 3.0 t70 -79.4 -25.66 42.08 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.357 -0.839 . . . . 0.0 110.167 -179.943 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . 0.469 ' HB3' ' O ' ' A' ' 3' ' ' ASN . 17.0 t -87.25 -42.11 13.19 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.316 -0.865 . . . . 0.0 110.067 179.937 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' SER . . . . . 0.468 ' O ' ' CG1' ' A' ' 12' ' ' ILE . 84.6 p -67.92 -46.49 71.4 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.366 -0.834 . . . . 0.0 110.285 -179.854 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . 0.461 ' HB2' ' O ' ' A' ' 5' ' ' ARG . 3.0 mt -65.27 -38.3 89.87 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.181 -0.949 . . . . 0.0 110.414 -179.883 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . 0.452 ' HB2' ' O ' ' A' ' 6' ' ' ASP . 26.1 m-20 -74.11 -48.82 27.0 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.213 -0.929 . . . . 0.0 110.502 -179.844 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.496 ' SG ' ' CB ' ' A' ' 16' ' ' TYR . 53.0 t -68.71 -39.18 80.57 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.185 -0.947 . . . . 0.0 110.631 -179.764 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . 0.468 ' CG1' ' O ' ' A' ' 8' ' ' SER . 46.8 mt -63.48 -39.3 84.8 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.553 0 O-C-N 121.095 -1.003 . . . . 0.0 110.152 179.942 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' MET . . . . . 0.423 ' HB2' ' O ' ' A' ' 9' ' ' LEU . 5.4 ttm -77.85 -19.07 55.51 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.243 -0.91 . . . . 0.0 109.981 179.759 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.11 -24.47 61.49 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.299 -0.876 . . . . 0.0 110.128 179.849 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 132.49 -2.93 5.03 Favored Glycine 0 N--CA 1.49 2.239 0 N-CA-C 109.559 -1.416 . . . . 0.0 109.559 -179.969 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' TYR . . . . . 0.565 ' CD1' ' HB3' ' A' ' 28' ' ' CYS . 82.2 m-85 -82.22 -172.24 3.87 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.287 -1.126 . . . . 0.0 110.183 -179.956 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . 0.52 ' C ' ' CD1' ' A' ' 18' ' ' PHE . 1.8 t-20 -127.18 -32.13 2.52 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.244 -0.91 . . . . 0.0 110.269 -179.935 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . 0.52 ' CD1' ' C ' ' A' ' 17' ' ' ASN . 2.9 m-85 -123.84 169.47 11.54 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.123 -0.986 . . . . 0.0 110.37 -179.912 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -156.67 129.12 2.34 Favored Glycine 0 N--CA 1.491 2.341 0 N-CA-C 109.439 -1.464 . . . . 0.0 109.439 179.853 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.446 ' O ' ' SG ' ' A' ' 26' ' ' CYS . 32.8 tttp -144.5 140.91 29.17 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.131 -1.217 . . . . 0.0 110.367 -179.843 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . 0.471 ' HA ' ' HA ' ' A' ' 26' ' ' CYS . 0.0 OUTLIER -97.58 131.62 44.0 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.185 -0.947 . . . . 0.0 110.206 -179.993 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.464 HG21 ' O ' ' A' ' 21' ' ' CYS . 54.2 t -151.23 127.83 2.01 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.615 0 O-C-N 121.149 -0.969 . . . . 0.0 110.471 179.998 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . 0.443 ' CB ' ' O ' ' A' ' 22' ' ' VAL . 14.9 ttp180 64.56 57.51 1.11 Allowed 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.32 -0.863 . . . . 0.0 110.314 179.829 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 50.24 22.19 4.81 Favored Glycine 0 N--CA 1.49 2.285 0 N-CA-C 109.5 -1.44 . . . . 0.0 109.5 -179.973 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' SER . . . . . 0.447 ' O ' ' N ' ' A' ' 22' ' ' VAL . 41.3 m -142.2 177.94 7.89 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.348 -1.089 . . . . 0.0 109.915 -179.986 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . 0.471 ' HA ' ' HA ' ' A' ' 21' ' ' CYS . 0.7 OUTLIER -136.8 143.13 43.02 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.145 -0.972 . . . . 0.0 110.392 179.998 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 2.4 mt-30 -115.19 156.3 25.59 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.309 -0.869 . . . . 0.0 109.971 179.821 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . 0.565 ' HB3' ' CD1' ' A' ' 16' ' ' TYR . 32.1 m -125.37 171.27 10.57 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.258 -0.901 . . . . 0.0 110.314 -179.861 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -143.19 139.66 30.4 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.376 -0.828 . . . . 0.0 110.033 179.891 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.489 1.518 0 O-C-N 121.218 -0.926 . . . . 0.0 110.252 -179.998 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . 0.464 ' O ' ' O ' ' A' ' 3' ' ' ASN . 16.7 p . . . . . 0 N--CA 1.491 1.575 0 CA-C-O 121.263 0.554 . . . . 0.0 110.301 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 3' ' ' ASN . . . . . 0.475 ' O ' ' HB2' ' A' ' 7' ' ' CYS . 2.1 m-20 58.89 124.53 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.289 -0.882 . . . . 0.0 110.54 179.683 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' ASP . . . . . 0.424 ' HA ' ' HB3' ' A' ' 7' ' ' CYS . 23.7 m-20 -80.14 -24.82 40.19 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.159 -0.963 . . . . 0.0 110.227 179.811 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 5.3 ttt180 -63.81 -60.77 2.86 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.329 -0.857 . . . . 0.0 110.471 -179.831 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 5.6 t70 -79.65 6.31 10.99 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.232 -0.918 . . . . 0.0 110.155 -179.943 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . 0.475 ' HB2' ' O ' ' A' ' 3' ' ' ASN . 4.9 t -99.58 -36.05 9.65 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.347 -0.846 . . . . 0.0 110.073 179.89 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -93.26 -29.3 15.75 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.314 -0.866 . . . . 0.0 110.22 179.923 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 2.7 mt -55.27 -55.65 29.04 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.31 -0.869 . . . . 0.0 110.332 -179.937 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 3.1 t0 -65.62 -35.97 82.37 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.156 -0.965 . . . . 0.0 110.369 -179.877 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -66.67 -49.47 66.07 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.255 -0.903 . . . . 0.0 110.2 179.997 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . 0.462 HG23 ' O ' ' A' ' 12' ' ' ILE . 61.2 mt -63.65 -24.1 35.0 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.637 0 O-C-N 121.328 -0.858 . . . . 0.0 109.894 179.855 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 2.7 mtt -79.66 -26.55 41.0 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.314 -0.866 . . . . 0.0 110.003 179.801 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.21 -25.79 60.9 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.274 -0.891 . . . . 0.0 110.102 179.907 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 134.51 -9.04 4.65 Favored Glycine 0 N--CA 1.491 2.331 0 N-CA-C 109.62 -1.392 . . . . 0.0 109.62 179.986 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 23.1 m-85 -68.02 -158.45 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.159 -1.201 . . . . 0.0 110.165 -179.98 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . 0.583 ' HB3' ' CD2' ' A' ' 18' ' ' PHE . 0.1 OUTLIER -135.71 -53.1 0.76 Allowed 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.343 -0.848 . . . . 0.0 110.118 179.953 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . 0.583 ' CD2' ' HB3' ' A' ' 17' ' ' ASN . 6.1 p90 -152.93 157.61 40.88 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.226 -0.921 . . . . 0.0 110.37 179.799 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . 0.421 ' HA3' ' HA ' ' A' ' 28' ' ' CYS . . . -154.05 -160.5 9.83 Favored Glycine 0 N--CA 1.49 2.24 0 N-CA-C 109.474 -1.45 . . . . 0.0 109.474 179.883 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -172.75 176.02 3.25 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.097 -1.237 . . . . 0.0 110.335 179.981 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . 0.448 ' SG ' ' O ' ' A' ' 25' ' ' SER . 8.4 t -83.99 132.9 34.71 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.29 -0.881 . . . . 0.0 110.317 179.943 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.462 ' O ' ' HB2' ' A' ' 25' ' ' SER . 71.0 t -118.27 92.13 2.04 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.675 0 O-C-N 121.293 -0.879 . . . . 0.0 110.254 -179.947 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . 0.466 ' O ' ' OG ' ' A' ' 25' ' ' SER . 4.7 tmm_? 50.81 84.15 0.04 OUTLIER 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.311 -0.868 . . . . 0.0 110.363 179.909 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 51.62 22.71 8.58 Favored Glycine 0 N--CA 1.49 2.24 0 N-CA-C 109.69 -1.364 . . . . 0.0 109.69 179.964 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' SER . . . . . 0.466 ' OG ' ' O ' ' A' ' 23' ' ' ARG . 1.1 m -135.78 -161.66 1.18 Allowed 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.333 -1.098 . . . . 0.0 109.718 179.794 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -167.03 124.62 1.26 Allowed 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.231 -0.918 . . . . 0.0 110.677 179.937 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.446 ' O ' ' SG ' ' A' ' 28' ' ' CYS . 33.8 mm-40 -119.06 -179.86 3.95 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.427 -0.796 . . . . 0.0 109.694 179.639 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . 0.446 ' SG ' ' O ' ' A' ' 27' ' ' GLN . 84.3 m -149.49 157.9 43.7 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.114 -0.991 . . . . 0.0 109.914 179.921 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . 0.57 ' HB2' ' CE1' ' A' ' 18' ' ' PHE . 6.2 mmm180 -134.31 156.52 48.32 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.105 -0.997 . . . . 0.0 110.483 -179.642 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.601 0 O-C-N 121.292 -0.88 . . . . 0.0 110.122 179.92 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . 0.425 ' O ' ' CB ' ' A' ' 3' ' ' ASN . 20.6 p . . . . . 0 N--CA 1.492 1.639 0 CA-C-O 121.24 0.543 . . . . 0.0 110.269 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 3' ' ' ASN . . . . . 0.467 ' O ' ' N ' ' A' ' 7' ' ' CYS . 0.8 OUTLIER 173.66 137.76 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.195 -0.941 . . . . 0.0 110.251 -179.969 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -53.36 -34.96 59.67 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.122 -0.986 . . . . 0.0 110.203 -179.989 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -78.4 -39.69 38.22 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.279 -0.888 . . . . 0.0 110.415 -179.946 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 4.3 t0 -84.8 -19.02 33.18 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.301 -0.875 . . . . 0.0 110.287 -179.889 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . 0.467 ' N ' ' O ' ' A' ' 3' ' ' ASN . 10.1 t -87.64 -27.9 22.2 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.235 -0.916 . . . . 0.0 110.113 179.977 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 6.0 t -92.41 -33.04 14.7 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.285 -0.884 . . . . 0.0 110.337 -179.882 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -57.02 -55.9 28.75 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.173 -0.954 . . . . 0.0 110.284 -179.792 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -67.09 -38.22 85.32 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.15 -0.969 . . . . 0.0 110.179 -179.949 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.418 ' SG ' ' O ' ' A' ' 7' ' ' CYS . 55.0 m -68.11 -44.74 75.47 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.285 -0.885 . . . . 0.0 110.185 -179.975 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . 0.477 HD11 HG22 ' A' ' 12' ' ' ILE . 19.8 mt -63.56 -41.13 91.57 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.589 0 O-C-N 121.187 -0.945 . . . . 0.0 109.997 179.882 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -69.08 -34.77 75.65 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.27 -0.894 . . . . 0.0 110.024 179.83 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -65.85 -57.12 8.66 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.294 -0.879 . . . . 0.0 109.945 179.832 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 159.91 36.65 0.02 OUTLIER Glycine 0 N--CA 1.491 2.352 0 N-CA-C 109.663 -1.375 . . . . 0.0 109.663 -179.991 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' TYR . . . . . 0.439 ' CD2' ' HG2' ' A' ' 30' ' ' ARG . 36.8 m-85 -113.09 -173.43 2.25 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.154 -1.203 . . . . 0.0 110.19 -179.996 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . 0.537 ' CG ' ' CE2' ' A' ' 18' ' ' PHE . 7.8 p30 -121.81 -34.92 3.29 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.312 -0.867 . . . . 0.0 109.942 179.662 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . 0.57 ' CE1' ' HB2' ' A' ' 29' ' ' ARG . 3.3 p90 -164.77 154.25 13.3 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.327 -0.858 . . . . 0.0 110.051 179.804 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . 0.458 ' O ' ' HB3' ' A' ' 20' ' ' LYS . . . -155.04 -162.77 11.49 Favored Glycine 0 N--CA 1.491 2.301 0 N-CA-C 109.391 -1.484 . . . . 0.0 109.391 179.997 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.458 ' HB3' ' O ' ' A' ' 19' ' ' GLY . 0.0 OUTLIER 178.45 165.7 0.8 Allowed 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.214 -1.168 . . . . 0.0 110.19 179.974 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . 0.461 ' HA ' ' O ' ' A' ' 25' ' ' SER . 39.3 t -83.0 145.67 29.19 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.2 -0.937 . . . . 0.0 109.968 179.839 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.431 ' O ' ' C ' ' A' ' 23' ' ' ARG . 92.5 t -138.47 126.46 29.08 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.597 0 O-C-N 121.197 -0.939 . . . . 0.0 110.393 -179.915 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . 0.431 ' C ' ' O ' ' A' ' 22' ' ' VAL . 3.0 ttp180 42.15 39.74 1.48 Allowed 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.259 -0.9 . . . . 0.0 110.149 -179.989 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 79.91 31.55 39.18 Favored Glycine 0 N--CA 1.49 2.281 0 N-CA-C 109.318 -1.513 . . . . 0.0 109.318 -179.879 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' SER . . . . . 0.461 ' O ' ' HA ' ' A' ' 21' ' ' CYS . 44.2 m -128.63 -164.19 1.36 Allowed 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.281 -1.129 . . . . 0.0 110.025 179.967 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 7.3 t -153.11 97.33 2.17 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.274 -0.891 . . . . 0.0 109.979 179.951 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.431 ' O ' ' SG ' ' A' ' 28' ' ' CYS . 14.5 mm-40 -106.67 164.26 12.23 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.294 -0.879 . . . . 0.0 110.522 -179.792 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . 0.431 ' SG ' ' O ' ' A' ' 27' ' ' GLN . 81.0 m -149.5 161.58 41.83 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.357 -0.84 . . . . 0.0 109.843 179.891 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . 0.57 ' HB2' ' CE1' ' A' ' 18' ' ' PHE . 14.2 mmm180 -123.28 164.35 18.95 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.156 -0.965 . . . . 0.0 110.328 -179.888 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.472 ' C ' ' ND2' ' A' ' 17' ' ' ASN . 59.4 mtp180 . . . . . 0 N--CA 1.492 1.631 0 O-C-N 121.241 -0.912 . . . . 0.0 110.065 179.855 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . 0.417 ' O ' ' C ' ' A' ' 3' ' ' ASN . 21.4 p . . . . . 0 N--CA 1.491 1.575 0 CA-C-O 121.195 0.521 . . . . 0.0 110.296 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 3' ' ' ASN . . . . . 0.442 ' O ' ' HB2' ' A' ' 7' ' ' CYS . 3.3 m-20 -42.93 149.66 0.19 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.221 -0.924 . . . . 0.0 110.19 -179.927 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 19.7 m-20 -68.55 -33.19 73.67 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.233 -0.917 . . . . 0.0 110.246 179.983 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 2.1 mtp180 -72.22 -41.57 66.74 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.245 -0.909 . . . . 0.0 110.177 179.97 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -79.92 3.16 20.77 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.239 -0.913 . . . . 0.0 110.196 179.879 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . 0.442 ' HB2' ' O ' ' A' ' 3' ' ' ASN . 7.0 t -107.97 -30.46 8.45 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.182 -0.949 . . . . 0.0 110.227 -179.923 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -93.46 -43.33 8.79 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.216 -0.928 . . . . 0.0 110.186 -179.839 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 47.3 mt -56.37 -49.61 73.92 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.214 -0.929 . . . . 0.0 110.298 -179.787 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 56.8 t0 -64.43 -45.94 85.35 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.261 -0.899 . . . . 0.0 110.289 -179.838 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.435 ' O ' ' HB2' ' A' ' 14' ' ' LYS . 0.5 OUTLIER -66.21 -32.98 74.73 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.315 -0.866 . . . . 0.0 110.184 -179.896 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 24.2 mt -63.41 -39.36 85.02 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.547 0 O-C-N 121.19 -0.944 . . . . 0.0 109.373 179.616 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 4.6 ttm -71.18 -27.62 63.65 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.364 -0.835 . . . . 0.0 109.397 179.274 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . 0.435 ' HB2' ' O ' ' A' ' 11' ' ' CYS . 2.7 mmpt? -63.47 -35.6 80.98 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.411 -0.806 . . . . 0.0 110.094 179.61 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 133.27 2.02 3.81 Favored Glycine 0 N--CA 1.491 2.34 0 N-CA-C 110.141 -1.184 . . . . 0.0 110.141 179.875 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' TYR . . . . . 0.483 ' HA ' ' CG ' ' A' ' 30' ' ' ARG . 17.8 m-85 -85.86 -167.58 1.91 Allowed 'General case' 0 N--CA 1.49 1.563 0 O-C-N 120.915 -1.344 . . . . 0.0 110.145 179.919 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . 0.573 ' HB3' ' CD2' ' A' ' 18' ' ' PHE . 0.7 OUTLIER -112.78 -62.52 1.57 Allowed 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.331 -0.856 . . . . 0.0 109.944 179.713 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . 0.573 ' CD2' ' HB3' ' A' ' 17' ' ' ASN . 7.5 p90 -143.71 151.66 40.32 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.274 -0.892 . . . . 0.0 110.142 179.597 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . 0.5 ' CA ' ' HA ' ' A' ' 28' ' ' CYS . . . -149.52 -164.6 11.79 Favored Glycine 0 N--CA 1.49 2.26 0 N-CA-C 109.501 -1.44 . . . . 0.0 109.501 -179.994 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.412 ' HB3' ' O ' ' A' ' 19' ' ' GLY . 0.0 OUTLIER -178.42 178.56 0.85 Allowed 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.226 -1.161 . . . . 0.0 110.111 179.972 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . 0.444 ' HA ' ' O ' ' A' ' 25' ' ' SER . 50.8 t -83.41 152.94 24.77 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.206 -0.934 . . . . 0.0 110.111 179.99 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.537 ' CG2' ' HB2' ' A' ' 27' ' ' GLN . 46.8 t -127.6 69.85 0.38 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.593 0 O-C-N 121.235 -0.916 . . . . 0.0 110.396 -179.994 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . 0.429 ' CB ' ' O ' ' A' ' 22' ' ' VAL . 0.4 OUTLIER 66.13 50.14 1.44 Allowed 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.275 -0.89 . . . . 0.0 110.368 179.849 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 94.53 16.95 40.83 Favored Glycine 0 N--CA 1.491 2.301 0 N-CA-C 109.674 -1.37 . . . . 0.0 109.674 179.857 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' SER . . . . . 0.444 ' O ' ' HA ' ' A' ' 21' ' ' CYS . 0.6 OUTLIER -133.49 -166.32 1.76 Allowed 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.1 -1.235 . . . . 0.0 110.154 179.922 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 0.3 OUTLIER -148.36 105.49 3.62 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.154 -0.966 . . . . 0.0 110.27 -179.973 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.537 ' HB2' ' CG2' ' A' ' 22' ' ' VAL . 3.2 mm100 -105.89 179.34 4.3 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.17 -0.956 . . . . 0.0 110.277 179.927 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . 0.5 ' HA ' ' CA ' ' A' ' 19' ' ' GLY . 66.4 m -151.9 164.76 36.44 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.348 -0.845 . . . . 0.0 109.929 179.817 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . 0.489 ' CB ' ' CE1' ' A' ' 18' ' ' PHE . 0.0 OUTLIER -142.97 133.04 24.32 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.055 -1.028 . . . . 0.0 110.47 179.975 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.483 ' CG ' ' HA ' ' A' ' 16' ' ' TYR . 9.4 mtm180 . . . . . 0 N--CA 1.49 1.547 0 O-C-N 121.357 -0.839 . . . . 0.0 110.253 179.988 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . 0.435 ' O ' ' SG ' ' A' ' 2' ' ' CYS . 32.0 p . . . . . 0 N--CA 1.491 1.588 0 CA-C-O 121.226 0.536 . . . . 0.0 110.246 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 3' ' ' ASN . . . . . 0.44 ' O ' ' SG ' ' A' ' 7' ' ' CYS . 0.1 OUTLIER -88.11 146.01 25.65 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.242 -0.911 . . . . 0.0 110.161 -179.982 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 2.4 p30 -69.07 -41.52 77.44 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.279 -0.888 . . . . 0.0 110.369 -179.988 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.81 -33.8 66.44 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.079 -1.013 . . . . 0.0 110.184 179.978 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 14.7 t0 -78.54 -11.03 59.94 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.259 -0.901 . . . . 0.0 109.743 179.894 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . 0.44 ' SG ' ' O ' ' A' ' 3' ' ' ASN . 19.3 m -93.5 -42.34 9.29 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.347 -0.846 . . . . 0.0 109.606 179.418 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 6.7 p -67.21 -37.52 83.77 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.346 -0.846 . . . . 0.0 109.912 179.669 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . 0.463 ' O ' ' HB2' ' A' ' 13' ' ' MET . 18.5 mt -66.38 -25.71 66.91 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.296 -0.877 . . . . 0.0 110.235 179.854 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -75.27 -47.01 29.99 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.296 -0.878 . . . . 0.0 110.392 -179.775 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.468 ' O ' ' HB2' ' A' ' 16' ' ' TYR . 30.7 m -67.06 -44.22 80.7 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.286 -0.884 . . . . 0.0 110.472 -179.668 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 31.8 mt -63.36 -38.61 82.61 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.654 0 O-C-N 121.188 -0.945 . . . . 0.0 110.457 -179.721 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' MET . . . . . 0.463 ' HB2' ' O ' ' A' ' 9' ' ' LEU . 1.9 tpp -65.31 -46.64 79.55 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.223 -0.923 . . . . 0.0 110.246 179.956 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 6.4 mtpt -63.01 -31.43 72.56 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.209 -0.932 . . . . 0.0 110.328 -179.889 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 139.67 -7.48 3.03 Favored Glycine 0 N--CA 1.49 2.254 0 N-CA-C 109.804 -1.318 . . . . 0.0 109.804 179.963 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' TYR . . . . . 0.468 ' HB2' ' O ' ' A' ' 11' ' ' CYS . 99.1 m-85 -76.73 -171.42 1.89 Allowed 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.209 -1.171 . . . . 0.0 110.092 179.999 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . 0.455 ' HB3' ' CD2' ' A' ' 18' ' ' PHE . 0.1 OUTLIER -118.24 -42.56 2.78 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.082 -1.012 . . . . 0.0 110.521 -179.749 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . 0.455 ' CD2' ' HB3' ' A' ' 17' ' ' ASN . 2.9 p90 -159.81 158.53 31.23 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.091 -1.006 . . . . 0.0 110.549 -179.885 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . 0.458 ' HA3' ' O ' ' A' ' 27' ' ' GLN . . . -144.47 -148.66 4.9 Favored Glycine 0 N--CA 1.491 2.339 0 N-CA-C 109.42 -1.472 . . . . 0.0 109.42 179.948 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.448 ' O ' ' HA ' ' A' ' 26' ' ' CYS . 0.3 OUTLIER -176.12 168.93 2.87 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.231 -1.158 . . . . 0.0 110.253 179.97 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . 0.45 ' HA ' ' SG ' ' A' ' 26' ' ' CYS . 1.2 m -87.62 142.19 28.04 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.351 -0.843 . . . . 0.0 110.166 -179.92 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 22.1 t -131.98 76.57 0.48 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.7 0 O-C-N 121.35 -0.843 . . . . 0.0 110.145 179.897 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 2.3 mtm-85 60.26 77.22 0.33 Allowed 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.335 -0.853 . . . . 0.0 110.243 179.98 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 62.8 11.81 38.62 Favored Glycine 0 N--CA 1.49 2.278 0 N-CA-C 109.578 -1.409 . . . . 0.0 109.578 179.979 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -130.33 176.34 8.21 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.221 -1.164 . . . . 0.0 109.926 179.877 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . 0.45 ' SG ' ' HA ' ' A' ' 21' ' ' CYS . 0.5 OUTLIER -154.08 132.26 11.84 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.172 -0.955 . . . . 0.0 110.204 -179.972 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.458 ' O ' ' HA3' ' A' ' 19' ' ' GLY . 2.5 mm100 -120.13 174.81 6.26 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.289 -0.882 . . . . 0.0 110.409 -179.885 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . 0.438 ' HB3' ' HB3' ' A' ' 11' ' ' CYS . 56.5 m -126.96 144.31 51.04 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.367 -0.833 . . . . 0.0 110.163 179.919 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 17.1 mmt180 -122.6 148.49 45.17 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.251 -0.905 . . . . 0.0 110.258 -179.925 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.659 0 O-C-N 121.323 -0.861 . . . . 0.0 110.222 179.996 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 17.9 p . . . . . 0 N--CA 1.492 1.636 0 CA-C-O 121.291 0.567 . . . . 0.0 110.254 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 35.0 m120 -117.55 133.58 55.8 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.231 -0.918 . . . . 0.0 110.122 179.978 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 4' ' ' ASP . . . . . 0.459 ' N ' ' OD1' ' A' ' 4' ' ' ASP . 0.9 OUTLIER -61.85 -30.41 70.83 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.262 -0.899 . . . . 0.0 110.224 179.95 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.08 -29.55 64.23 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.255 -0.903 . . . . 0.0 110.089 179.904 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -79.47 -14.36 58.96 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.297 -0.877 . . . . 0.0 110.126 179.869 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -96.97 -25.15 15.49 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.291 -0.881 . . . . 0.0 109.888 179.863 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' SER . . . . . 0.459 ' OG ' ' O ' ' A' ' 4' ' ' ASP . 0.1 OUTLIER -82.82 -43.78 16.26 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.339 -0.85 . . . . 0.0 110.083 179.846 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -62.37 -49.61 74.86 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.267 -0.896 . . . . 0.0 110.087 179.818 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -62.47 -27.08 68.88 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.26 -0.9 . . . . 0.0 109.638 179.681 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.54 ' O ' ' N ' ' A' ' 16' ' ' TYR . 0.1 OUTLIER -66.77 -46.12 76.34 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.395 -0.816 . . . . 0.0 109.641 179.428 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 89.4 mt -75.49 -33.34 27.02 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.502 0 O-C-N 121.339 -0.85 . . . . 0.0 110.2 179.971 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 1.7 ttt -69.0 -52.92 23.78 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.121 -0.987 . . . . 0.0 110.226 -179.989 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 4.1 mttt -60.8 -30.51 70.11 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.321 -0.862 . . . . 0.0 110.344 -179.977 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 122.68 14.55 4.26 Favored Glycine 0 N--CA 1.491 2.365 0 N-CA-C 109.756 -1.337 . . . . 0.0 109.756 179.944 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' TYR . . . . . 0.54 ' N ' ' O ' ' A' ' 11' ' ' CYS . 48.2 m-85 -92.53 -179.98 5.34 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.246 -1.15 . . . . 0.0 110.08 179.879 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . 0.47 ' HB2' ' HA ' ' A' ' 30' ' ' ARG . 6.7 m120 -101.56 -52.1 3.3 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.094 -1.004 . . . . 0.0 110.486 -179.792 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . 0.517 ' CE2' ' HB2' ' A' ' 29' ' ' ARG . 33.2 p90 -146.91 163.19 36.92 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.103 -0.998 . . . . 0.0 110.567 -179.872 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -138.38 -170.45 11.86 Favored Glycine 0 N--CA 1.491 2.316 0 N-CA-C 109.375 -1.49 . . . . 0.0 109.375 179.944 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -170.52 164.61 8.49 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.216 -1.167 . . . . 0.0 110.2 179.916 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . 0.462 ' HA ' ' O ' ' A' ' 25' ' ' SER . 0.8 OUTLIER -90.99 137.72 32.15 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.219 -0.926 . . . . 0.0 110.113 179.943 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.52 ' HB ' ' CB ' ' A' ' 25' ' ' SER . 57.3 t -110.07 76.26 0.42 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.641 0 O-C-N 121.234 -0.916 . . . . 0.0 110.173 -179.98 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 13.6 mtm180 54.37 54.16 9.82 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.229 -0.92 . . . . 0.0 110.208 179.894 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 93.9 15.41 49.09 Favored Glycine 0 N--CA 1.49 2.3 0 N-CA-C 109.753 -1.339 . . . . 0.0 109.753 179.957 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' SER . . . . . 0.52 ' CB ' ' HB ' ' A' ' 22' ' ' VAL . 0.5 OUTLIER -127.36 -176.15 3.65 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.226 -1.161 . . . . 0.0 110.213 -179.946 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 8.1 t -143.56 114.17 7.57 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.207 -0.933 . . . . 0.0 110.175 -179.988 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 21.4 mm100 -117.45 157.6 25.94 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.269 -0.894 . . . . 0.0 110.132 179.961 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -124.32 133.23 53.52 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.325 -0.86 . . . . 0.0 110.084 -179.982 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . 0.517 ' HB2' ' CE2' ' A' ' 18' ' ' PHE . 3.4 mtm180 -123.37 163.6 20.48 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.162 -0.961 . . . . 0.0 110.383 -179.941 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.47 ' HA ' ' HB2' ' A' ' 17' ' ' ASN . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.618 0 O-C-N 121.327 -0.858 . . . . 0.0 110.118 179.955 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . 0.443 ' O ' ' CB ' ' A' ' 3' ' ' ASN . 18.3 p . . . . . 0 N--CA 1.49 1.542 0 CA-C-O 121.262 0.553 . . . . 0.0 110.244 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 3' ' ' ASN . . . . . 0.455 ' O ' ' CB ' ' A' ' 7' ' ' CYS . 17.3 t-20 64.9 93.42 0.06 Allowed 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.24 -0.913 . . . . 0.0 110.158 -179.801 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 93.0 m-20 -57.35 -35.78 70.37 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.26 -0.9 . . . . 0.0 110.359 -179.908 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . 0.455 ' O ' ' HB2' ' A' ' 9' ' ' LEU . 1.3 ttm-85 -62.6 -57.26 11.72 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.081 -1.012 . . . . 0.0 110.161 -179.935 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -79.89 6.63 10.63 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.279 -0.888 . . . . 0.0 110.211 179.916 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . 0.455 ' CB ' ' O ' ' A' ' 3' ' ' ASN . 39.5 t -107.22 -34.0 7.25 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.268 -0.895 . . . . 0.0 110.232 -179.946 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' SER . . . . . 0.465 ' O ' HG13 ' A' ' 12' ' ' ILE . 19.4 m -93.96 -42.2 9.18 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.293 -0.879 . . . . 0.0 110.434 -179.777 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . 0.455 ' HB2' ' O ' ' A' ' 5' ' ' ARG . 0.2 OUTLIER -53.32 -49.24 67.48 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.187 -0.946 . . . . 0.0 110.362 -179.71 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -62.87 -46.73 86.49 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.152 -0.967 . . . . 0.0 110.158 179.914 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -66.64 -38.96 87.96 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.197 -0.939 . . . . 0.0 110.179 -179.885 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . 0.465 HG13 ' O ' ' A' ' 8' ' ' SER . 14.2 mt -64.65 -33.58 64.13 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.611 0 O-C-N 121.232 -0.918 . . . . 0.0 110.149 179.907 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 7.3 ttm -73.85 -30.17 62.52 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.265 -0.897 . . . . 0.0 110.098 179.906 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 3.9 mtpp -59.64 -30.44 68.72 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.298 -0.876 . . . . 0.0 110.307 -179.978 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 138.98 -6.32 3.13 Favored Glycine 0 N--CA 1.49 2.298 0 N-CA-C 109.829 -1.308 . . . . 0.0 109.829 179.978 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 94.9 m-85 -77.15 177.37 7.89 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.174 -1.192 . . . . 0.0 110.202 179.988 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . 0.467 ' HB3' ' CD2' ' A' ' 18' ' ' PHE . 34.2 t-20 -102.81 -59.52 1.69 Allowed 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.207 -0.933 . . . . 0.0 110.367 179.994 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . 0.507 ' CE1' ' CB ' ' A' ' 29' ' ' ARG . 17.1 p90 -140.82 161.81 36.93 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.232 -0.918 . . . . 0.0 110.309 179.974 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . 0.452 ' HA2' ' HA ' ' A' ' 28' ' ' CYS . . . -148.04 -160.6 9.06 Favored Glycine 0 N--CA 1.49 2.285 0 N-CA-C 109.5 -1.44 . . . . 0.0 109.5 -179.927 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -177.63 170.64 1.98 Allowed 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.226 -1.161 . . . . 0.0 110.178 179.935 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . 0.45 ' O ' HG21 ' A' ' 22' ' ' VAL . 4.0 t -93.49 155.11 17.52 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.284 -0.885 . . . . 0.0 110.217 -179.936 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.45 HG21 ' O ' ' A' ' 21' ' ' CYS . 98.0 t -149.79 94.49 0.18 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.64 0 O-C-N 121.29 -0.881 . . . . 0.0 110.115 179.933 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER 50.62 65.79 1.35 Allowed 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.26 -0.9 . . . . 0.0 110.239 179.999 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 61.33 37.71 94.51 Favored Glycine 0 N--CA 1.491 2.32 0 N-CA-C 109.603 -1.399 . . . . 0.0 109.603 179.986 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' SER . . . . . 0.422 ' HB3' ' HB ' ' A' ' 22' ' ' VAL . 2.4 t -134.94 170.8 15.33 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.322 -1.104 . . . . 0.0 110.189 179.97 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 1.3 m -134.61 102.57 5.34 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.282 -0.886 . . . . 0.0 110.07 179.888 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 10.4 mm100 -105.24 164.82 11.55 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.399 -0.813 . . . . 0.0 110.318 -179.718 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . 0.452 ' HA ' ' HA2' ' A' ' 19' ' ' GLY . 59.4 m -145.79 158.03 43.88 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.301 -0.875 . . . . 0.0 110.294 -179.88 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . 0.507 ' CB ' ' CE1' ' A' ' 18' ' ' PHE . 0.0 OUTLIER -138.37 149.13 45.26 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.306 -0.871 . . . . 0.0 110.159 179.927 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.587 0 O-C-N 121.315 -0.865 . . . . 0.0 110.266 179.977 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . 0.449 ' O ' ' O ' ' A' ' 3' ' ' ASN . 19.4 p . . . . . 0 N--CA 1.491 1.607 0 CA-C-O 121.267 0.556 . . . . 0.0 110.2 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 3' ' ' ASN . . . . . 0.449 ' O ' ' O ' ' A' ' 2' ' ' CYS . 2.1 t-20 59.92 124.02 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.256 -0.903 . . . . 0.0 110.208 -179.99 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 4' ' ' ASP . . . . . 0.45 ' OD1' ' HB2' ' A' ' 21' ' ' CYS . 0.3 OUTLIER -66.26 -28.63 68.86 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.276 -0.89 . . . . 0.0 110.239 -179.914 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 62.1 ttt180 -68.16 -44.96 74.83 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.26 -0.9 . . . . 0.0 110.149 -179.903 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 74.6 m-20 -79.4 -17.16 54.94 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.223 -0.923 . . . . 0.0 110.079 179.974 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . 0.415 ' SG ' ' O ' ' A' ' 20' ' ' LYS . 14.7 t -82.73 -33.31 27.56 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.376 -0.827 . . . . 0.0 110.083 179.846 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' SER . . . . . 0.454 ' HA ' ' HA3' ' A' ' 19' ' ' GLY . 34.8 p -80.94 -50.11 10.14 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.359 -0.838 . . . . 0.0 110.286 -179.909 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -56.01 -22.53 27.59 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.165 -0.96 . . . . 0.0 110.064 179.928 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -73.96 -47.02 40.39 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.309 -0.87 . . . . 0.0 110.125 179.934 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.462 ' O ' ' HB2' ' A' ' 16' ' ' TYR . 21.0 m -67.22 -44.73 78.8 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.184 -0.948 . . . . 0.0 109.989 179.918 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . 0.446 HD11 ' O ' ' A' ' 8' ' ' SER . 2.5 mt -63.74 -30.48 50.03 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.601 0 O-C-N 121.239 -0.913 . . . . 0.0 110.069 179.844 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -74.98 -28.25 60.48 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.223 -0.923 . . . . 0.0 110.126 179.82 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 3.2 mtpp -82.73 -18.07 42.09 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.327 -0.858 . . . . 0.0 110.339 179.973 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 117.65 8.87 10.6 Favored Glycine 0 N--CA 1.491 2.362 0 N-CA-C 109.635 -1.386 . . . . 0.0 109.635 179.836 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' TYR . . . . . 0.462 ' HB2' ' O ' ' A' ' 11' ' ' CYS . 40.4 m-85 -83.77 -172.5 4.19 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.18 -1.188 . . . . 0.0 110.139 179.965 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . 0.56 ' HB3' ' CE1' ' A' ' 18' ' ' PHE . 0.4 OUTLIER -133.05 0.49 3.45 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.219 -0.925 . . . . 0.0 110.475 -179.819 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . 0.56 ' CE1' ' HB3' ' A' ' 17' ' ' ASN . 5.9 m-85 -141.37 162.49 35.36 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.137 -0.977 . . . . 0.0 110.414 -179.948 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . 0.454 ' HA3' ' HA ' ' A' ' 8' ' ' SER . . . -156.85 121.4 1.07 Allowed Glycine 0 N--CA 1.49 2.239 0 N-CA-C 109.355 -1.498 . . . . 0.0 109.355 179.904 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.415 ' O ' ' SG ' ' A' ' 7' ' ' CYS . 23.1 ttpt -134.64 149.74 50.59 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.155 -1.203 . . . . 0.0 110.424 -179.787 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . 0.45 ' HB2' ' OD1' ' A' ' 4' ' ' ASP . 0.1 OUTLIER -105.57 126.54 52.25 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.357 -0.84 . . . . 0.0 110.042 179.829 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 59.0 t -145.59 139.14 21.48 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.637 0 O-C-N 121.291 -0.881 . . . . 0.0 110.26 -179.897 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 42.2 mtm180 47.67 53.73 10.83 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.27 -0.893 . . . . 0.0 110.261 179.87 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 51.7 29.49 25.71 Favored Glycine 0 N--CA 1.49 2.259 0 N-CA-C 109.652 -1.379 . . . . 0.0 109.652 179.912 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 8.4 t -131.09 -170.61 2.4 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.227 -1.161 . . . . 0.0 110.235 -179.952 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 53.3 t -143.31 140.73 30.72 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.292 -0.88 . . . . 0.0 110.096 -179.976 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 30.3 mt-30 -120.28 141.78 49.68 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.127 -0.983 . . . . 0.0 110.619 -179.813 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 43.4 m -124.22 150.57 45.11 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.355 -0.841 . . . . 0.0 109.886 179.602 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . 0.453 ' HB3' ' CD1' ' A' ' 18' ' ' PHE . 0.0 OUTLIER -136.38 161.12 36.68 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.131 -0.981 . . . . 0.0 110.227 -179.91 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.406 ' HG2' ' HA ' ' A' ' 16' ' ' TYR . 0.2 OUTLIER . . . . . 0 N--CA 1.493 1.691 0 O-C-N 121.187 -0.945 . . . . 0.0 110.002 179.927 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . 0.453 ' O ' ' SG ' ' A' ' 2' ' ' CYS . 10.6 t . . . . . 0 N--CA 1.491 1.597 0 CA-C-O 121.273 0.558 . . . . 0.0 110.088 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -79.11 134.08 36.74 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.235 -0.916 . . . . 0.0 110.228 179.988 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 4' ' ' ASP . . . . . 0.508 ' N ' ' OD1' ' A' ' 4' ' ' ASP . 8.6 p-10 -57.01 -41.3 78.24 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.235 -0.916 . . . . 0.0 110.208 179.9 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 7.0 tpt180 -62.25 -42.46 99.35 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.24 -0.912 . . . . 0.0 109.925 179.942 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -79.34 -17.04 55.34 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.365 -0.834 . . . . 0.0 109.741 179.608 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . 0.454 ' O ' ' SG ' ' A' ' 11' ' ' CYS . 0.9 OUTLIER -78.0 -33.02 51.48 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.43 -0.794 . . . . 0.0 109.874 179.618 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' SER . . . . . 0.459 ' O ' HG13 ' A' ' 12' ' ' ILE . 0.3 OUTLIER -82.04 -43.99 17.21 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.393 -0.817 . . . . 0.0 110.152 179.734 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.4 mt -55.32 -46.94 76.31 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.262 -0.899 . . . . 0.0 110.193 179.943 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 19.9 t0 -63.77 -37.37 87.1 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.274 -0.891 . . . . 0.0 110.168 179.977 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.454 ' SG ' ' O ' ' A' ' 7' ' ' CYS . 82.4 m -66.32 -41.07 90.19 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.26 -0.9 . . . . 0.0 109.849 179.86 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . 0.459 HG13 ' O ' ' A' ' 8' ' ' SER . 81.4 mt -63.83 -35.65 73.92 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.587 0 O-C-N 121.322 -0.861 . . . . 0.0 109.901 179.822 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -70.72 -28.66 64.89 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.275 -0.891 . . . . 0.0 109.83 179.769 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.29 -23.93 46.94 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.313 -0.867 . . . . 0.0 110.132 179.889 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 124.52 -3.15 8.8 Favored Glycine 0 N--CA 1.491 2.348 0 N-CA-C 109.592 -1.403 . . . . 0.0 109.592 179.957 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' TYR . . . . . 0.417 ' CD2' ' CB ' ' A' ' 28' ' ' CYS . 48.1 m-85 -86.96 -175.71 5.46 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.126 -1.22 . . . . 0.0 110.334 -179.955 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 28.1 m-80 -109.18 -55.01 2.47 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.265 -0.897 . . . . 0.0 110.223 -179.979 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . 0.578 ' CE2' ' HB2' ' A' ' 29' ' ' ARG . 8.2 p90 -129.62 170.15 14.14 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.154 -0.967 . . . . 0.0 110.408 179.958 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -140.15 -178.38 16.86 Favored Glycine 0 N--CA 1.49 2.297 0 N-CA-C 109.405 -1.478 . . . . 0.0 109.405 179.952 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -164.62 160.9 20.58 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.227 -1.161 . . . . 0.0 110.323 179.96 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . 0.435 ' HA ' ' O ' ' A' ' 25' ' ' SER . 1.8 t -92.94 141.14 28.74 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.235 -0.916 . . . . 0.0 110.351 -179.851 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.452 ' O ' ' HB2' ' A' ' 25' ' ' SER . 72.8 t -147.42 123.85 2.91 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.614 0 O-C-N 121.301 -0.874 . . . . 0.0 110.058 179.894 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . 0.444 ' HB2' ' O ' ' A' ' 22' ' ' VAL . 3.7 mmm-85 55.43 35.79 25.77 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.275 -0.89 . . . . 0.0 110.13 -179.904 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 73.17 29.19 64.88 Favored Glycine 0 N--CA 1.489 2.218 0 N-CA-C 109.5 -1.44 . . . . 0.0 109.5 -179.925 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' SER . . . . . 0.452 ' HB2' ' O ' ' A' ' 22' ' ' VAL . 69.7 m -129.3 -171.59 2.53 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.283 -1.128 . . . . 0.0 110.307 179.999 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 47.3 t -141.53 121.41 13.59 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.346 -0.846 . . . . 0.0 110.181 179.956 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 4.8 mm-40 -120.21 174.74 6.31 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.171 -0.956 . . . . 0.0 110.458 -179.915 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . 0.417 ' CB ' ' CD2' ' A' ' 16' ' ' TYR . 73.1 m -125.05 149.58 47.65 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.323 -0.861 . . . . 0.0 110.085 179.886 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . 0.578 ' HB2' ' CE2' ' A' ' 18' ' ' PHE . 0.7 OUTLIER -136.42 146.03 45.94 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.216 -0.928 . . . . 0.0 110.258 -179.916 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.491 1.624 0 O-C-N 121.259 -0.901 . . . . 0.0 110.241 -179.98 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . 0.434 ' O ' ' SG ' ' A' ' 2' ' ' CYS . 15.8 p . . . . . 0 N--CA 1.492 1.648 0 CA-C-O 121.246 0.546 . . . . 0.0 110.236 . . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 3' ' ' ASN . . . . . 0.443 ' O ' ' HB2' ' A' ' 7' ' ' CYS . 20.4 t-20 -100.54 125.14 46.86 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.3 -0.875 . . . . 0.0 110.253 -179.945 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -66.58 -34.37 77.74 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.197 -0.939 . . . . 0.0 110.38 179.976 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . 0.453 ' O ' ' HB2' ' A' ' 9' ' ' LEU . 1.8 mmm-85 -62.15 -54.47 40.69 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.159 -0.963 . . . . 0.0 110.125 179.951 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -79.5 2.22 22.85 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.239 -0.913 . . . . 0.0 110.045 179.758 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . 0.443 ' HB2' ' O ' ' A' ' 3' ' ' ASN . 14.8 t -95.3 -40.44 9.54 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.254 -0.904 . . . . 0.0 109.997 179.97 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 26.8 t -86.42 -35.39 19.75 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.376 -0.828 . . . . 0.0 110.045 179.875 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . 0.453 ' HB2' ' O ' ' A' ' 5' ' ' ARG . 0.6 OUTLIER -55.22 -47.53 75.18 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.208 -0.932 . . . . 0.0 110.008 179.944 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -65.13 -35.02 79.79 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.321 -0.862 . . . . 0.0 110.122 179.912 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 1.5 t -70.45 -39.37 74.36 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.214 -0.929 . . . . 0.0 110.131 179.968 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 39.8 mt -63.55 -35.44 72.64 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.579 0 O-C-N 121.2 -0.938 . . . . 0.0 109.809 179.703 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -77.77 -27.57 50.31 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.382 -0.824 . . . . 0.0 109.754 179.39 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.51 -27.82 65.51 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.354 -0.841 . . . . 0.0 109.958 179.743 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 121.89 10.82 6.15 Favored Glycine 0 N--CA 1.489 2.192 0 N-CA-C 109.669 -1.373 . . . . 0.0 109.669 179.983 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 60.6 m-85 -93.44 -161.73 0.87 Allowed 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.301 -1.117 . . . . 0.0 110.327 -179.958 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . 0.487 ' HB3' ' CD2' ' A' ' 18' ' ' PHE . 1.8 t-20 -119.76 -51.44 2.26 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.264 -0.898 . . . . 0.0 110.36 -179.882 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . 0.565 ' CE1' ' HB2' ' A' ' 29' ' ' ARG . 6.5 p90 -161.84 156.66 22.93 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.277 -0.889 . . . . 0.0 110.154 -179.817 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . 0.448 ' HA2' ' HA ' ' A' ' 28' ' ' CYS . . . -127.88 -149.69 7.15 Favored Glycine 0 N--CA 1.491 2.363 0 N-CA-C 109.684 -1.366 . . . . 0.0 109.684 179.946 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.469 ' O ' ' HA ' ' A' ' 26' ' ' CYS . 9.7 tttp -175.26 152.98 1.48 Allowed 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.233 -1.157 . . . . 0.0 110.177 179.962 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 0.3 OUTLIER -90.84 129.58 36.88 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.274 -0.891 . . . . 0.0 110.312 179.957 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.446 ' O ' ' N ' ' A' ' 24' ' ' GLY . 84.5 t -109.72 98.35 6.92 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.613 0 O-C-N 121.242 -0.911 . . . . 0.0 110.07 -179.974 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 59.37 -84.81 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.174 -0.954 . . . . 0.0 110.13 -179.844 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . 0.446 ' N ' ' O ' ' A' ' 22' ' ' VAL . . . -126.05 15.71 6.9 Favored Glycine 0 N--CA 1.49 2.297 0 N-CA-C 109.527 -1.429 . . . . 0.0 109.527 179.887 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -130.87 -163.71 1.35 Allowed 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.264 -1.139 . . . . 0.0 110.076 179.88 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . 0.469 ' HA ' ' O ' ' A' ' 20' ' ' LYS . 0.5 OUTLIER -158.24 132.97 8.33 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.167 -0.958 . . . . 0.0 110.33 179.83 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 10.0 mm100 -108.89 -174.14 2.44 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.353 -0.842 . . . . 0.0 110.301 -179.935 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . 0.448 ' HA ' ' HA2' ' A' ' 19' ' ' GLY . 1.1 m -140.46 153.21 46.18 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.327 -0.858 . . . . 0.0 110.207 -179.994 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . 0.565 ' HB2' ' CE1' ' A' ' 18' ' ' PHE . 4.5 mmt180 -144.04 137.95 28.0 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.309 -0.869 . . . . 0.0 110.286 -179.957 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.656 0 O-C-N 121.23 -0.919 . . . . 0.0 110.147 179.913 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . 0.447 ' SG ' ' O ' ' A' ' 25' ' ' SER . 12.0 p . . . . . 0 N--CA 1.491 1.616 0 CA-C-O 121.255 0.55 . . . . 0.0 110.174 . . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 2.8 m-20 -111.9 133.53 54.04 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.279 -0.888 . . . . 0.0 110.143 -179.937 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -50.75 -34.57 27.72 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.211 -0.931 . . . . 0.0 110.101 179.961 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -65.76 -49.89 66.73 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.254 -0.904 . . . . 0.0 110.084 179.812 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -79.68 0.86 28.62 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.243 -0.911 . . . . 0.0 110.098 179.846 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 11.6 t -100.23 -36.75 9.18 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.184 -0.947 . . . . 0.0 110.169 179.908 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 8' ' ' SER . . . . . 0.459 ' O ' HG13 ' A' ' 12' ' ' ILE . 0.1 OUTLIER -86.57 -35.26 19.58 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.296 -0.878 . . . . 0.0 110.091 179.909 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 2.2 mt -55.52 -55.36 32.83 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.258 -0.901 . . . . 0.0 110.136 179.924 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -62.78 -30.59 71.57 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.321 -0.862 . . . . 0.0 110.016 179.819 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 1.2 m -74.81 -39.48 61.66 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.316 -0.865 . . . . 0.0 110.098 179.856 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . 0.459 HG13 ' O ' ' A' ' 8' ' ' SER . 36.0 mt -63.64 -32.02 55.24 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.581 0 O-C-N 121.337 -0.852 . . . . 0.0 110.006 179.881 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -86.76 -20.24 27.93 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.33 -0.856 . . . . 0.0 110.016 179.826 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.62 -22.08 51.33 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.394 -0.816 . . . . 0.0 110.155 179.928 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 126.04 5.42 6.25 Favored Glycine 0 N--CA 1.49 2.271 0 N-CA-C 109.642 -1.383 . . . . 0.0 109.642 -179.999 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 78.0 m-85 -94.41 -172.58 2.82 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.199 -1.177 . . . . 0.0 110.129 179.976 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . 0.467 ' HB3' ' CE2' ' A' ' 18' ' ' PHE . 44.1 t30 -139.08 7.05 2.42 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.135 -0.978 . . . . 0.0 110.2 179.907 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . 0.467 ' CE2' ' HB3' ' A' ' 17' ' ' ASN . 49.1 m-85 -143.62 168.97 18.62 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.252 -0.905 . . . . 0.0 110.155 179.946 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . 0.445 ' HA3' ' OG ' ' A' ' 8' ' ' SER . . . -155.73 100.17 0.19 Allowed Glycine 0 N--CA 1.49 2.283 0 N-CA-C 109.434 -1.466 . . . . 0.0 109.434 179.953 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -120.39 137.97 54.01 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.205 -1.174 . . . . 0.0 110.247 -179.806 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -87.32 153.35 21.54 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.214 -0.929 . . . . 0.0 110.191 -179.981 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.477 ' HB ' ' CB ' ' A' ' 25' ' ' SER . 35.8 t -126.57 61.44 0.29 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.56 0 O-C-N 121.247 -0.908 . . . . 0.0 110.167 179.893 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 3.3 mpp_? 60.26 63.86 1.33 Allowed 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.364 -0.835 . . . . 0.0 110.141 -179.808 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 92.15 13.09 58.02 Favored Glycine 0 N--CA 1.49 2.29 0 N-CA-C 109.493 -1.443 . . . . 0.0 109.493 -179.885 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 25' ' ' SER . . . . . 0.477 ' CB ' ' HB ' ' A' ' 22' ' ' VAL . 0.6 OUTLIER -133.28 -175.93 3.97 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.257 -1.143 . . . . 0.0 110.164 179.971 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 12.2 t -150.26 114.87 5.24 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.237 -0.914 . . . . 0.0 110.386 -179.977 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.451 ' O ' ' SG ' ' A' ' 28' ' ' CYS . 2.7 mm100 -114.79 161.5 18.1 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.188 -0.945 . . . . 0.0 110.123 179.844 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . 0.451 ' SG ' ' O ' ' A' ' 27' ' ' GLN . 86.4 m -150.0 -178.45 6.49 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.223 -0.923 . . . . 0.0 110.333 -179.952 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -146.98 163.1 37.3 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.272 -0.892 . . . . 0.0 110.195 -179.986 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.667 0 O-C-N 121.235 -0.915 . . . . 0.0 110.183 179.927 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . 0.465 ' O ' ' HB3' ' A' ' 3' ' ' ASN . 26.6 p . . . . . 0 N--CA 1.492 1.642 0 CA-C-O 121.234 0.54 . . . . 0.0 110.253 . . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 3' ' ' ASN . . . . . 0.465 ' HB3' ' O ' ' A' ' 2' ' ' CYS . 8.9 t-20 62.71 126.24 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.228 -0.92 . . . . 0.0 110.104 -179.743 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -76.11 -18.78 59.02 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.237 -0.914 . . . . 0.0 110.412 -179.776 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -67.85 -55.78 11.64 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.256 -0.903 . . . . 0.0 110.288 -179.814 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 42.9 m-20 -79.33 -6.64 57.19 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.244 -0.91 . . . . 0.0 110.314 -179.799 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 53.1 t -90.28 -42.32 11.05 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.225 -0.922 . . . . 0.0 110.082 179.854 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 3.1 m -78.2 -43.18 29.2 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.266 -0.896 . . . . 0.0 110.174 -179.996 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 40.2 mt -54.61 -47.95 72.79 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.307 -0.871 . . . . 0.0 110.215 -179.893 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . 0.466 ' O ' ' HG3' ' A' ' 14' ' ' LYS . 0.2 OUTLIER -66.6 -33.35 75.46 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.276 -0.89 . . . . 0.0 110.361 179.978 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 7.4 m -68.26 -45.73 72.36 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.24 -0.913 . . . . 0.0 110.369 179.998 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 68.2 mt -68.13 -33.19 59.5 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.645 0 O-C-N 121.228 -0.92 . . . . 0.0 110.351 -179.866 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -67.04 -37.65 84.45 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.193 -0.942 . . . . 0.0 110.427 -179.878 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . 0.466 ' HG3' ' O ' ' A' ' 10' ' ' ASP . 8.3 mttm -63.02 -27.49 69.45 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.243 -0.91 . . . . 0.0 110.325 -179.834 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 133.23 -2.62 4.7 Favored Glycine 0 N--CA 1.491 2.31 0 N-CA-C 109.745 -1.342 . . . . 0.0 109.745 179.958 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 16' ' ' TYR . . . . . 0.4 ' HA ' ' HG2' ' A' ' 30' ' ' ARG . 96.8 m-85 -83.79 179.35 7.6 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.149 -1.207 . . . . 0.0 110.354 -179.859 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . 0.578 ' HB3' ' CD2' ' A' ' 18' ' ' PHE . 1.5 t-20 -103.46 -46.61 4.52 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.347 -0.846 . . . . 0.0 109.875 179.688 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . 0.578 ' CD2' ' HB3' ' A' ' 17' ' ' ASN . 32.6 p90 -154.18 140.09 18.21 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.34 -0.85 . . . . 0.0 110.013 179.643 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . 0.484 ' CA ' ' HA ' ' A' ' 28' ' ' CYS . . . -119.89 -152.03 8.92 Favored Glycine 0 N--CA 1.49 2.242 0 N-CA-C 109.575 -1.41 . . . . 0.0 109.575 -179.97 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -178.36 166.44 1.86 Allowed 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.27 -1.135 . . . . 0.0 110.184 -179.945 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . 0.432 ' HA ' ' O ' ' A' ' 25' ' ' SER . 12.3 t -84.98 142.76 29.39 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.228 -0.92 . . . . 0.0 110.297 -179.938 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.415 ' O ' ' HB2' ' A' ' 23' ' ' ARG . 19.3 t -130.15 88.05 1.07 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.499 0 O-C-N 121.218 -0.926 . . . . 0.0 110.011 179.838 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . 0.415 ' HB2' ' O ' ' A' ' 22' ' ' VAL . 42.5 mtt180 54.23 74.69 0.32 Allowed 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.327 -0.858 . . . . 0.0 110.114 -179.926 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 59.37 28.55 64.79 Favored Glycine 0 N--CA 1.49 2.292 0 N-CA-C 109.521 -1.432 . . . . 0.0 109.521 -179.967 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 25' ' ' SER . . . . . 0.432 ' O ' ' HA ' ' A' ' 21' ' ' CYS . 2.1 m -136.96 176.38 8.77 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.27 -1.135 . . . . 0.0 110.172 -179.979 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 45.9 t -137.23 121.78 18.43 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.222 -0.924 . . . . 0.0 110.312 179.946 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.419 ' O ' ' HA3' ' A' ' 19' ' ' GLY . 1.7 mm-40 -120.03 161.21 21.34 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.278 -0.889 . . . . 0.0 110.14 179.849 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . 0.484 ' HA ' ' CA ' ' A' ' 19' ' ' GLY . 17.9 m -119.79 139.39 52.39 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.341 -0.85 . . . . 0.0 110.03 179.905 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . 0.568 ' HB3' ' CE1' ' A' ' 18' ' ' PHE . 1.1 mtm180 -120.16 143.08 48.4 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.167 -0.958 . . . . 0.0 110.29 -179.989 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.4 ' HG2' ' HA ' ' A' ' 16' ' ' TYR . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.639 0 O-C-N 121.28 -0.888 . . . . 0.0 110.161 179.975 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 13.2 p . . . . . 0 N--CA 1.492 1.636 0 CA-C-O 121.255 0.55 . . . . 0.0 110.161 . . . . . . . . . 0 0 . 1 . 024 nuclear orig core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -116.1 156.42 26.43 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.143 -0.973 . . . . 0.0 110.278 -179.884 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 33.1 m-20 -61.93 -34.64 76.46 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.225 -0.922 . . . . 0.0 109.933 179.732 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 38.2 ttt180 -79.46 -38.18 35.18 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.289 -0.882 . . . . 0.0 109.855 179.737 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 24.9 t0 -79.52 -12.44 59.86 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.346 -0.846 . . . . 0.0 110.088 179.852 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 28.4 t -96.18 -35.32 11.34 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.313 -0.867 . . . . 0.0 110.172 179.982 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 11.5 p -78.02 -36.02 49.12 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.288 -0.882 . . . . 0.0 110.252 -179.89 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 8.4 mt -53.49 -44.56 69.14 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.226 -0.921 . . . . 0.0 110.303 -179.999 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . 0.452 ' O ' ' HG3' ' A' ' 14' ' ' LYS . 19.8 t0 -72.24 -31.92 66.25 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.144 -0.972 . . . . 0.0 110.107 179.817 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.45 ' O ' ' HB2' ' A' ' 16' ' ' TYR . 55.7 m -66.76 -38.19 86.1 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.29 -0.881 . . . . 0.0 110.222 179.987 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 16.0 mt -71.54 -45.32 68.44 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.569 0 O-C-N 121.199 -0.938 . . . . 0.0 110.102 -179.99 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 1.4 ttt -63.79 -29.15 70.39 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.228 -0.92 . . . . 0.0 110.111 179.916 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . 0.452 ' HG3' ' O ' ' A' ' 10' ' ' ASP . 22.6 mttt -68.4 -20.25 64.66 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.359 -0.838 . . . . 0.0 110.153 179.842 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 119.82 -5.14 12.76 Favored Glycine 0 N--CA 1.491 2.323 0 N-CA-C 109.624 -1.39 . . . . 0.0 109.624 179.958 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 16' ' ' TYR . . . . . 0.45 ' HB2' ' O ' ' A' ' 11' ' ' CYS . 58.5 m-85 -86.73 -155.73 0.28 Allowed 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.238 -1.154 . . . . 0.0 110.083 179.96 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -129.2 -65.02 0.88 Allowed 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.117 -0.99 . . . . 0.0 110.259 -179.995 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . 0.531 ' CE1' ' HB3' ' A' ' 29' ' ' ARG . 39.7 p90 -129.11 139.83 51.81 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.272 -0.892 . . . . 0.0 110.301 -179.958 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . 0.462 ' HA3' ' O ' ' A' ' 27' ' ' GLN . . . -121.68 -162.88 11.77 Favored Glycine 0 N--CA 1.49 2.285 0 N-CA-C 109.571 -1.412 . . . . 0.0 109.571 179.997 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -162.31 151.76 15.84 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.35 -1.089 . . . . 0.0 110.198 -179.949 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . 0.429 ' HA ' ' O ' ' A' ' 25' ' ' SER . 0.8 OUTLIER -86.11 140.87 29.83 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.242 -0.911 . . . . 0.0 110.125 179.844 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.5 ' O ' ' CB ' ' A' ' 25' ' ' SER . 15.6 t -136.27 96.41 1.5 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.604 0 O-C-N 121.143 -0.973 . . . . 0.0 110.128 -179.998 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . 0.419 ' O ' ' C ' ' A' ' 24' ' ' GLY . 16.7 mtt180 52.16 85.43 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.192 -0.942 . . . . 0.0 110.144 -179.908 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . 0.419 ' C ' ' O ' ' A' ' 23' ' ' ARG . . . 44.88 33.34 3.51 Favored Glycine 0 N--CA 1.491 2.3 0 N-CA-C 109.362 -1.495 . . . . 0.0 109.362 -179.791 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 25' ' ' SER . . . . . 0.5 ' CB ' ' O ' ' A' ' 22' ' ' VAL . 0.8 OUTLIER -138.03 165.14 27.33 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.237 -1.155 . . . . 0.0 110.15 -179.913 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 24.6 t -134.84 127.62 31.13 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.185 -0.947 . . . . 0.0 110.312 -179.979 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.462 ' O ' ' HA3' ' A' ' 19' ' ' GLY . 27.5 mt-30 -118.85 159.6 23.46 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.339 -0.851 . . . . 0.0 109.978 179.82 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 61.9 m -120.67 136.0 54.96 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.196 -0.94 . . . . 0.0 110.26 -179.866 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . 0.531 ' HB3' ' CE1' ' A' ' 18' ' ' PHE . 5.8 mmt180 -124.3 136.46 54.14 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.312 -0.867 . . . . 0.0 110.285 -179.968 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.493 1.68 0 O-C-N 121.383 -0.823 . . . . 0.0 110.182 179.901 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 2' ' ' CYS . . . . . 0.446 ' O ' ' HB2' ' A' ' 3' ' ' ASN . 28.5 p . . . . . 0 N--CA 1.491 1.596 0 CA-C-O 121.234 0.54 . . . . 0.0 110.307 . . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 3' ' ' ASN . . . . . 0.446 ' HB2' ' O ' ' A' ' 2' ' ' CYS . 29.5 m-20 57.97 98.2 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.283 -0.885 . . . . 0.0 110.163 -179.919 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -69.47 -38.2 77.62 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.21 -0.931 . . . . 0.0 110.307 -179.928 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.85 -39.85 95.19 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.262 -0.899 . . . . 0.0 110.308 -179.98 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -79.68 -21.94 44.07 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.283 -0.886 . . . . 0.0 110.332 -179.9 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 8.6 t -78.41 -34.4 48.08 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.233 -0.917 . . . . 0.0 110.05 179.863 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 22.8 m -81.31 -34.72 31.71 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.241 -0.912 . . . . 0.0 110.118 179.909 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 8.6 mt -61.86 -51.95 66.1 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.217 -0.927 . . . . 0.0 110.205 179.855 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -62.64 -29.41 70.6 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.183 -0.948 . . . . 0.0 109.942 179.776 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 1.3 m -72.59 -47.86 44.53 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.289 -0.882 . . . . 0.0 110.143 179.816 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 12' ' ' ILE . . . . . 0.412 ' O ' HG23 ' A' ' 12' ' ' ILE . 40.9 mt -63.38 -22.45 30.84 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.599 0 O-C-N 121.306 -0.871 . . . . 0.0 109.88 179.828 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -77.86 -40.89 38.69 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.374 -0.829 . . . . 0.0 110.039 179.779 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -59.66 -48.35 82.02 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.277 -0.889 . . . . 0.0 110.089 179.936 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 144.65 36.71 0.07 OUTLIER Glycine 0 N--CA 1.492 2.388 0 N-CA-C 109.934 -1.266 . . . . 0.0 109.934 179.752 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 16' ' ' TYR . . . . . 0.522 ' CD1' ' HG3' ' A' ' 30' ' ' ARG . 64.8 m-85 -108.64 -164.38 0.95 Allowed 'General case' 0 N--CA 1.487 1.394 0 O-C-N 121.119 -1.224 . . . . 0.0 110.042 179.744 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . 0.565 ' HB3' ' CD1' ' A' ' 18' ' ' PHE . 51.9 t-20 -128.84 -54.41 1.22 Allowed 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.123 -0.985 . . . . 0.0 110.486 -179.941 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . 0.599 ' N ' ' CD1' ' A' ' 18' ' ' PHE . 5.8 p90 -131.73 150.4 52.16 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.129 -0.982 . . . . 0.0 110.177 179.95 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . 0.457 ' HA2' ' HA ' ' A' ' 28' ' ' CYS . . . -155.82 -176.64 28.2 Favored Glycine 0 N--CA 1.49 2.272 0 N-CA-C 109.812 -1.315 . . . . 0.0 109.812 -179.868 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -174.66 171.89 3.15 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.279 -1.13 . . . . 0.0 110.112 -179.974 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 21' ' ' CYS . . . . . 0.407 ' HA ' ' O ' ' A' ' 25' ' ' SER . 52.1 t -90.35 135.92 33.38 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.223 -0.923 . . . . 0.0 110.136 179.921 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.465 ' HB ' ' HB3' ' A' ' 25' ' ' SER . 5.2 t -113.98 85.45 0.82 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.625 0 O-C-N 121.146 -0.971 . . . . 0.0 110.196 -179.995 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 54.01 72.34 0.45 Allowed 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.264 -0.898 . . . . 0.0 110.223 179.917 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 65.0 34.76 90.74 Favored Glycine 0 N--CA 1.49 2.282 0 N-CA-C 109.624 -1.39 . . . . 0.0 109.624 179.853 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 25' ' ' SER . . . . . 0.465 ' HB3' ' HB ' ' A' ' 22' ' ' VAL . 8.7 t -140.26 175.59 9.47 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.237 -1.155 . . . . 0.0 110.263 -179.993 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 52.8 t -135.27 97.72 3.78 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.265 -0.897 . . . . 0.0 110.136 179.909 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.457 ' HB2' ' CG2' ' A' ' 22' ' ' VAL . 28.1 mt-30 -113.42 151.23 31.63 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.269 -0.894 . . . . 0.0 110.251 -179.877 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . 0.457 ' HA ' ' HA2' ' A' ' 19' ' ' GLY . 91.2 m -144.77 168.96 18.97 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.297 -0.877 . . . . 0.0 110.16 179.857 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . 0.564 ' HB2' ' CE2' ' A' ' 18' ' ' PHE . 1.8 mpt_? -136.21 167.63 20.92 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.308 -0.87 . . . . 0.0 110.283 -179.752 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 30' ' ' ARG . . . . . 0.522 ' HG3' ' CD1' ' A' ' 16' ' ' TYR . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.59 0 O-C-N 121.275 -0.89 . . . . 0.0 110.17 -179.987 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.645 0 CA-C-O 121.16 0.505 . . . . 0.0 110.242 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . 0.458 ' O ' ' SG ' ' A' ' 7' ' ' CYS . 11.4 t -79.58 -20.94 45.75 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.267 -0.895 . . . . 0.0 110.206 179.964 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . 0.467 ' O ' ' HB2' ' A' ' 7' ' ' CYS . 15.7 m120 48.0 84.22 0.03 OUTLIER 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.211 -0.931 . . . . 0.0 110.107 -179.96 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -52.02 -25.77 9.24 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.296 -0.877 . . . . 0.0 110.688 -179.824 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . 0.465 ' O ' ' HB2' ' A' ' 9' ' ' LEU . 0.0 OUTLIER -79.39 -45.24 19.91 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.073 -1.017 . . . . 0.0 110.481 -179.694 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -79.6 -18.4 51.7 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.193 -0.942 . . . . 0.0 110.218 -179.887 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.469 ' O ' ' HB2' ' A' ' 11' ' ' CYS . 0.5 OUTLIER -83.53 -43.36 15.81 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.301 -0.874 . . . . 0.0 110.08 179.849 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' SER . . . . . 0.452 ' O ' HG13 ' A' ' 12' ' ' ILE . 86.0 p -72.17 -39.64 68.53 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.266 -0.896 . . . . 0.0 110.335 -179.92 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . 0.465 ' HB2' ' O ' ' A' ' 5' ' ' ARG . 0.2 OUTLIER -63.14 -51.4 66.65 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.248 -0.907 . . . . 0.0 110.343 -179.84 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -62.85 -35.95 81.64 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.261 -0.899 . . . . 0.0 110.457 -179.793 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.469 ' HB2' ' O ' ' A' ' 7' ' ' CYS . 0.5 OUTLIER -73.39 -43.83 59.74 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.109 -0.995 . . . . 0.0 110.425 -179.942 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . 0.452 HG13 ' O ' ' A' ' 8' ' ' SER . 47.6 mt -63.42 -23.18 32.65 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.614 0 O-C-N 121.185 -0.947 . . . . 0.0 109.885 179.906 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 1.9 ttt -80.22 -39.52 28.92 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.318 -0.864 . . . . 0.0 109.859 179.62 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 40.4 mtmt -54.03 -29.61 44.4 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.251 -0.905 . . . . 0.0 110.076 179.752 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 128.44 5.82 4.93 Favored Glycine 0 N--CA 1.491 2.321 0 N-CA-C 109.839 -1.304 . . . . 0.0 109.839 179.852 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 25.7 m-85 -80.37 -177.97 6.42 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.149 -1.206 . . . . 0.0 110.143 -179.975 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . 0.478 ' CB ' ' OG1' ' A' ' 31' ' ' THR . 3.5 t-20 -108.31 -51.39 2.9 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.189 -0.945 . . . . 0.0 110.174 -179.915 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . 0.564 ' CE1' ' CB ' ' A' ' 29' ' ' ARG . 8.9 p90 -151.42 159.07 44.4 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.283 -0.886 . . . . 0.0 110.372 -179.917 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . 0.516 ' CA ' ' HA ' ' A' ' 28' ' ' CYS . . . -153.42 -162.05 10.77 Favored Glycine 0 N--CA 1.49 2.279 0 N-CA-C 109.372 -1.491 . . . . 0.0 109.372 179.938 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.457 ' HB3' ' O ' ' A' ' 19' ' ' GLY . 1.6 pttt 176.79 160.94 0.39 Allowed 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.288 -1.125 . . . . 0.0 110.275 179.891 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 74.1 m -82.92 137.81 34.08 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.153 -0.967 . . . . 0.0 110.086 179.899 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.489 ' O ' ' N ' ' A' ' 25' ' ' SER . 41.7 t -131.85 131.11 61.96 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.568 0 O-C-N 121.271 -0.893 . . . . 0.0 110.208 179.951 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . 0.426 ' C ' ' O ' ' A' ' 22' ' ' VAL . 0.8 OUTLIER 42.88 40.97 2.36 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.287 -0.883 . . . . 0.0 110.288 179.955 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 72.47 27.17 70.11 Favored Glycine 0 N--CA 1.491 2.35 0 N-CA-C 109.728 -1.349 . . . . 0.0 109.728 179.964 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' SER . . . . . 0.489 ' N ' ' O ' ' A' ' 22' ' ' VAL . 13.3 m -121.06 -173.37 2.59 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.217 -1.167 . . . . 0.0 110.112 179.927 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 16.9 t -134.68 101.16 4.84 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.284 -0.885 . . . . 0.0 110.312 -179.959 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 12.3 mm100 -118.61 154.37 32.76 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.253 -0.904 . . . . 0.0 110.154 179.954 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . 0.516 ' HA ' ' CA ' ' A' ' 19' ' ' GLY . 64.0 m -139.24 168.22 20.32 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.235 -0.916 . . . . 0.0 110.095 -179.944 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . 0.564 ' CB ' ' CE1' ' A' ' 18' ' ' PHE . 0.2 OUTLIER -128.81 154.65 46.21 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.131 -0.981 . . . . 0.0 110.419 -179.8 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -119.91 136.01 54.67 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.374 -0.828 . . . . 0.0 110.091 179.915 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' THR . . . . . 0.478 ' OG1' ' CB ' ' A' ' 17' ' ' ASN . 0.0 OUTLIER -111.3 165.59 11.81 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.186 -0.946 . . . . 0.0 110.131 179.96 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -149.68 -170.13 3.56 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.253 -0.904 . . . . 0.0 110.243 -179.927 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.404 0 N-CA-C 109.45 -1.46 . . . . 0.0 109.45 179.969 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.67 0 CA-C-O 121.196 0.522 . . . . 0.0 110.159 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 18.3 p -90.26 138.76 31.27 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.286 -0.884 . . . . 0.0 110.071 179.951 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 90.4 m-20 -114.6 146.26 41.02 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.185 -0.947 . . . . 0.0 110.319 -179.753 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 28.8 m-20 -64.96 -24.44 67.52 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.23 -0.919 . . . . 0.0 109.954 179.802 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.05 -54.07 12.46 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.352 -0.843 . . . . 0.0 110.274 -179.973 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 8.6 t0 -78.58 -4.66 49.93 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.356 -0.84 . . . . 0.0 109.783 179.822 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 5.1 t -95.15 -50.77 4.92 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.422 -0.799 . . . . 0.0 109.548 179.454 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 7.1 m -65.78 -39.8 91.34 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.365 -0.834 . . . . 0.0 109.906 179.633 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 6.5 mt -54.32 -39.24 66.85 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.193 -0.942 . . . . 0.0 110.015 179.828 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -72.25 -35.24 68.75 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.294 -0.878 . . . . 0.0 110.106 179.911 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.451 ' O ' ' HB2' ' A' ' 16' ' ' TYR . 92.0 m -66.57 -42.29 87.24 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.325 -0.859 . . . . 0.0 109.942 179.891 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 23.7 mt -67.43 -35.47 73.56 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.588 0 O-C-N 121.265 -0.897 . . . . 0.0 110.217 179.965 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 3.6 ttt -63.79 -46.33 85.69 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.232 -0.918 . . . . 0.0 110.186 179.996 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -59.19 -21.17 59.04 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.244 -0.91 . . . . 0.0 110.279 -179.941 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 115.63 7.86 15.1 Favored Glycine 0 N--CA 1.49 2.275 0 N-CA-C 109.606 -1.398 . . . . 0.0 109.606 179.849 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' TYR . . . . . 0.451 ' HB2' ' O ' ' A' ' 11' ' ' CYS . 24.7 m-85 -91.02 -159.33 0.62 Allowed 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.134 -1.215 . . . . 0.0 110.3 -179.986 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . 0.456 ' HB3' ' CD2' ' A' ' 18' ' ' PHE . 4.8 m-80 -116.88 -70.98 0.76 Allowed 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.209 -0.932 . . . . 0.0 110.372 -179.939 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . 0.503 ' CE1' ' HB2' ' A' ' 29' ' ' ARG . 14.8 p90 -128.42 -177.67 4.26 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.21 -0.931 . . . . 0.0 110.274 -179.862 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -151.53 -164.84 12.46 Favored Glycine 0 N--CA 1.49 2.258 0 N-CA-C 109.332 -1.507 . . . . 0.0 109.332 179.975 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.454 ' O ' ' HA ' ' A' ' 26' ' ' CYS . 0.3 OUTLIER -162.16 147.54 12.89 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.15 -1.206 . . . . 0.0 110.3 179.989 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . 0.477 ' C ' ' CG2' ' A' ' 22' ' ' VAL . 0.8 OUTLIER -82.3 139.08 34.37 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.353 -0.842 . . . . 0.0 110.385 -179.99 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.477 ' CG2' ' C ' ' A' ' 21' ' ' CYS . 15.1 t -151.57 112.25 0.46 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.607 0 O-C-N 121.303 -0.873 . . . . 0.0 110.255 -179.987 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . 0.457 ' HB2' ' O ' ' A' ' 22' ' ' VAL . 83.7 mtt180 61.02 73.38 0.48 Allowed 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.253 -0.904 . . . . 0.0 110.347 179.974 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . 0.419 ' C ' ' O ' ' A' ' 23' ' ' ARG . . . 42.65 28.12 0.6 Allowed Glycine 0 N--CA 1.492 2.386 0 N-CA-C 109.611 -1.396 . . . . 0.0 109.611 179.893 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' SER . . . . . 0.407 ' N ' ' O ' ' A' ' 23' ' ' ARG . 0.5 OUTLIER -141.22 -163.74 1.61 Allowed 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.276 -1.132 . . . . 0.0 110.041 179.971 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . 0.455 ' SG ' ' HA ' ' A' ' 21' ' ' CYS . 0.5 OUTLIER -167.07 142.86 4.24 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.234 -0.916 . . . . 0.0 110.171 179.917 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 6.3 mm-40 -119.84 176.18 5.53 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.387 -0.821 . . . . 0.0 110.302 -179.92 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 85.4 m -120.47 135.46 55.05 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.346 -0.846 . . . . 0.0 109.956 179.885 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . 0.503 ' HB2' ' CE1' ' A' ' 18' ' ' PHE . 0.4 OUTLIER -120.53 150.35 40.99 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.26 -0.9 . . . . 0.0 110.395 -179.815 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 5.4 ttt180 -112.74 157.58 21.13 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.313 -0.867 . . . . 0.0 109.964 179.994 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -82.5 -148.88 0.08 Allowed 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.269 -0.894 . . . . 0.0 110.285 -179.957 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -141.29 118.44 11.31 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.256 -0.902 . . . . 0.0 110.073 -179.993 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.235 0 N-CA-C 109.484 -1.446 . . . . 0.0 109.484 179.963 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.618 0 CA-C-O 121.257 0.551 . . . . 0.0 110.204 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . 0.456 ' SG ' ' O ' ' A' ' 25' ' ' SER . 45.8 t -97.87 141.44 30.85 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.256 -0.902 . . . . 0.0 110.246 179.999 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 66.5 m-80 -116.62 140.79 49.0 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.337 -0.852 . . . . 0.0 110.113 -179.98 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . 0.463 ' O ' ' OG ' ' A' ' 8' ' ' SER . 2.8 m-20 -63.05 -13.4 35.39 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.249 -0.907 . . . . 0.0 110.096 179.994 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . 0.449 ' O ' ' HB2' ' A' ' 9' ' ' LEU . 0.0 OUTLIER -80.89 -40.05 25.32 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.373 -0.83 . . . . 0.0 110.2 179.994 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . 0.415 ' O ' ' CB ' ' A' ' 10' ' ' ASP . 1.0 OUTLIER -79.62 -29.29 41.02 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.175 -0.953 . . . . 0.0 110.146 -179.958 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -76.38 -47.2 24.1 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.183 -0.948 . . . . 0.0 110.039 179.873 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' SER . . . . . 0.463 ' OG ' ' O ' ' A' ' 4' ' ' ASP . 7.3 m -65.85 -39.81 91.12 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.192 -0.942 . . . . 0.0 109.994 179.884 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . 0.449 ' HB2' ' O ' ' A' ' 5' ' ' ARG . 4.0 mt -73.77 -36.57 65.09 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.32 -0.862 . . . . 0.0 110.164 179.775 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . 0.415 ' CB ' ' O ' ' A' ' 6' ' ' ASP . 36.9 t0 -76.43 -42.32 44.43 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.239 -0.913 . . . . 0.0 110.126 179.909 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.449 ' O ' ' HB2' ' A' ' 16' ' ' TYR . 93.9 m -67.28 -40.81 86.19 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.244 -0.91 . . . . 0.0 110.174 179.992 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 44.7 mt -66.23 -40.0 85.77 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.616 0 O-C-N 121.307 -0.871 . . . . 0.0 110.267 179.932 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' MET . . . . . 0.412 ' HB2' ' O ' ' A' ' 9' ' ' LEU . 2.3 ttp -68.29 -34.58 76.41 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.255 -0.903 . . . . 0.0 110.205 -179.994 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -64.05 -19.1 64.97 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.321 -0.862 . . . . 0.0 110.178 -179.991 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . 0.445 ' O ' ' NH1' ' A' ' 30' ' ' ARG . . . 109.91 16.42 10.7 Favored Glycine 0 N--CA 1.49 2.263 0 N-CA-C 109.662 -1.375 . . . . 0.0 109.662 -179.985 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' TYR . . . . . 0.449 ' HB2' ' O ' ' A' ' 11' ' ' CYS . 31.5 m-85 -97.36 -160.92 0.83 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.311 -1.111 . . . . 0.0 110.178 -179.873 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . 0.421 ' OD1' ' CD2' ' A' ' 18' ' ' PHE . 2.9 t-20 -119.4 -64.47 1.27 Allowed 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.237 -0.915 . . . . 0.0 110.272 -179.881 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . 0.574 ' CE1' ' HB3' ' A' ' 29' ' ' ARG . 6.6 p90 -143.77 145.28 32.26 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.184 -0.947 . . . . 0.0 110.289 -179.897 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . 0.437 ' HA3' ' HA ' ' A' ' 28' ' ' CYS . . . -132.99 -150.1 6.31 Favored Glycine 0 N--CA 1.491 2.331 0 N-CA-C 109.736 -1.345 . . . . 0.0 109.736 -179.965 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -170.66 173.52 5.36 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.185 -1.186 . . . . 0.0 110.229 -179.949 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 9.7 m -104.42 125.64 50.81 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.255 -0.903 . . . . 0.0 110.13 179.852 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.457 ' HB ' ' HB2' ' A' ' 25' ' ' SER . 9.9 t -86.81 43.12 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.633 0 O-C-N 121.2 -0.938 . . . . 0.0 110.037 179.858 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 3.4 mtm180 54.13 33.8 18.66 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.324 -0.86 . . . . 0.0 110.362 179.731 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 158.13 -19.36 0.34 Allowed Glycine 0 N--CA 1.491 2.319 0 C-N-CA 119.767 -1.206 . . . . 0.0 110.086 179.802 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' SER . . . . . 0.457 ' HB2' ' HB ' ' A' ' 22' ' ' VAL . 22.6 m -127.66 -176.55 3.79 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 120.993 -1.298 . . . . 0.0 110.681 -179.824 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . 0.45 ' SG ' ' SG ' ' A' ' 2' ' ' CYS . 0.1 OUTLIER -134.58 120.14 19.27 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.442 -0.787 . . . . 0.0 109.887 -179.863 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 1.8 mm-40 -118.68 167.2 11.88 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.202 -0.936 . . . . 0.0 110.494 -179.754 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . 0.437 ' HA ' ' HA3' ' A' ' 19' ' ' GLY . 17.7 m -136.52 152.05 50.1 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.206 -0.934 . . . . 0.0 109.97 179.849 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . 0.574 ' HB3' ' CE1' ' A' ' 18' ' ' PHE . 0.0 OUTLIER -132.5 152.03 51.69 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.155 -0.966 . . . . 0.0 110.398 -179.868 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.445 ' NH1' ' O ' ' A' ' 15' ' ' GLY . 0.0 OUTLIER -105.46 -166.18 1.19 Allowed 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.303 -0.873 . . . . 0.0 110.036 179.889 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 65.4 p -97.84 -172.71 2.44 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.192 -0.942 . . . . 0.0 110.108 179.95 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -97.34 121.48 39.28 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.111 -0.993 . . . . 0.0 110.227 -179.975 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.222 0 CA-C-O 118.017 -1.435 . . . . 0.0 109.551 -179.994 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.621 0 CA-C-O 121.245 0.545 . . . . 0.0 110.189 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . 0.429 ' HB2' ' SG ' ' A' ' 26' ' ' CYS . 23.3 p -73.96 155.3 38.78 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.276 -0.89 . . . . 0.0 110.342 -179.903 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . 0.455 ' O ' ' SG ' ' A' ' 7' ' ' CYS . 0.1 OUTLIER -112.6 110.22 20.25 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.159 -0.963 . . . . 0.0 110.226 179.955 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . 0.507 ' N ' ' OD1' ' A' ' 4' ' ' ASP . 0.8 OUTLIER -50.9 -35.46 33.11 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.291 -0.881 . . . . 0.0 110.32 -179.901 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -62.31 -49.04 77.19 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.201 -0.937 . . . . 0.0 110.195 -179.945 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . 0.441 ' O ' ' HB2' ' A' ' 10' ' ' ASP . 0.3 OUTLIER -79.2 -6.65 57.09 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.314 -0.866 . . . . 0.0 110.0 179.873 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.455 ' SG ' ' O ' ' A' ' 3' ' ' ASN . 87.4 m -89.81 -40.29 12.55 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.227 -0.921 . . . . 0.0 109.915 179.634 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 8.5 t -77.49 -39.24 47.07 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.297 -0.877 . . . . 0.0 110.082 179.693 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 12.7 mt -72.54 -38.78 67.89 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.309 -0.869 . . . . 0.0 110.063 179.875 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . 0.465 ' O ' ' HG2' ' A' ' 14' ' ' LYS . 12.1 t70 -69.41 -43.21 73.87 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.293 -0.88 . . . . 0.0 109.999 179.821 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 53.4 m -65.95 -40.36 91.27 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.289 -0.882 . . . . 0.0 109.733 179.82 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . 0.419 HD13 HG22 ' A' ' 12' ' ' ILE . 27.1 mt -63.73 -32.1 55.63 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.509 0 O-C-N 121.286 -0.884 . . . . 0.0 109.494 179.411 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -65.27 -45.06 85.99 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.367 -0.833 . . . . 0.0 109.694 179.506 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . 0.465 ' HG2' ' O ' ' A' ' 10' ' ' ASP . 11.8 mmmm -57.61 -17.57 15.14 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.34 -0.85 . . . . 0.0 109.855 179.621 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 107.02 40.07 1.89 Allowed Glycine 0 N--CA 1.491 2.328 0 N-CA-C 109.222 -1.551 . . . . 0.0 109.222 -179.712 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 12.3 m-85 -121.88 -165.54 1.27 Allowed 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.346 -1.091 . . . . 0.0 110.418 -179.74 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . 0.568 ' HB3' ' CD2' ' A' ' 18' ' ' PHE . 9.5 m-80 -98.11 -53.54 3.34 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.33 -0.856 . . . . 0.0 110.154 179.904 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . 0.568 ' CD2' ' HB3' ' A' ' 17' ' ' ASN . 11.0 p90 -161.27 -171.11 2.89 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.194 -0.941 . . . . 0.0 110.268 179.848 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -140.64 -179.23 17.95 Favored Glycine 0 N--CA 1.491 2.34 0 N-CA-C 109.639 -1.384 . . . . 0.0 109.639 179.985 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -149.41 151.17 33.59 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.254 -1.145 . . . . 0.0 110.387 179.978 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . 0.434 ' SG ' ' SG ' ' A' ' 26' ' ' CYS . 0.8 OUTLIER -89.88 132.49 35.26 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.228 -0.92 . . . . 0.0 110.245 -179.971 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.522 ' O ' ' CB ' ' A' ' 25' ' ' SER . 99.1 t -136.31 100.93 2.43 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.594 0 O-C-N 121.271 -0.893 . . . . 0.0 110.317 -179.941 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 50.92 80.3 0.08 Allowed 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.266 -0.896 . . . . 0.0 110.431 179.843 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 47.78 23.71 2.55 Favored Glycine 0 N--CA 1.49 2.278 0 N-CA-C 109.696 -1.362 . . . . 0.0 109.696 179.866 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' SER . . . . . 0.522 ' CB ' ' O ' ' A' ' 22' ' ' VAL . 1.2 t -127.16 173.67 9.53 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.217 -1.167 . . . . 0.0 110.137 179.968 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . 0.434 ' SG ' ' SG ' ' A' ' 21' ' ' CYS . 0.0 OUTLIER -158.47 123.57 4.32 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.227 -0.921 . . . . 0.0 110.318 179.919 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 25.1 mm-40 -120.28 -175.06 2.92 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.223 -0.923 . . . . 0.0 110.34 179.878 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 56.8 m -119.99 145.66 46.59 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.214 -0.929 . . . . 0.0 110.123 179.931 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . 0.565 ' CB ' ' CE1' ' A' ' 18' ' ' PHE . 0.4 OUTLIER -126.99 165.04 20.17 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.167 -0.958 . . . . 0.0 110.141 -179.905 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -112.7 -157.16 0.61 Allowed 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.25 -0.906 . . . . 0.0 110.23 -179.979 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' THR . . . . . 0.478 ' OG1' ' ND2' ' A' ' 17' ' ' ASN . 0.3 OUTLIER -114.64 -174.97 2.58 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.279 -0.888 . . . . 0.0 110.229 -179.992 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -100.85 -179.64 4.12 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.176 -0.953 . . . . 0.0 110.207 179.971 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.389 0 CA-C-O 117.968 -1.462 . . . . 0.0 109.573 -179.992 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.616 0 CA-C-O 121.254 0.55 . . . . 0.0 110.265 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . 0.439 ' SG ' ' O ' ' A' ' 25' ' ' SER . 6.5 t -88.33 120.36 29.62 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.238 -0.914 . . . . 0.0 110.171 179.986 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 2.8 m-80 -110.13 140.21 44.46 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.296 -0.878 . . . . 0.0 110.195 179.962 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -51.13 -43.44 61.17 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.203 -0.936 . . . . 0.0 110.182 -179.945 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 21.6 mtp180 -72.74 -42.81 63.69 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.253 -0.904 . . . . 0.0 110.203 179.998 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 1.3 t0 -79.92 3.93 18.36 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.36 -0.838 . . . . 0.0 110.154 179.964 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 8.6 t -107.21 -31.85 8.05 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.214 -0.929 . . . . 0.0 110.222 -179.966 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' SER . . . . . 0.458 ' O ' HG13 ' A' ' 12' ' ' ILE . 36.7 t -93.12 -31.19 14.9 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.267 -0.895 . . . . 0.0 110.218 179.941 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 34.5 mt -57.2 -57.83 10.88 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.176 -0.953 . . . . 0.0 110.139 -179.992 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -62.7 -38.54 90.82 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.33 -0.856 . . . . 0.0 110.237 -179.997 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -66.21 -38.32 87.68 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.246 -0.909 . . . . 0.0 110.02 -179.984 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . 0.458 HG13 ' O ' ' A' ' 8' ' ' SER . 11.0 mt -63.94 -34.3 67.51 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.549 0 O-C-N 121.292 -0.88 . . . . 0.0 109.669 179.587 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 36.9 mtt -67.9 -38.86 83.49 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.411 -0.806 . . . . 0.0 110.068 179.68 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 33.8 mtmt -55.07 -33.28 62.62 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.303 -0.873 . . . . 0.0 110.378 -179.882 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 130.69 2.07 4.92 Favored Glycine 0 N--CA 1.491 2.31 0 N-CA-C 109.871 -1.291 . . . . 0.0 109.871 179.948 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 81.2 m-85 -79.41 -178.02 6.05 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.063 -1.257 . . . . 0.0 110.214 -179.96 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . 0.487 ' HB3' ' CD2' ' A' ' 18' ' ' PHE . 1.5 t-20 -103.73 -66.09 0.97 Allowed 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.287 -0.883 . . . . 0.0 110.272 -179.976 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . 0.506 ' CE1' ' HB2' ' A' ' 29' ' ' ARG . 7.2 p90 -138.58 159.07 43.0 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.164 -0.96 . . . . 0.0 110.387 -179.958 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . 0.524 ' CA ' ' HA ' ' A' ' 28' ' ' CYS . . . -156.64 172.35 34.33 Favored Glycine 0 N--CA 1.489 2.22 0 N-CA-C 109.816 -1.314 . . . . 0.0 109.816 179.992 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -143.2 166.8 23.71 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.333 -1.098 . . . . 0.0 110.14 179.923 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . 0.474 ' HA ' ' O ' ' A' ' 25' ' ' SER . 47.0 t -98.94 116.04 30.27 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.222 -0.924 . . . . 0.0 110.079 179.863 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.51 ' O ' ' N ' ' A' ' 24' ' ' GLY . 41.1 t -80.22 82.86 1.25 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.676 0 O-C-N 121.155 -0.965 . . . . 0.0 110.085 -179.933 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 61.73 -77.03 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.298 -0.876 . . . . 0.0 109.895 -179.927 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . 0.51 ' N ' ' O ' ' A' ' 22' ' ' VAL . . . -127.24 39.32 1.97 Allowed Glycine 0 N--CA 1.489 2.183 0 N-CA-C 109.285 -1.526 . . . . 0.0 109.285 179.711 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' SER . . . . . 0.474 ' O ' ' HA ' ' A' ' 21' ' ' CYS . 0.3 OUTLIER -147.01 172.97 12.9 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.326 -1.102 . . . . 0.0 110.039 -179.951 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 49.3 t -134.85 98.31 3.99 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.201 -0.937 . . . . 0.0 110.248 -179.884 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.408 ' C ' ' SG ' ' A' ' 28' ' ' CYS . 4.6 mm-40 -105.43 157.99 16.97 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.292 -0.88 . . . . 0.0 109.915 179.943 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . 0.524 ' HA ' ' CA ' ' A' ' 19' ' ' GLY . 34.3 m -142.65 170.72 15.17 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.079 -1.013 . . . . 0.0 110.541 -179.803 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . 0.506 ' HB2' ' CE1' ' A' ' 18' ' ' PHE . 27.9 mmt180 -142.1 164.72 29.41 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.388 -0.82 . . . . 0.0 110.304 -179.75 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 54.3 mtp180 -112.46 -166.95 1.12 Allowed 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.282 -0.886 . . . . 0.0 110.139 179.973 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 2.0 p -95.5 -166.06 1.39 Allowed 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.268 -0.895 . . . . 0.0 110.246 -179.968 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 3.3 p -102.8 88.11 3.12 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.318 -0.864 . . . . 0.0 110.192 -179.89 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.338 0 CA-C-O 117.887 -1.507 . . . . 0.0 109.536 179.984 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.614 0 CA-C-O 121.199 0.523 . . . . 0.0 110.058 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . 0.452 ' HA ' ' HB2' ' A' ' 26' ' ' CYS . 12.1 t -96.67 89.8 5.08 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.29 -0.881 . . . . 0.0 110.288 -179.976 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . 0.41 ' O ' ' N ' ' A' ' 7' ' ' CYS . 1.4 m-20 -145.92 131.57 18.89 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.215 -0.928 . . . . 0.0 110.11 179.861 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . 0.447 ' O ' ' OG ' ' A' ' 8' ' ' SER . 65.6 m-20 -50.87 -37.25 42.31 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.219 -0.926 . . . . 0.0 110.259 179.997 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . 0.463 ' O ' ' HB2' ' A' ' 9' ' ' LEU . 0.0 OUTLIER -73.44 -41.54 63.1 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.307 -0.871 . . . . 0.0 110.147 179.999 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 33.8 m-20 -80.0 -22.75 42.11 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.227 -0.921 . . . . 0.0 110.308 -179.944 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.41 ' N ' ' O ' ' A' ' 3' ' ' ASN . 41.4 m -76.36 -36.24 58.28 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.395 -0.816 . . . . 0.0 110.091 -179.914 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' SER . . . . . 0.447 ' OG ' ' O ' ' A' ' 4' ' ' ASP . 0.7 OUTLIER -85.02 -33.69 22.48 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.242 -0.912 . . . . 0.0 110.517 -179.703 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . 0.463 ' HB2' ' O ' ' A' ' 5' ' ' ARG . 0.7 OUTLIER -71.59 -52.95 15.43 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.173 -0.954 . . . . 0.0 110.322 -179.838 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 2.3 t0 -62.69 -24.71 67.79 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.193 -0.942 . . . . 0.0 110.147 179.899 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.402 ' SG ' ' O ' ' A' ' 7' ' ' CYS . 3.6 m -78.96 -45.65 19.94 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.185 -0.947 . . . . 0.0 110.287 -179.986 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . 0.44 HG13 ' O ' ' A' ' 8' ' ' SER . 64.2 mt -63.57 -30.25 49.36 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.626 0 O-C-N 121.123 -0.985 . . . . 0.0 110.222 179.991 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' MET . . . . . 0.458 ' HG3' ' O ' ' A' ' 9' ' ' LEU . 11.9 mtp -84.24 -27.35 28.0 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.272 -0.893 . . . . 0.0 110.178 179.832 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -78.93 -27.17 43.68 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.254 -0.904 . . . . 0.0 110.29 179.942 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 121.88 17.69 3.73 Favored Glycine 0 N--CA 1.492 2.415 0 N-CA-C 109.634 -1.387 . . . . 0.0 109.634 179.87 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' TYR . . . . . 0.456 ' HB3' ' SG ' ' A' ' 28' ' ' CYS . 45.0 m-85 -100.22 -170.45 1.87 Allowed 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.242 -1.152 . . . . 0.0 110.263 -179.99 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . 0.546 ' HB3' ' CD2' ' A' ' 18' ' ' PHE . 2.4 m120 -122.54 -56.92 1.77 Allowed 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.274 -0.891 . . . . 0.0 110.241 179.929 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . 0.554 ' CE1' ' HB3' ' A' ' 29' ' ' ARG . 11.6 p90 -147.33 153.88 40.23 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.188 -0.945 . . . . 0.0 110.186 -179.922 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . 0.527 ' CA ' ' HA ' ' A' ' 28' ' ' CYS . . . -136.74 -146.86 5.24 Favored Glycine 0 N--CA 1.492 2.367 0 N-CA-C 109.745 -1.342 . . . . 0.0 109.745 -179.924 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 175.04 141.99 0.05 Allowed 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.27 -1.135 . . . . 0.0 110.209 -179.957 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . 0.49 ' HA ' ' HA ' ' A' ' 26' ' ' CYS . 0.1 OUTLIER -97.04 125.61 41.61 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.203 -0.935 . . . . 0.0 110.456 -179.868 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.402 ' O ' ' CG1' ' A' ' 22' ' ' VAL . 60.7 t -94.39 45.47 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.564 0 O-C-N 121.348 -0.845 . . . . 0.0 109.964 179.812 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 61.32 84.85 0.13 Allowed 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.321 -0.862 . . . . 0.0 110.384 -179.96 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 103.63 -20.17 42.59 Favored Glycine 0 N--CA 1.491 2.34 0 N-CA-C 109.782 -1.327 . . . . 0.0 109.782 179.756 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' SER . . . . . 0.458 ' O ' ' HA ' ' A' ' 21' ' ' CYS . 3.0 t -132.2 162.21 31.5 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.122 -1.222 . . . . 0.0 110.33 -179.875 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . 0.49 ' HA ' ' HA ' ' A' ' 21' ' ' CYS . 18.2 t -138.7 123.34 18.58 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.288 -0.883 . . . . 0.0 110.426 -179.926 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 76.9 mt-30 -108.74 175.2 5.55 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.344 -0.847 . . . . 0.0 110.085 179.872 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . 0.527 ' HA ' ' CA ' ' A' ' 19' ' ' GLY . 6.9 t -148.68 156.4 42.33 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.298 -0.876 . . . . 0.0 110.431 -179.856 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . 0.554 ' HB3' ' CE1' ' A' ' 18' ' ' PHE . 6.2 mmm-85 -144.53 137.14 26.62 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.244 -0.91 . . . . 0.0 110.215 179.903 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.443 ' HG3' ' CD2' ' A' ' 16' ' ' TYR . 1.7 mpp_? -89.24 -160.84 0.71 Allowed 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.302 -0.874 . . . . 0.0 110.177 -179.958 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' THR . . . . . 0.402 HG22 ' ND2' ' A' ' 17' ' ' ASN . 0.0 OUTLIER -106.95 171.6 7.28 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.23 -0.919 . . . . 0.0 110.201 179.932 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -163.42 -86.7 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.213 -0.93 . . . . 0.0 110.174 -179.976 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.313 0 N-CA-C 109.461 -1.455 . . . . 0.0 109.461 -179.951 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.608 0 CA-C-O 121.161 0.505 . . . . 0.0 110.165 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . 0.464 ' O ' ' HB2' ' A' ' 21' ' ' CYS . 17.7 p -92.15 37.52 0.99 Allowed 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.185 -0.947 . . . . 0.0 110.182 179.933 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . 0.417 ' OD1' ' O ' ' A' ' 3' ' ' ASN . 53.2 p-10 -51.98 154.89 2.0 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.178 -0.951 . . . . 0.0 110.132 179.994 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . 0.466 ' OD2' ' HG2' ' A' ' 20' ' ' LYS . 0.6 OUTLIER -65.23 -15.93 62.99 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.358 -0.839 . . . . 0.0 110.385 -179.798 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . 0.43 ' O ' HD13 ' A' ' 9' ' ' LEU . 0.0 OUTLIER -75.33 -54.45 7.06 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.271 -0.893 . . . . 0.0 110.522 -179.788 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 2.1 t0 -79.77 -25.85 40.85 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.255 -0.903 . . . . 0.0 110.674 -179.683 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.4 ' O ' ' SG ' ' A' ' 11' ' ' CYS . 30.9 t -76.76 -33.83 58.06 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.204 -0.935 . . . . 0.0 110.25 -179.868 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' SER . . . . . 0.453 ' HB3' ' O ' ' A' ' 4' ' ' ASP . 22.7 p -79.58 -43.19 23.43 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.182 -0.949 . . . . 0.0 110.317 179.939 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . 0.43 HD13 ' O ' ' A' ' 5' ' ' ARG . 0.2 OUTLIER -53.49 -42.04 66.87 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.258 -0.901 . . . . 0.0 110.203 -179.982 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 3.3 t70 -63.45 -27.19 69.11 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.298 -0.876 . . . . 0.0 110.097 179.733 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.4 ' SG ' ' O ' ' A' ' 7' ' ' CYS . 79.4 m -71.51 -41.4 69.3 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.271 -0.893 . . . . 0.0 110.107 -179.983 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 36.1 mt -63.65 -45.62 96.98 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.576 0 O-C-N 121.316 -0.865 . . . . 0.0 110.034 179.851 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 1.2 ttp -64.28 -31.42 72.62 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.243 -0.911 . . . . 0.0 109.98 179.767 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.47 -32.16 66.01 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.34 -0.85 . . . . 0.0 110.152 -179.945 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 137.3 -7.41 3.71 Favored Glycine 0 N--CA 1.491 2.323 0 N-CA-C 109.509 -1.436 . . . . 0.0 109.509 -179.904 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 26.2 m-85 -87.89 -170.12 2.86 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.321 -1.105 . . . . 0.0 110.15 -179.888 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 35.2 t-20 -120.61 -40.81 2.63 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.333 -0.854 . . . . 0.0 110.237 179.864 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . 0.605 ' CE2' ' CB ' ' A' ' 29' ' ' ARG . 38.4 p90 -146.58 146.96 30.64 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.342 -0.849 . . . . 0.0 110.193 179.829 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . 0.42 ' CA ' ' HA ' ' A' ' 28' ' ' CYS . . . -137.34 -173.01 12.73 Favored Glycine 0 N--CA 1.491 2.302 0 N-CA-C 109.524 -1.43 . . . . 0.0 109.524 -179.937 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.466 ' HG2' ' OD2' ' A' ' 4' ' ' ASP . 0.0 OUTLIER -161.96 159.25 26.32 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.191 -1.182 . . . . 0.0 110.258 179.963 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . 0.464 ' HB2' ' O ' ' A' ' 2' ' ' CYS . 40.7 t -87.43 139.47 30.52 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.29 -0.881 . . . . 0.0 110.018 -179.977 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.474 ' HB ' ' HB2' ' A' ' 25' ' ' SER . 43.0 t -117.89 92.49 2.15 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.684 0 O-C-N 121.154 -0.966 . . . . 0.0 110.679 -179.8 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER 50.66 53.87 12.2 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.477 -0.764 . . . . 0.0 111.108 179.328 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 89.97 15.98 56.86 Favored Glycine 0 N--CA 1.491 2.345 0 C-N-CA 119.886 -1.15 . . . . 0.0 110.312 179.205 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' SER . . . . . 0.474 ' HB2' ' HB ' ' A' ' 22' ' ' VAL . 1.1 m -122.04 178.99 4.67 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.006 -1.29 . . . . 0.0 110.134 179.719 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 46.0 t -145.75 95.03 2.58 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.258 -0.901 . . . . 0.0 110.32 -179.911 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -105.64 178.42 4.57 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.333 -0.855 . . . . 0.0 110.195 179.83 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . 0.42 ' HA ' ' CA ' ' A' ' 19' ' ' GLY . 82.0 m -134.69 150.33 50.6 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.259 -0.901 . . . . 0.0 110.284 -179.962 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . 0.605 ' CB ' ' CE2' ' A' ' 18' ' ' PHE . 10.1 mtt180 -122.59 146.37 47.49 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.259 -0.901 . . . . 0.0 110.1 -179.972 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.444 ' O ' ' CZ ' ' A' ' 18' ' ' PHE . 0.0 OUTLIER -95.3 174.13 7.19 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.217 -0.927 . . . . 0.0 110.19 179.985 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 30.0 p -77.96 -164.17 0.49 Allowed 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.36 -0.837 . . . . 0.0 110.126 -179.963 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 69.0 p -145.49 48.6 1.26 Allowed 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.178 -0.951 . . . . 0.0 110.173 -179.94 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.193 0 CA-C-O 118.014 -1.437 . . . . 0.0 109.618 179.95 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.617 0 CA-C-O 121.322 0.582 . . . . 0.0 110.17 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . 0.45 ' SG ' ' HB2' ' A' ' 26' ' ' CYS . 48.9 t -82.57 120.86 26.06 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.222 -0.924 . . . . 0.0 110.257 179.968 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -82.41 139.34 34.08 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.197 -0.939 . . . . 0.0 110.24 179.941 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 46.7 m-20 -66.85 -30.92 71.22 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.195 -0.941 . . . . 0.0 110.118 179.912 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . 0.429 ' O ' ' CD1' ' A' ' 9' ' ' LEU . 6.5 mtp180 -75.98 -41.84 50.12 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.277 -0.89 . . . . 0.0 110.098 179.868 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -79.64 -23.04 42.84 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.253 -0.904 . . . . 0.0 110.323 179.967 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 46.7 t -78.75 -38.06 39.71 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.21 -0.931 . . . . 0.0 110.145 179.877 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 38.1 t -75.06 -42.05 57.72 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.245 -0.909 . . . . 0.0 110.079 179.879 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . 0.429 ' CD1' ' O ' ' A' ' 5' ' ' ARG . 61.5 mt -53.86 -47.02 71.42 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.306 -0.871 . . . . 0.0 110.292 -179.963 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . 0.46 ' O ' ' HG3' ' A' ' 14' ' ' LYS . 5.5 m-20 -62.66 -38.82 91.83 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.272 -0.893 . . . . 0.0 110.108 179.959 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.443 ' O ' ' HB2' ' A' ' 16' ' ' TYR . 87.5 m -66.69 -39.13 87.97 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.285 -0.885 . . . . 0.0 110.042 179.94 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . 0.446 HD13 HG23 ' A' ' 12' ' ' ILE . 17.1 mt -63.67 -33.23 60.43 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.633 0 O-C-N 121.356 -0.84 . . . . 0.0 110.187 -179.865 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' MET . . . . . 0.474 ' HA ' ' CE ' ' A' ' 13' ' ' MET . 0.3 OUTLIER -71.28 -39.94 71.21 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.321 -0.862 . . . . 0.0 110.198 -179.977 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . 0.46 ' HG3' ' O ' ' A' ' 10' ' ' ASP . 1.1 mtmm -59.42 -14.58 12.72 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.126 -0.984 . . . . 0.0 110.218 -179.852 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 108.2 11.86 23.05 Favored Glycine 0 N--CA 1.49 2.262 0 N-CA-C 109.452 -1.459 . . . . 0.0 109.452 -179.931 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' TYR . . . . . 0.443 ' HB2' ' O ' ' A' ' 11' ' ' CYS . 5.8 m-85 -93.69 -165.08 1.26 Allowed 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.209 -1.171 . . . . 0.0 110.202 179.953 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -113.56 -62.12 1.64 Allowed 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.32 -0.863 . . . . 0.0 109.907 179.888 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . 0.469 ' CE1' ' HB2' ' A' ' 29' ' ' ARG . 1.0 OUTLIER -133.09 159.97 38.54 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.36 -0.837 . . . . 0.0 110.017 179.777 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -137.46 173.61 22.19 Favored Glycine 0 N--CA 1.491 2.306 0 N-CA-C 109.638 -1.385 . . . . 0.0 109.638 -179.799 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 19.3 ttpt -153.35 144.92 23.31 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.278 -1.13 . . . . 0.0 110.0 -179.919 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . 0.463 ' HA ' ' O ' ' A' ' 25' ' ' SER . 83.5 m -84.1 153.75 23.57 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.248 -0.907 . . . . 0.0 110.323 -179.93 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.538 ' O ' ' CG ' ' A' ' 23' ' ' ARG . 58.1 t -150.16 145.52 17.14 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.557 0 O-C-N 121.279 -0.888 . . . . 0.0 110.155 179.947 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . 0.538 ' CG ' ' O ' ' A' ' 22' ' ' VAL . 16.1 ptt180 38.22 33.46 0.06 Allowed 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.632 -0.667 . . . . 0.0 110.697 179.998 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . 0.408 ' N ' ' O ' ' A' ' 22' ' ' VAL . . . 79.91 37.55 22.13 Favored Glycine 0 N--CA 1.489 2.231 0 N-CA-C 109.523 -1.431 . . . . 0.0 109.523 -179.938 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' SER . . . . . 0.485 ' N ' ' O ' ' A' ' 22' ' ' VAL . 7.7 t -138.05 -168.85 2.44 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.268 -1.136 . . . . 0.0 110.173 179.999 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . 0.45 ' HB2' ' SG ' ' A' ' 2' ' ' CYS . 49.4 t -141.15 120.16 12.8 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.26 -0.9 . . . . 0.0 110.265 -179.959 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 24.6 mt-30 -118.75 166.15 13.13 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.232 -0.918 . . . . 0.0 110.208 -179.988 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 18.1 m -128.81 148.59 50.89 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.255 -0.903 . . . . 0.0 110.091 -179.904 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . 0.469 ' HB2' ' CE1' ' A' ' 18' ' ' PHE . 8.4 mmm-85 -129.02 168.02 16.65 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.182 -0.949 . . . . 0.0 110.299 179.969 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 15.2 mtm180 -116.29 -177.65 3.22 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.334 -0.854 . . . . 0.0 110.331 -179.987 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -114.92 160.98 18.89 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.334 -0.854 . . . . 0.0 110.202 179.973 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -142.03 -51.82 0.41 Allowed 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.275 -0.891 . . . . 0.0 110.161 -179.961 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.27 0 CA-C-O 117.968 -1.462 . . . . 0.0 109.531 -179.919 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . 0.469 ' HB3' ' HA2' ' A' ' 24' ' ' GLY . . . . . . . . 0 N--CA 1.491 1.623 0 CA-C-O 121.221 0.534 . . . . 0.0 110.175 . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 16.3 p -100.67 142.21 32.47 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.172 -0.955 . . . . 0.0 110.195 179.927 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 6.2 m120 -100.32 128.05 46.48 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.142 -0.974 . . . . 0.0 110.305 -179.889 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -66.41 -48.56 69.67 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.306 -0.871 . . . . 0.0 110.044 179.909 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . 0.446 ' O ' ' CD1' ' A' ' 9' ' ' LEU . 1.5 ttt85 -62.53 -35.89 80.87 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.295 -0.878 . . . . 0.0 109.723 179.701 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 1.9 t0 -79.53 -20.97 45.83 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.357 -0.839 . . . . 0.0 109.563 179.47 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.417 ' O ' ' HB2' ' A' ' 11' ' ' CYS . 7.5 t -80.34 -45.71 17.33 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.432 -0.793 . . . . 0.0 109.874 179.639 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' SER . . . . . 0.448 ' HB3' HD12 ' A' ' 12' ' ' ILE . 0.4 OUTLIER -68.35 -44.28 75.58 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.428 -0.795 . . . . 0.0 110.207 -179.971 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . 0.446 ' CD1' ' O ' ' A' ' 5' ' ' ARG . 0.2 OUTLIER -53.99 -43.43 69.99 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.272 -0.893 . . . . 0.0 110.023 179.939 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . 0.47 ' O ' ' HG3' ' A' ' 14' ' ' LYS . 11.5 t0 -74.02 -43.5 57.75 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.319 -0.863 . . . . 0.0 110.255 179.953 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.417 ' HB2' ' O ' ' A' ' 7' ' ' CYS . 0.0 OUTLIER -66.48 -39.95 89.04 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.166 -0.959 . . . . 0.0 110.433 -179.779 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . 0.448 HD12 ' HB3' ' A' ' 8' ' ' SER . 14.3 mt -63.4 -47.05 93.65 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.672 0 O-C-N 121.141 -0.975 . . . . 0.0 110.034 179.962 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -64.41 -25.32 67.97 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.156 -0.965 . . . . 0.0 109.83 179.719 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . 0.47 ' HG3' ' O ' ' A' ' 10' ' ' ASP . 3.4 mttt -73.29 -36.75 66.36 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.293 -0.879 . . . . 0.0 110.151 179.78 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 147.47 -13.78 1.4 Allowed Glycine 0 N--CA 1.491 2.349 0 N-CA-C 109.666 -1.374 . . . . 0.0 109.666 179.941 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' TYR . . . . . 0.47 ' CE2' ' HD2' ' A' ' 30' ' ' ARG . 85.6 m-85 -74.05 -168.7 0.65 Allowed 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.117 -1.225 . . . . 0.0 110.299 179.997 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . 0.553 ' HB3' ' CD2' ' A' ' 18' ' ' PHE . 0.7 OUTLIER -132.12 -53.06 0.97 Allowed 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.193 -0.942 . . . . 0.0 110.339 -179.967 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . 0.578 ' CE1' ' HB2' ' A' ' 29' ' ' ARG . 9.4 p90 -141.62 152.82 44.33 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.138 -0.977 . . . . 0.0 110.428 179.928 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -148.72 -152.18 5.65 Favored Glycine 0 N--CA 1.489 2.222 0 N-CA-C 109.565 -1.414 . . . . 0.0 109.565 179.977 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.47 ' O ' ' HA ' ' A' ' 26' ' ' CYS . 0.0 OUTLIER -174.18 149.42 1.42 Allowed 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.267 -1.137 . . . . 0.0 110.096 -179.989 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -90.14 129.04 36.47 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.258 -0.901 . . . . 0.0 110.322 179.977 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.453 ' N ' ' O ' ' A' ' 25' ' ' SER . 54.0 t -111.08 94.1 2.91 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.58 0 O-C-N 121.264 -0.898 . . . . 0.0 110.33 -179.955 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . 0.448 ' HB2' ' O ' ' A' ' 22' ' ' VAL . 5.4 mtt-85 61.32 -88.67 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.328 -0.858 . . . . 0.0 110.506 179.863 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . 0.469 ' HA2' ' HB3' ' A' ' 1' ' ' ALA . . . -119.94 24.21 7.97 Favored Glycine 0 N--CA 1.489 2.197 0 N-CA-C 109.784 -1.327 . . . . 0.0 109.784 -179.703 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' SER . . . . . 0.453 ' O ' ' N ' ' A' ' 22' ' ' VAL . 0.3 OUTLIER -147.98 -174.54 4.59 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.165 -1.197 . . . . 0.0 110.076 179.856 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . 0.47 ' HA ' ' O ' ' A' ' 20' ' ' LYS . 9.2 t -149.67 150.7 32.54 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.257 -0.902 . . . . 0.0 110.48 179.942 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.43 ' O ' ' SG ' ' A' ' 28' ' ' CYS . 12.5 mt-30 -113.5 175.25 5.53 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.381 -0.824 . . . . 0.0 109.763 179.64 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . 0.43 ' SG ' ' O ' ' A' ' 27' ' ' GLN . 7.5 m -155.66 141.4 18.0 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.214 -0.929 . . . . 0.0 110.339 -179.883 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . 0.578 ' HB2' ' CE1' ' A' ' 18' ' ' PHE . 1.0 OUTLIER -134.1 137.63 44.71 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.31 -0.869 . . . . 0.0 110.109 -179.974 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.47 ' HD2' ' CE2' ' A' ' 16' ' ' TYR . 0.4 OUTLIER -100.22 174.8 5.97 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.299 -0.876 . . . . 0.0 110.415 -179.811 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 22.1 p -97.5 138.47 34.88 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.343 -0.848 . . . . 0.0 110.158 179.972 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 3.2 m -112.26 27.06 9.98 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.212 -0.93 . . . . 0.0 110.24 -179.985 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.267 0 N-CA-C 109.5 -1.44 . . . . 0.0 109.5 179.92 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.577 0 CA-C-O 121.295 0.569 . . . . 0.0 110.194 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . 0.453 ' SG ' ' HB2' ' A' ' 26' ' ' CYS . 39.6 t -97.98 116.96 31.25 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.202 -0.937 . . . . 0.0 110.124 179.943 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 10.8 m120 -83.56 115.15 21.98 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.308 -0.87 . . . . 0.0 110.136 179.96 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -58.03 -21.74 46.57 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.267 -0.896 . . . . 0.0 110.147 179.96 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . 0.443 ' O ' ' HB2' ' A' ' 9' ' ' LEU . 0.0 OUTLIER -78.51 -45.62 21.54 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.21 -0.931 . . . . 0.0 110.097 179.975 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 21.0 m-20 -79.03 -18.41 53.6 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.244 -0.91 . . . . 0.0 109.818 179.791 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.473 ' O ' ' HB2' ' A' ' 11' ' ' CYS . 8.1 t -78.37 -54.08 6.58 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.345 -0.847 . . . . 0.0 109.947 179.801 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' SER . . . . . 0.451 ' O ' HG13 ' A' ' 12' ' ' ILE . 0.3 OUTLIER -64.58 -42.03 95.88 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.288 -0.882 . . . . 0.0 110.133 179.932 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . 0.443 ' HB2' ' O ' ' A' ' 5' ' ' ARG . 0.3 OUTLIER -54.05 -51.85 62.73 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.146 -0.971 . . . . 0.0 110.231 -179.997 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 2.4 t0 -69.36 -38.77 78.24 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.278 -0.889 . . . . 0.0 110.417 -179.923 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.473 ' HB2' ' O ' ' A' ' 7' ' ' CYS . 0.1 OUTLIER -66.58 -39.79 88.62 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.159 -0.963 . . . . 0.0 110.132 -179.957 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . 0.451 HG13 ' O ' ' A' ' 8' ' ' SER . 15.5 mt -63.63 -38.72 83.0 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.563 0 O-C-N 121.278 -0.889 . . . . 0.0 109.833 179.87 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 2.6 mmm -69.87 -28.87 66.01 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.271 -0.893 . . . . 0.0 109.999 179.715 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -67.15 -32.06 72.91 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.255 -0.903 . . . . 0.0 110.205 179.836 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 138.25 -7.51 3.44 Favored Glycine 0 N--CA 1.491 2.313 0 N-CA-C 109.581 -1.408 . . . . 0.0 109.581 -179.823 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 97.2 m-85 -80.09 -163.73 0.59 Allowed 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.135 -1.215 . . . . 0.0 110.242 179.914 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . 0.585 ' HB3' ' CD2' ' A' ' 18' ' ' PHE . 0.7 OUTLIER -133.11 -63.31 0.77 Allowed 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.297 -0.877 . . . . 0.0 110.203 179.871 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . 0.585 ' CD2' ' HB3' ' A' ' 17' ' ' ASN . 5.4 p90 -133.89 145.75 49.92 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.12 -0.988 . . . . 0.0 110.38 179.78 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . 0.478 ' CA ' ' HA ' ' A' ' 28' ' ' CYS . . . -140.29 -150.51 5.47 Favored Glycine 0 N--CA 1.489 2.219 0 N-CA-C 109.529 -1.428 . . . . 0.0 109.529 -179.973 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 4.1 tttm -173.61 152.97 2.18 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.179 -1.189 . . . . 0.0 110.265 179.932 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . 0.433 ' SG ' ' SG ' ' A' ' 26' ' ' CYS . 22.1 m -91.31 144.27 25.78 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.346 -0.846 . . . . 0.0 110.315 179.969 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.419 ' O ' ' HB2' ' A' ' 23' ' ' ARG . 39.2 t -139.25 115.73 9.92 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.67 0 O-C-N 121.323 -0.86 . . . . 0.0 110.159 179.919 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . 0.419 ' HB2' ' O ' ' A' ' 22' ' ' VAL . 0.1 OUTLIER 56.31 -92.85 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.344 -0.848 . . . . 0.0 110.3 179.939 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -131.65 23.62 4.21 Favored Glycine 0 N--CA 1.49 2.238 0 N-CA-C 109.456 -1.457 . . . . 0.0 109.456 -179.955 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 4.0 t -142.34 172.47 12.65 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.226 -1.161 . . . . 0.0 109.931 179.872 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . 0.453 ' HB2' ' SG ' ' A' ' 2' ' ' CYS . 1.0 OUTLIER -138.46 145.37 40.8 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.084 -1.01 . . . . 0.0 110.837 -179.749 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.45 ' O ' ' SG ' ' A' ' 28' ' ' CYS . 14.1 mm-40 -119.97 170.18 9.5 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.34 -0.85 . . . . 0.0 109.791 179.572 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . 0.478 ' HA ' ' CA ' ' A' ' 19' ' ' GLY . 96.6 m -150.4 157.93 43.59 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.076 -1.015 . . . . 0.0 110.452 -179.949 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . 0.574 ' HB2' ' CE1' ' A' ' 18' ' ' PHE . 9.7 mtp180 -128.96 159.59 35.38 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.207 -0.933 . . . . 0.0 110.395 179.967 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -107.48 154.78 20.86 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.205 -0.935 . . . . 0.0 110.143 179.866 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' THR . . . . . 0.519 ' CG2' ' OD1' ' A' ' 17' ' ' ASN . 44.0 p -79.57 -170.63 2.43 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.203 -0.936 . . . . 0.0 110.106 -179.986 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 2.8 m -104.55 -163.02 0.93 Allowed 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.334 -0.854 . . . . 0.0 110.205 179.936 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.344 0 N-CA-C 109.456 -1.458 . . . . 0.0 109.456 -179.997 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.576 0 CA-C-O 121.245 0.545 . . . . 0.0 110.209 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . 0.439 ' O ' ' CB ' ' A' ' 3' ' ' ASN . 16.4 p -93.74 11.8 27.85 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.344 -0.847 . . . . 0.0 110.025 -179.965 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . 0.439 ' CB ' ' O ' ' A' ' 2' ' ' CYS . 1.0 OUTLIER 66.16 84.78 0.15 Allowed 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.272 -0.893 . . . . 0.0 109.872 -179.829 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -53.02 -40.42 63.86 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.314 -0.866 . . . . 0.0 110.372 -179.792 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . 0.404 ' O ' HD11 ' A' ' 9' ' ' LEU . 8.0 ptm180 -62.35 -36.35 81.95 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.172 -0.955 . . . . 0.0 110.093 -179.916 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 22.7 t0 -81.16 -12.75 59.13 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.232 -0.917 . . . . 0.0 109.915 179.717 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.416 ' O ' ' SG ' ' A' ' 11' ' ' CYS . 0.8 OUTLIER -82.44 -39.76 22.14 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.324 -0.86 . . . . 0.0 110.095 179.923 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' SER . . . . . 0.418 ' OG ' HD13 ' A' ' 12' ' ' ILE . 2.2 t -84.52 -35.15 23.09 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.312 -0.867 . . . . 0.0 110.001 179.918 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . 0.404 HD11 ' O ' ' A' ' 5' ' ' ARG . 5.6 mt -65.01 -46.91 79.41 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.353 -0.842 . . . . 0.0 109.992 179.808 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -64.16 -39.78 94.72 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.166 -0.959 . . . . 0.0 110.062 179.767 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.416 ' SG ' ' O ' ' A' ' 7' ' ' CYS . 82.5 m -67.37 -41.28 85.33 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.282 -0.886 . . . . 0.0 110.21 179.807 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . 0.418 HD13 ' OG ' ' A' ' 8' ' ' SER . 53.6 mt -66.81 -44.0 89.4 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.603 0 O-C-N 121.297 -0.877 . . . . 0.0 110.258 179.981 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -69.1 -20.24 64.07 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.14 -0.975 . . . . 0.0 110.096 -179.962 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.61 -21.48 60.31 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.266 -0.896 . . . . 0.0 110.253 -179.961 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 124.32 -1.0 8.9 Favored Glycine 0 N--CA 1.491 2.328 0 N-CA-C 109.749 -1.341 . . . . 0.0 109.749 179.823 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' TYR . . . . . 0.445 ' N ' ' CD1' ' A' ' 16' ' ' TYR . 30.4 m-85 -89.09 -158.69 0.52 Allowed 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.138 -1.213 . . . . 0.0 110.236 -179.998 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . 0.576 ' HB3' ' CD2' ' A' ' 18' ' ' PHE . 5.3 t30 -120.1 -40.7 2.69 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.146 -0.971 . . . . 0.0 110.239 179.978 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . 0.576 ' CD2' ' HB3' ' A' ' 17' ' ' ASN . 12.3 p90 -157.1 158.01 35.6 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.127 -0.983 . . . . 0.0 110.404 179.874 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . 0.441 ' O ' ' HB3' ' A' ' 20' ' ' LYS . . . -138.88 -165.12 10.15 Favored Glycine 0 N--CA 1.492 2.37 0 N-CA-C 109.427 -1.469 . . . . 0.0 109.427 179.993 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.441 ' HB3' ' O ' ' A' ' 19' ' ' GLY . 0.0 OUTLIER -176.75 163.04 2.25 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.264 -1.139 . . . . 0.0 110.207 179.965 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . 0.524 ' O ' ' CG2' ' A' ' 22' ' ' VAL . 2.8 t -92.03 155.7 17.92 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.331 -0.856 . . . . 0.0 110.375 -179.93 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.524 ' CG2' ' O ' ' A' ' 21' ' ' CYS . 73.0 t -157.48 103.63 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.567 0 O-C-N 121.319 -0.863 . . . . 0.0 110.027 179.785 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . 0.44 ' HB2' ' O ' ' A' ' 22' ' ' VAL . 0.0 OUTLIER 57.87 66.15 1.18 Allowed 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.219 -0.926 . . . . 0.0 110.122 -179.854 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 50.48 44.59 45.93 Favored Glycine 0 N--CA 1.491 2.344 0 N-CA-C 109.499 -1.44 . . . . 0.0 109.499 -179.975 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' SER . . . . . 0.405 ' O ' ' SG ' ' A' ' 21' ' ' CYS . 0.2 OUTLIER -142.26 164.91 28.86 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.203 -1.175 . . . . 0.0 110.209 179.988 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -134.93 111.21 9.65 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.242 -0.911 . . . . 0.0 110.09 179.938 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -117.77 168.06 10.81 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.368 -0.833 . . . . 0.0 110.273 -179.793 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 23.3 m -124.44 142.71 51.1 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.301 -0.875 . . . . 0.0 110.05 179.84 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . 0.509 ' CZ ' ' HA ' ' A' ' 29' ' ' ARG . 3.8 mmp_? -129.72 136.43 49.66 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.194 -0.942 . . . . 0.0 110.25 -179.933 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 10.4 mtp85 -98.69 -172.63 2.35 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.242 -0.911 . . . . 0.0 110.226 -179.941 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -116.17 -26.05 7.37 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.277 -0.889 . . . . 0.0 110.227 179.997 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -106.35 -178.19 3.58 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.254 -0.904 . . . . 0.0 110.3 179.999 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.239 0 N-CA-C 109.569 -1.412 . . . . 0.0 109.569 179.967 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.672 0 CA-C-O 121.16 0.505 . . . . 0.0 110.254 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . 0.415 ' C ' ' SG ' ' A' ' 21' ' ' CYS . 7.2 t -83.71 83.08 8.04 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.364 -0.835 . . . . 0.0 110.115 179.93 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . 0.469 ' O ' ' HB3' ' A' ' 7' ' ' CYS . 0.8 OUTLIER -126.44 129.61 49.05 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.387 -0.821 . . . . 0.0 110.036 -179.971 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 10.4 m-20 -54.64 -41.9 70.63 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.275 -0.89 . . . . 0.0 110.675 -179.749 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . 0.461 ' O ' ' HB2' ' A' ' 9' ' ' LEU . 3.0 ttt180 -81.88 -35.34 29.35 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.13 -0.981 . . . . 0.0 110.264 -179.808 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . 0.452 ' O ' ' HB2' ' A' ' 10' ' ' ASP . 3.0 t70 -79.4 -25.66 42.08 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.357 -0.839 . . . . 0.0 110.167 -179.943 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.469 ' HB3' ' O ' ' A' ' 3' ' ' ASN . 17.0 t -87.25 -42.11 13.19 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.316 -0.865 . . . . 0.0 110.067 179.937 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' SER . . . . . 0.468 ' O ' ' CG1' ' A' ' 12' ' ' ILE . 84.6 p -67.92 -46.49 71.4 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.366 -0.834 . . . . 0.0 110.285 -179.854 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . 0.461 ' HB2' ' O ' ' A' ' 5' ' ' ARG . 3.0 mt -65.27 -38.3 89.87 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.181 -0.949 . . . . 0.0 110.414 -179.883 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . 0.452 ' HB2' ' O ' ' A' ' 6' ' ' ASP . 26.1 m-20 -74.11 -48.82 27.0 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.213 -0.929 . . . . 0.0 110.502 -179.844 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.496 ' SG ' ' CB ' ' A' ' 16' ' ' TYR . 53.0 t -68.71 -39.18 80.57 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.185 -0.947 . . . . 0.0 110.631 -179.764 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . 0.468 ' CG1' ' O ' ' A' ' 8' ' ' SER . 46.8 mt -63.48 -39.3 84.8 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.553 0 O-C-N 121.095 -1.003 . . . . 0.0 110.152 179.942 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' MET . . . . . 0.423 ' HB2' ' O ' ' A' ' 9' ' ' LEU . 5.4 ttm -77.85 -19.07 55.51 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.243 -0.91 . . . . 0.0 109.981 179.759 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.11 -24.47 61.49 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.299 -0.876 . . . . 0.0 110.128 179.849 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 132.49 -2.93 5.03 Favored Glycine 0 N--CA 1.49 2.239 0 N-CA-C 109.559 -1.416 . . . . 0.0 109.559 -179.969 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' TYR . . . . . 0.565 ' CD1' ' HB3' ' A' ' 28' ' ' CYS . 82.2 m-85 -82.22 -172.24 3.87 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.287 -1.126 . . . . 0.0 110.183 -179.956 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . 0.52 ' C ' ' CD1' ' A' ' 18' ' ' PHE . 1.8 t-20 -127.18 -32.13 2.52 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.244 -0.91 . . . . 0.0 110.269 -179.935 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . 0.52 ' CD1' ' C ' ' A' ' 17' ' ' ASN . 2.9 m-85 -123.84 169.47 11.54 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.123 -0.986 . . . . 0.0 110.37 -179.912 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -156.67 129.12 2.34 Favored Glycine 0 N--CA 1.491 2.341 0 N-CA-C 109.439 -1.464 . . . . 0.0 109.439 179.853 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.446 ' O ' ' SG ' ' A' ' 26' ' ' CYS . 32.8 tttp -144.5 140.91 29.17 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.131 -1.217 . . . . 0.0 110.367 -179.843 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . 0.471 ' HA ' ' HA ' ' A' ' 26' ' ' CYS . 0.0 OUTLIER -97.58 131.62 44.0 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.185 -0.947 . . . . 0.0 110.206 -179.993 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.464 HG21 ' O ' ' A' ' 21' ' ' CYS . 54.2 t -151.23 127.83 2.01 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.615 0 O-C-N 121.149 -0.969 . . . . 0.0 110.471 179.998 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . 0.443 ' CB ' ' O ' ' A' ' 22' ' ' VAL . 14.9 ttp180 64.56 57.51 1.11 Allowed 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.32 -0.863 . . . . 0.0 110.314 179.829 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 50.24 22.19 4.81 Favored Glycine 0 N--CA 1.49 2.285 0 N-CA-C 109.5 -1.44 . . . . 0.0 109.5 -179.973 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' SER . . . . . 0.447 ' O ' ' N ' ' A' ' 22' ' ' VAL . 41.3 m -142.2 177.94 7.89 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.348 -1.089 . . . . 0.0 109.915 -179.986 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . 0.471 ' HA ' ' HA ' ' A' ' 21' ' ' CYS . 0.7 OUTLIER -136.8 143.13 43.02 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.145 -0.972 . . . . 0.0 110.392 179.998 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 2.4 mt-30 -115.19 156.3 25.59 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.309 -0.869 . . . . 0.0 109.971 179.821 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . 0.565 ' HB3' ' CD1' ' A' ' 16' ' ' TYR . 32.1 m -125.37 171.27 10.57 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.258 -0.901 . . . . 0.0 110.314 -179.861 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -143.19 139.66 30.4 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.376 -0.828 . . . . 0.0 110.033 179.891 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -108.85 117.19 33.55 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.218 -0.926 . . . . 0.0 110.252 -179.998 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' THR . . . . . 0.425 ' OG1' ' N ' ' A' ' 32' ' ' SER . 3.3 t -77.83 -164.61 0.53 Allowed 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.322 -0.861 . . . . 0.0 110.259 -179.976 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' SER . . . . . 0.425 ' N ' ' OG1' ' A' ' 31' ' ' THR . 37.4 t -125.25 169.14 12.56 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.253 -0.905 . . . . 0.0 110.155 179.924 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.22 0 CA-C-O 117.988 -1.451 . . . . 0.0 109.543 -179.961 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.575 0 CA-C-O 121.239 0.542 . . . . 0.0 110.211 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . 0.464 ' O ' ' O ' ' A' ' 3' ' ' ASN . 16.7 p -106.07 -34.94 7.4 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.17 -0.956 . . . . 0.0 110.301 179.984 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . 0.475 ' O ' ' HB2' ' A' ' 7' ' ' CYS . 2.1 m-20 58.89 124.53 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.289 -0.882 . . . . 0.0 110.54 179.683 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . 0.424 ' HA ' ' HB3' ' A' ' 7' ' ' CYS . 23.7 m-20 -80.14 -24.82 40.19 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.159 -0.963 . . . . 0.0 110.227 179.811 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 5.3 ttt180 -63.81 -60.77 2.86 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.329 -0.857 . . . . 0.0 110.471 -179.831 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 5.6 t70 -79.65 6.31 10.99 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.232 -0.918 . . . . 0.0 110.155 -179.943 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.475 ' HB2' ' O ' ' A' ' 3' ' ' ASN . 4.9 t -99.58 -36.05 9.65 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.347 -0.846 . . . . 0.0 110.073 179.89 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -93.26 -29.3 15.75 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.314 -0.866 . . . . 0.0 110.22 179.923 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 2.7 mt -55.27 -55.65 29.04 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.31 -0.869 . . . . 0.0 110.332 -179.937 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 3.1 t0 -65.62 -35.97 82.37 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.156 -0.965 . . . . 0.0 110.369 -179.877 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -66.67 -49.47 66.07 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.255 -0.903 . . . . 0.0 110.2 179.997 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . 0.462 HG23 ' O ' ' A' ' 12' ' ' ILE . 61.2 mt -63.65 -24.1 35.0 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.637 0 O-C-N 121.328 -0.858 . . . . 0.0 109.894 179.855 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 2.7 mtt -79.66 -26.55 41.0 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.314 -0.866 . . . . 0.0 110.003 179.801 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.21 -25.79 60.9 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.274 -0.891 . . . . 0.0 110.102 179.907 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 134.51 -9.04 4.65 Favored Glycine 0 N--CA 1.491 2.331 0 N-CA-C 109.62 -1.392 . . . . 0.0 109.62 179.986 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 23.1 m-85 -68.02 -158.45 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.159 -1.201 . . . . 0.0 110.165 -179.98 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . 0.583 ' HB3' ' CD2' ' A' ' 18' ' ' PHE . 0.1 OUTLIER -135.71 -53.1 0.76 Allowed 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.343 -0.848 . . . . 0.0 110.118 179.953 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . 0.583 ' CD2' ' HB3' ' A' ' 17' ' ' ASN . 6.1 p90 -152.93 157.61 40.88 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.226 -0.921 . . . . 0.0 110.37 179.799 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . 0.421 ' HA3' ' HA ' ' A' ' 28' ' ' CYS . . . -154.05 -160.5 9.83 Favored Glycine 0 N--CA 1.49 2.24 0 N-CA-C 109.474 -1.45 . . . . 0.0 109.474 179.883 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -172.75 176.02 3.25 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.097 -1.237 . . . . 0.0 110.335 179.981 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . 0.448 ' SG ' ' O ' ' A' ' 25' ' ' SER . 8.4 t -83.99 132.9 34.71 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.29 -0.881 . . . . 0.0 110.317 179.943 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.462 ' O ' ' HB2' ' A' ' 25' ' ' SER . 71.0 t -118.27 92.13 2.04 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.675 0 O-C-N 121.293 -0.879 . . . . 0.0 110.254 -179.947 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . 0.466 ' O ' ' OG ' ' A' ' 25' ' ' SER . 4.7 tmm_? 50.81 84.15 0.04 OUTLIER 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.311 -0.868 . . . . 0.0 110.363 179.909 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 51.62 22.71 8.58 Favored Glycine 0 N--CA 1.49 2.24 0 N-CA-C 109.69 -1.364 . . . . 0.0 109.69 179.964 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' SER . . . . . 0.466 ' OG ' ' O ' ' A' ' 23' ' ' ARG . 1.1 m -135.78 -161.66 1.18 Allowed 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.333 -1.098 . . . . 0.0 109.718 179.794 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -167.03 124.62 1.26 Allowed 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.231 -0.918 . . . . 0.0 110.677 179.937 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.446 ' O ' ' SG ' ' A' ' 28' ' ' CYS . 33.8 mm-40 -119.06 -179.86 3.95 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.427 -0.796 . . . . 0.0 109.694 179.639 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . 0.446 ' SG ' ' O ' ' A' ' 27' ' ' GLN . 84.3 m -149.49 157.9 43.7 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.114 -0.991 . . . . 0.0 109.914 179.921 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . 0.57 ' HB2' ' CE1' ' A' ' 18' ' ' PHE . 6.2 mmm180 -134.31 156.52 48.32 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.105 -0.997 . . . . 0.0 110.483 -179.642 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -113.21 174.23 6.01 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.292 -0.88 . . . . 0.0 110.122 179.92 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -80.28 -87.12 0.08 Allowed 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.158 -0.964 . . . . 0.0 110.216 179.922 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 10.6 t -132.99 50.18 2.26 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.271 -0.893 . . . . 0.0 110.237 -179.975 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.267 0 N-CA-C 109.554 -1.418 . . . . 0.0 109.554 -179.96 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.639 0 CA-C-O 121.265 0.555 . . . . 0.0 110.415 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . 0.425 ' O ' ' CB ' ' A' ' 3' ' ' ASN . 20.6 p -77.86 176.0 9.49 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.268 -0.895 . . . . 0.0 110.269 179.956 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . 0.467 ' O ' ' N ' ' A' ' 7' ' ' CYS . 0.8 OUTLIER 173.66 137.76 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.195 -0.941 . . . . 0.0 110.251 -179.969 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -53.36 -34.96 59.67 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.122 -0.986 . . . . 0.0 110.203 -179.989 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -78.4 -39.69 38.22 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.279 -0.888 . . . . 0.0 110.415 -179.946 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 4.3 t0 -84.8 -19.02 33.18 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.301 -0.875 . . . . 0.0 110.287 -179.889 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.467 ' N ' ' O ' ' A' ' 3' ' ' ASN . 10.1 t -87.64 -27.9 22.2 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.235 -0.916 . . . . 0.0 110.113 179.977 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 6.0 t -92.41 -33.04 14.7 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.285 -0.884 . . . . 0.0 110.337 -179.882 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -57.02 -55.9 28.75 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.173 -0.954 . . . . 0.0 110.284 -179.792 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -67.09 -38.22 85.32 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.15 -0.969 . . . . 0.0 110.179 -179.949 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.418 ' SG ' ' O ' ' A' ' 7' ' ' CYS . 55.0 m -68.11 -44.74 75.47 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.285 -0.885 . . . . 0.0 110.185 -179.975 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . 0.477 HD11 HG22 ' A' ' 12' ' ' ILE . 19.8 mt -63.56 -41.13 91.57 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.589 0 O-C-N 121.187 -0.945 . . . . 0.0 109.997 179.882 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -69.08 -34.77 75.65 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.27 -0.894 . . . . 0.0 110.024 179.83 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -65.85 -57.12 8.66 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.294 -0.879 . . . . 0.0 109.945 179.832 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 159.91 36.65 0.02 OUTLIER Glycine 0 N--CA 1.491 2.352 0 N-CA-C 109.663 -1.375 . . . . 0.0 109.663 -179.991 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' TYR . . . . . 0.439 ' CD2' ' HG2' ' A' ' 30' ' ' ARG . 36.8 m-85 -113.09 -173.43 2.25 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.154 -1.203 . . . . 0.0 110.19 -179.996 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . 0.537 ' CG ' ' CE2' ' A' ' 18' ' ' PHE . 7.8 p30 -121.81 -34.92 3.29 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.312 -0.867 . . . . 0.0 109.942 179.662 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . 0.57 ' CE1' ' HB2' ' A' ' 29' ' ' ARG . 3.3 p90 -164.77 154.25 13.3 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.327 -0.858 . . . . 0.0 110.051 179.804 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . 0.458 ' O ' ' HB3' ' A' ' 20' ' ' LYS . . . -155.04 -162.77 11.49 Favored Glycine 0 N--CA 1.491 2.301 0 N-CA-C 109.391 -1.484 . . . . 0.0 109.391 179.997 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.458 ' HB3' ' O ' ' A' ' 19' ' ' GLY . 0.0 OUTLIER 178.45 165.7 0.8 Allowed 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.214 -1.168 . . . . 0.0 110.19 179.974 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . 0.461 ' HA ' ' O ' ' A' ' 25' ' ' SER . 39.3 t -83.0 145.67 29.19 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.2 -0.937 . . . . 0.0 109.968 179.839 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.431 ' O ' ' C ' ' A' ' 23' ' ' ARG . 92.5 t -138.47 126.46 29.08 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.597 0 O-C-N 121.197 -0.939 . . . . 0.0 110.393 -179.915 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . 0.431 ' C ' ' O ' ' A' ' 22' ' ' VAL . 3.0 ttp180 42.15 39.74 1.48 Allowed 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.259 -0.9 . . . . 0.0 110.149 -179.989 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 79.91 31.55 39.18 Favored Glycine 0 N--CA 1.49 2.281 0 N-CA-C 109.318 -1.513 . . . . 0.0 109.318 -179.879 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' SER . . . . . 0.461 ' O ' ' HA ' ' A' ' 21' ' ' CYS . 44.2 m -128.63 -164.19 1.36 Allowed 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.281 -1.129 . . . . 0.0 110.025 179.967 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 7.3 t -153.11 97.33 2.17 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.274 -0.891 . . . . 0.0 109.979 179.951 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.431 ' O ' ' SG ' ' A' ' 28' ' ' CYS . 14.5 mm-40 -106.67 164.26 12.23 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.294 -0.879 . . . . 0.0 110.522 -179.792 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . 0.431 ' SG ' ' O ' ' A' ' 27' ' ' GLN . 81.0 m -149.5 161.58 41.83 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.357 -0.84 . . . . 0.0 109.843 179.891 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . 0.57 ' HB2' ' CE1' ' A' ' 18' ' ' PHE . 14.2 mmm180 -123.28 164.35 18.95 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.156 -0.965 . . . . 0.0 110.328 -179.888 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.472 ' C ' ' ND2' ' A' ' 17' ' ' ASN . 59.4 mtp180 -119.24 160.32 22.4 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.241 -0.912 . . . . 0.0 110.065 179.855 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' THR . . . . . 0.444 HG22 ' HB3' ' A' ' 17' ' ' ASN . 49.3 p -76.83 -173.45 2.66 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.184 -0.947 . . . . 0.0 110.217 -179.923 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 16.2 m -93.7 85.81 4.96 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.286 -0.884 . . . . 0.0 110.172 -179.976 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.281 0 CA-C-O 117.972 -1.46 . . . . 0.0 109.532 179.932 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.592 0 CA-C-O 121.277 0.561 . . . . 0.0 110.179 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . 0.417 ' O ' ' C ' ' A' ' 3' ' ' ASN . 21.4 p -98.72 48.01 0.98 Allowed 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.167 -0.958 . . . . 0.0 110.296 179.959 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . 0.442 ' O ' ' HB2' ' A' ' 7' ' ' CYS . 3.3 m-20 -42.93 149.66 0.19 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.221 -0.924 . . . . 0.0 110.19 -179.927 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 19.7 m-20 -68.55 -33.19 73.67 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.233 -0.917 . . . . 0.0 110.246 179.983 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 2.1 mtp180 -72.22 -41.57 66.74 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.245 -0.909 . . . . 0.0 110.177 179.97 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -79.92 3.16 20.77 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.239 -0.913 . . . . 0.0 110.196 179.879 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.442 ' HB2' ' O ' ' A' ' 3' ' ' ASN . 7.0 t -107.97 -30.46 8.45 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.182 -0.949 . . . . 0.0 110.227 -179.923 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -93.46 -43.33 8.79 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.216 -0.928 . . . . 0.0 110.186 -179.839 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 47.3 mt -56.37 -49.61 73.92 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.214 -0.929 . . . . 0.0 110.298 -179.787 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 56.8 t0 -64.43 -45.94 85.35 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.261 -0.899 . . . . 0.0 110.289 -179.838 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.435 ' O ' ' HB2' ' A' ' 14' ' ' LYS . 0.5 OUTLIER -66.21 -32.98 74.73 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.315 -0.866 . . . . 0.0 110.184 -179.896 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 24.2 mt -63.41 -39.36 85.02 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.547 0 O-C-N 121.19 -0.944 . . . . 0.0 109.373 179.616 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 4.6 ttm -71.18 -27.62 63.65 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.364 -0.835 . . . . 0.0 109.397 179.274 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . 0.435 ' HB2' ' O ' ' A' ' 11' ' ' CYS . 2.7 mmpt? -63.47 -35.6 80.98 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.411 -0.806 . . . . 0.0 110.094 179.61 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 133.27 2.02 3.81 Favored Glycine 0 N--CA 1.491 2.34 0 N-CA-C 110.141 -1.184 . . . . 0.0 110.141 179.875 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' TYR . . . . . 0.483 ' HA ' ' CG ' ' A' ' 30' ' ' ARG . 17.8 m-85 -85.86 -167.58 1.91 Allowed 'General case' 0 N--CA 1.49 1.563 0 O-C-N 120.915 -1.344 . . . . 0.0 110.145 179.919 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . 0.573 ' HB3' ' CD2' ' A' ' 18' ' ' PHE . 0.7 OUTLIER -112.78 -62.52 1.57 Allowed 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.331 -0.856 . . . . 0.0 109.944 179.713 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . 0.573 ' CD2' ' HB3' ' A' ' 17' ' ' ASN . 7.5 p90 -143.71 151.66 40.32 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.274 -0.892 . . . . 0.0 110.142 179.597 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . 0.5 ' CA ' ' HA ' ' A' ' 28' ' ' CYS . . . -149.52 -164.6 11.79 Favored Glycine 0 N--CA 1.49 2.26 0 N-CA-C 109.501 -1.44 . . . . 0.0 109.501 -179.994 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.412 ' HB3' ' O ' ' A' ' 19' ' ' GLY . 0.0 OUTLIER -178.42 178.56 0.85 Allowed 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.226 -1.161 . . . . 0.0 110.111 179.972 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . 0.444 ' HA ' ' O ' ' A' ' 25' ' ' SER . 50.8 t -83.41 152.94 24.77 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.206 -0.934 . . . . 0.0 110.111 179.99 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.537 ' CG2' ' HB2' ' A' ' 27' ' ' GLN . 46.8 t -127.6 69.85 0.38 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.593 0 O-C-N 121.235 -0.916 . . . . 0.0 110.396 -179.994 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . 0.429 ' CB ' ' O ' ' A' ' 22' ' ' VAL . 0.4 OUTLIER 66.13 50.14 1.44 Allowed 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.275 -0.89 . . . . 0.0 110.368 179.849 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 94.53 16.95 40.83 Favored Glycine 0 N--CA 1.491 2.301 0 N-CA-C 109.674 -1.37 . . . . 0.0 109.674 179.857 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' SER . . . . . 0.444 ' O ' ' HA ' ' A' ' 21' ' ' CYS . 0.6 OUTLIER -133.49 -166.32 1.76 Allowed 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.1 -1.235 . . . . 0.0 110.154 179.922 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 0.3 OUTLIER -148.36 105.49 3.62 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.154 -0.966 . . . . 0.0 110.27 -179.973 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.537 ' HB2' ' CG2' ' A' ' 22' ' ' VAL . 3.2 mm100 -105.89 179.34 4.3 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.17 -0.956 . . . . 0.0 110.277 179.927 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . 0.5 ' HA ' ' CA ' ' A' ' 19' ' ' GLY . 66.4 m -151.9 164.76 36.44 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.348 -0.845 . . . . 0.0 109.929 179.817 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . 0.489 ' CB ' ' CE1' ' A' ' 18' ' ' PHE . 0.0 OUTLIER -142.97 133.04 24.32 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.055 -1.028 . . . . 0.0 110.47 179.975 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.483 ' CG ' ' HA ' ' A' ' 16' ' ' TYR . 9.4 mtm180 -111.49 166.72 10.89 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.357 -0.839 . . . . 0.0 110.253 179.988 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 33.6 p -94.75 147.95 22.8 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.248 -0.907 . . . . 0.0 110.16 179.929 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' SER . . . . . 0.471 ' OG ' ' N ' ' A' ' 33' ' ' GLY . 1.1 p -129.4 -153.45 0.57 Allowed 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.181 -0.949 . . . . 0.0 110.243 179.98 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . 0.471 ' N ' ' OG ' ' A' ' 32' ' ' SER . . . . . . . . 0 N--CA 1.491 2.304 0 CA-C-O 117.976 -1.458 . . . . 0.0 109.535 -179.975 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.629 0 CA-C-O 121.469 0.652 . . . . 0.0 110.319 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . 0.435 ' O ' ' SG ' ' A' ' 2' ' ' CYS . 32.0 p -90.12 126.5 35.81 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.359 -0.838 . . . . 0.0 110.246 -179.947 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . 0.44 ' O ' ' SG ' ' A' ' 7' ' ' CYS . 0.1 OUTLIER -88.11 146.01 25.65 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.242 -0.911 . . . . 0.0 110.161 -179.982 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 2.4 p30 -69.07 -41.52 77.44 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.279 -0.888 . . . . 0.0 110.369 -179.988 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.81 -33.8 66.44 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.079 -1.013 . . . . 0.0 110.184 179.978 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 14.7 t0 -78.54 -11.03 59.94 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.259 -0.901 . . . . 0.0 109.743 179.894 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.44 ' SG ' ' O ' ' A' ' 3' ' ' ASN . 19.3 m -93.5 -42.34 9.29 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.347 -0.846 . . . . 0.0 109.606 179.418 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 6.7 p -67.21 -37.52 83.77 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.346 -0.846 . . . . 0.0 109.912 179.669 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . 0.463 ' O ' ' HB2' ' A' ' 13' ' ' MET . 18.5 mt -66.38 -25.71 66.91 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.296 -0.877 . . . . 0.0 110.235 179.854 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -75.27 -47.01 29.99 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.296 -0.878 . . . . 0.0 110.392 -179.775 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.468 ' O ' ' HB2' ' A' ' 16' ' ' TYR . 30.7 m -67.06 -44.22 80.7 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.286 -0.884 . . . . 0.0 110.472 -179.668 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 31.8 mt -63.36 -38.61 82.61 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.654 0 O-C-N 121.188 -0.945 . . . . 0.0 110.457 -179.721 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' MET . . . . . 0.463 ' HB2' ' O ' ' A' ' 9' ' ' LEU . 1.9 tpp -65.31 -46.64 79.55 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.223 -0.923 . . . . 0.0 110.246 179.956 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 6.4 mtpt -63.01 -31.43 72.56 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.209 -0.932 . . . . 0.0 110.328 -179.889 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 139.67 -7.48 3.03 Favored Glycine 0 N--CA 1.49 2.254 0 N-CA-C 109.804 -1.318 . . . . 0.0 109.804 179.963 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' TYR . . . . . 0.468 ' HB2' ' O ' ' A' ' 11' ' ' CYS . 99.1 m-85 -76.73 -171.42 1.89 Allowed 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.209 -1.171 . . . . 0.0 110.092 179.999 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . 0.455 ' HB3' ' CD2' ' A' ' 18' ' ' PHE . 0.1 OUTLIER -118.24 -42.56 2.78 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.082 -1.012 . . . . 0.0 110.521 -179.749 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . 0.455 ' CD2' ' HB3' ' A' ' 17' ' ' ASN . 2.9 p90 -159.81 158.53 31.23 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.091 -1.006 . . . . 0.0 110.549 -179.885 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . 0.458 ' HA3' ' O ' ' A' ' 27' ' ' GLN . . . -144.47 -148.66 4.9 Favored Glycine 0 N--CA 1.491 2.339 0 N-CA-C 109.42 -1.472 . . . . 0.0 109.42 179.948 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.448 ' O ' ' HA ' ' A' ' 26' ' ' CYS . 0.3 OUTLIER -176.12 168.93 2.87 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.231 -1.158 . . . . 0.0 110.253 179.97 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . 0.45 ' HA ' ' SG ' ' A' ' 26' ' ' CYS . 1.2 m -87.62 142.19 28.04 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.351 -0.843 . . . . 0.0 110.166 -179.92 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 22.1 t -131.98 76.57 0.48 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.7 0 O-C-N 121.35 -0.843 . . . . 0.0 110.145 179.897 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 2.3 mtm-85 60.26 77.22 0.33 Allowed 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.335 -0.853 . . . . 0.0 110.243 179.98 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 62.8 11.81 38.62 Favored Glycine 0 N--CA 1.49 2.278 0 N-CA-C 109.578 -1.409 . . . . 0.0 109.578 179.979 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -130.33 176.34 8.21 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.221 -1.164 . . . . 0.0 109.926 179.877 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . 0.45 ' SG ' ' HA ' ' A' ' 21' ' ' CYS . 0.5 OUTLIER -154.08 132.26 11.84 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.172 -0.955 . . . . 0.0 110.204 -179.972 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.458 ' O ' ' HA3' ' A' ' 19' ' ' GLY . 2.5 mm100 -120.13 174.81 6.26 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.289 -0.882 . . . . 0.0 110.409 -179.885 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . 0.438 ' HB3' ' HB3' ' A' ' 11' ' ' CYS . 56.5 m -126.96 144.31 51.04 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.367 -0.833 . . . . 0.0 110.163 179.919 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 17.1 mmt180 -122.6 148.49 45.17 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.251 -0.905 . . . . 0.0 110.258 -179.925 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -98.09 178.58 5.05 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.323 -0.861 . . . . 0.0 110.222 179.996 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -115.63 -19.84 10.39 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.281 -0.887 . . . . 0.0 110.219 179.963 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 7.1 t -105.22 144.4 32.06 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.267 -0.896 . . . . 0.0 110.201 179.953 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.273 0 CA-C-O 117.925 -1.486 . . . . 0.0 109.535 179.967 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.563 0 CA-C-O 121.231 0.539 . . . . 0.0 110.209 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 17.9 p -86.08 153.75 21.88 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.273 -0.892 . . . . 0.0 110.254 -179.895 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 35.0 m120 -117.55 133.58 55.8 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.231 -0.918 . . . . 0.0 110.122 179.978 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . 0.459 ' N ' ' OD1' ' A' ' 4' ' ' ASP . 0.9 OUTLIER -61.85 -30.41 70.83 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.262 -0.899 . . . . 0.0 110.224 179.95 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.08 -29.55 64.23 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.255 -0.903 . . . . 0.0 110.089 179.904 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -79.47 -14.36 58.96 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.297 -0.877 . . . . 0.0 110.126 179.869 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -96.97 -25.15 15.49 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.291 -0.881 . . . . 0.0 109.888 179.863 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' SER . . . . . 0.459 ' OG ' ' O ' ' A' ' 4' ' ' ASP . 0.1 OUTLIER -82.82 -43.78 16.26 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.339 -0.85 . . . . 0.0 110.083 179.846 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -62.37 -49.61 74.86 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.267 -0.896 . . . . 0.0 110.087 179.818 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -62.47 -27.08 68.88 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.26 -0.9 . . . . 0.0 109.638 179.681 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.54 ' O ' ' N ' ' A' ' 16' ' ' TYR . 0.1 OUTLIER -66.77 -46.12 76.34 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.395 -0.816 . . . . 0.0 109.641 179.428 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 89.4 mt -75.49 -33.34 27.02 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.502 0 O-C-N 121.339 -0.85 . . . . 0.0 110.2 179.971 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 1.7 ttt -69.0 -52.92 23.78 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.121 -0.987 . . . . 0.0 110.226 -179.989 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 4.1 mttt -60.8 -30.51 70.11 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.321 -0.862 . . . . 0.0 110.344 -179.977 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 122.68 14.55 4.26 Favored Glycine 0 N--CA 1.491 2.365 0 N-CA-C 109.756 -1.337 . . . . 0.0 109.756 179.944 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' TYR . . . . . 0.54 ' N ' ' O ' ' A' ' 11' ' ' CYS . 48.2 m-85 -92.53 -179.98 5.34 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.246 -1.15 . . . . 0.0 110.08 179.879 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . 0.513 ' CB ' HG21 ' A' ' 31' ' ' THR . 6.7 m120 -101.56 -52.1 3.3 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.094 -1.004 . . . . 0.0 110.486 -179.792 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . 0.517 ' CE2' ' HB2' ' A' ' 29' ' ' ARG . 33.2 p90 -146.91 163.19 36.92 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.103 -0.998 . . . . 0.0 110.567 -179.872 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -138.38 -170.45 11.86 Favored Glycine 0 N--CA 1.491 2.316 0 N-CA-C 109.375 -1.49 . . . . 0.0 109.375 179.944 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -170.52 164.61 8.49 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.216 -1.167 . . . . 0.0 110.2 179.916 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . 0.462 ' HA ' ' O ' ' A' ' 25' ' ' SER . 0.8 OUTLIER -90.99 137.72 32.15 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.219 -0.926 . . . . 0.0 110.113 179.943 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.52 ' HB ' ' CB ' ' A' ' 25' ' ' SER . 57.3 t -110.07 76.26 0.42 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.641 0 O-C-N 121.234 -0.916 . . . . 0.0 110.173 -179.98 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 13.6 mtm180 54.37 54.16 9.82 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.229 -0.92 . . . . 0.0 110.208 179.894 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 93.9 15.41 49.09 Favored Glycine 0 N--CA 1.49 2.3 0 N-CA-C 109.753 -1.339 . . . . 0.0 109.753 179.957 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' SER . . . . . 0.52 ' CB ' ' HB ' ' A' ' 22' ' ' VAL . 0.5 OUTLIER -127.36 -176.15 3.65 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.226 -1.161 . . . . 0.0 110.213 -179.946 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 8.1 t -143.56 114.17 7.57 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.207 -0.933 . . . . 0.0 110.175 -179.988 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 21.4 mm100 -117.45 157.6 25.94 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.269 -0.894 . . . . 0.0 110.132 179.961 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -124.32 133.23 53.52 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.325 -0.86 . . . . 0.0 110.084 -179.982 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . 0.517 ' HB2' ' CE2' ' A' ' 18' ' ' PHE . 3.4 mtm180 -123.37 163.6 20.48 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.162 -0.961 . . . . 0.0 110.383 -179.941 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.47 ' HA ' ' HB2' ' A' ' 17' ' ' ASN . 0.0 OUTLIER -115.34 -178.49 3.39 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.327 -0.858 . . . . 0.0 110.118 179.955 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' THR . . . . . 0.513 HG21 ' CB ' ' A' ' 17' ' ' ASN . 43.4 p -115.72 132.85 56.51 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.227 -0.921 . . . . 0.0 110.224 -179.872 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' SER . . . . . 0.404 ' OG ' ' N ' ' A' ' 33' ' ' GLY . 1.4 t -133.66 -84.25 0.45 Allowed 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.216 -0.927 . . . . 0.0 110.189 179.891 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . 0.404 ' N ' ' OG ' ' A' ' 32' ' ' SER . . . . . . . . 0 N--CA 1.491 2.311 0 CA-C-O 118.0 -1.445 . . . . 0.0 109.589 179.967 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.647 0 CA-C-O 121.199 0.524 . . . . 0.0 110.185 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . 0.443 ' O ' ' CB ' ' A' ' 3' ' ' ASN . 18.3 p -79.65 1.91 24.52 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.252 -0.905 . . . . 0.0 110.244 179.976 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . 0.455 ' O ' ' CB ' ' A' ' 7' ' ' CYS . 17.3 t-20 64.9 93.42 0.06 Allowed 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.24 -0.913 . . . . 0.0 110.158 -179.801 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 93.0 m-20 -57.35 -35.78 70.37 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.26 -0.9 . . . . 0.0 110.359 -179.908 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . 0.455 ' O ' ' HB2' ' A' ' 9' ' ' LEU . 1.3 ttm-85 -62.6 -57.26 11.72 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.081 -1.012 . . . . 0.0 110.161 -179.935 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -79.89 6.63 10.63 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.279 -0.888 . . . . 0.0 110.211 179.916 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.455 ' CB ' ' O ' ' A' ' 3' ' ' ASN . 39.5 t -107.22 -34.0 7.25 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.268 -0.895 . . . . 0.0 110.232 -179.946 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' SER . . . . . 0.465 ' O ' HG13 ' A' ' 12' ' ' ILE . 19.4 m -93.96 -42.2 9.18 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.293 -0.879 . . . . 0.0 110.434 -179.777 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . 0.455 ' HB2' ' O ' ' A' ' 5' ' ' ARG . 0.2 OUTLIER -53.32 -49.24 67.48 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.187 -0.946 . . . . 0.0 110.362 -179.71 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -62.87 -46.73 86.49 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.152 -0.967 . . . . 0.0 110.158 179.914 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -66.64 -38.96 87.96 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.197 -0.939 . . . . 0.0 110.179 -179.885 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . 0.465 HG13 ' O ' ' A' ' 8' ' ' SER . 14.2 mt -64.65 -33.58 64.13 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.611 0 O-C-N 121.232 -0.918 . . . . 0.0 110.149 179.907 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 7.3 ttm -73.85 -30.17 62.52 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.265 -0.897 . . . . 0.0 110.098 179.906 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 3.9 mtpp -59.64 -30.44 68.72 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.298 -0.876 . . . . 0.0 110.307 -179.978 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 138.98 -6.32 3.13 Favored Glycine 0 N--CA 1.49 2.298 0 N-CA-C 109.829 -1.308 . . . . 0.0 109.829 179.978 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 94.9 m-85 -77.15 177.37 7.89 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.174 -1.192 . . . . 0.0 110.202 179.988 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . 0.467 ' HB3' ' CD2' ' A' ' 18' ' ' PHE . 34.2 t-20 -102.81 -59.52 1.69 Allowed 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.207 -0.933 . . . . 0.0 110.367 179.994 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . 0.507 ' CE1' ' CB ' ' A' ' 29' ' ' ARG . 17.1 p90 -140.82 161.81 36.93 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.232 -0.918 . . . . 0.0 110.309 179.974 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . 0.452 ' HA2' ' HA ' ' A' ' 28' ' ' CYS . . . -148.04 -160.6 9.06 Favored Glycine 0 N--CA 1.49 2.285 0 N-CA-C 109.5 -1.44 . . . . 0.0 109.5 -179.927 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -177.63 170.64 1.98 Allowed 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.226 -1.161 . . . . 0.0 110.178 179.935 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . 0.45 ' O ' HG21 ' A' ' 22' ' ' VAL . 4.0 t -93.49 155.11 17.52 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.284 -0.885 . . . . 0.0 110.217 -179.936 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.45 HG21 ' O ' ' A' ' 21' ' ' CYS . 98.0 t -149.79 94.49 0.18 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.64 0 O-C-N 121.29 -0.881 . . . . 0.0 110.115 179.933 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER 50.62 65.79 1.35 Allowed 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.26 -0.9 . . . . 0.0 110.239 179.999 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 61.33 37.71 94.51 Favored Glycine 0 N--CA 1.491 2.32 0 N-CA-C 109.603 -1.399 . . . . 0.0 109.603 179.986 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' SER . . . . . 0.422 ' HB3' ' HB ' ' A' ' 22' ' ' VAL . 2.4 t -134.94 170.8 15.33 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.322 -1.104 . . . . 0.0 110.189 179.97 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 1.3 m -134.61 102.57 5.34 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.282 -0.886 . . . . 0.0 110.07 179.888 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 10.4 mm100 -105.24 164.82 11.55 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.399 -0.813 . . . . 0.0 110.318 -179.718 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . 0.452 ' HA ' ' HA2' ' A' ' 19' ' ' GLY . 59.4 m -145.79 158.03 43.88 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.301 -0.875 . . . . 0.0 110.294 -179.88 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . 0.507 ' CB ' ' CE1' ' A' ' 18' ' ' PHE . 0.0 OUTLIER -138.37 149.13 45.26 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.306 -0.871 . . . . 0.0 110.159 179.927 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -109.21 -149.33 0.44 Allowed 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.315 -0.865 . . . . 0.0 110.266 179.977 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 18.1 p -108.15 -174.22 2.47 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.296 -0.877 . . . . 0.0 110.232 -179.967 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 18.9 p -121.19 57.9 0.99 Allowed 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.227 -0.921 . . . . 0.0 110.174 -179.982 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.177 0 CA-C-O 117.99 -1.45 . . . . 0.0 109.594 179.966 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.607 0 CA-C-O 121.18 0.514 . . . . 0.0 110.267 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . 0.449 ' O ' ' O ' ' A' ' 3' ' ' ASN . 19.4 p -80.9 -29.06 35.66 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.431 -0.793 . . . . 0.0 110.2 179.971 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . 0.449 ' O ' ' O ' ' A' ' 2' ' ' CYS . 2.1 t-20 59.92 124.02 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.256 -0.903 . . . . 0.0 110.208 -179.99 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . 0.45 ' OD1' ' HB2' ' A' ' 21' ' ' CYS . 0.3 OUTLIER -66.26 -28.63 68.86 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.276 -0.89 . . . . 0.0 110.239 -179.914 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 62.1 ttt180 -68.16 -44.96 74.83 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.26 -0.9 . . . . 0.0 110.149 -179.903 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 74.6 m-20 -79.4 -17.16 54.94 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.223 -0.923 . . . . 0.0 110.079 179.974 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.415 ' SG ' ' O ' ' A' ' 20' ' ' LYS . 14.7 t -82.73 -33.31 27.56 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.376 -0.827 . . . . 0.0 110.083 179.846 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' SER . . . . . 0.454 ' HA ' ' HA3' ' A' ' 19' ' ' GLY . 34.8 p -80.94 -50.11 10.14 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.359 -0.838 . . . . 0.0 110.286 -179.909 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -56.01 -22.53 27.59 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.165 -0.96 . . . . 0.0 110.064 179.928 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -73.96 -47.02 40.39 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.309 -0.87 . . . . 0.0 110.125 179.934 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.462 ' O ' ' HB2' ' A' ' 16' ' ' TYR . 21.0 m -67.22 -44.73 78.8 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.184 -0.948 . . . . 0.0 109.989 179.918 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . 0.446 HD11 ' O ' ' A' ' 8' ' ' SER . 2.5 mt -63.74 -30.48 50.03 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.601 0 O-C-N 121.239 -0.913 . . . . 0.0 110.069 179.844 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -74.98 -28.25 60.48 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.223 -0.923 . . . . 0.0 110.126 179.82 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 3.2 mtpp -82.73 -18.07 42.09 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.327 -0.858 . . . . 0.0 110.339 179.973 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 117.65 8.87 10.6 Favored Glycine 0 N--CA 1.491 2.362 0 N-CA-C 109.635 -1.386 . . . . 0.0 109.635 179.836 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' TYR . . . . . 0.462 ' HB2' ' O ' ' A' ' 11' ' ' CYS . 40.4 m-85 -83.77 -172.5 4.19 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.18 -1.188 . . . . 0.0 110.139 179.965 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . 0.56 ' HB3' ' CE1' ' A' ' 18' ' ' PHE . 0.4 OUTLIER -133.05 0.49 3.45 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.219 -0.925 . . . . 0.0 110.475 -179.819 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . 0.56 ' CE1' ' HB3' ' A' ' 17' ' ' ASN . 5.9 m-85 -141.37 162.49 35.36 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.137 -0.977 . . . . 0.0 110.414 -179.948 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . 0.454 ' HA3' ' HA ' ' A' ' 8' ' ' SER . . . -156.85 121.4 1.07 Allowed Glycine 0 N--CA 1.49 2.239 0 N-CA-C 109.355 -1.498 . . . . 0.0 109.355 179.904 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.415 ' O ' ' SG ' ' A' ' 7' ' ' CYS . 23.1 ttpt -134.64 149.74 50.59 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.155 -1.203 . . . . 0.0 110.424 -179.787 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . 0.45 ' HB2' ' OD1' ' A' ' 4' ' ' ASP . 0.1 OUTLIER -105.57 126.54 52.25 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.357 -0.84 . . . . 0.0 110.042 179.829 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 59.0 t -145.59 139.14 21.48 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.637 0 O-C-N 121.291 -0.881 . . . . 0.0 110.26 -179.897 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 42.2 mtm180 47.67 53.73 10.83 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.27 -0.893 . . . . 0.0 110.261 179.87 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 51.7 29.49 25.71 Favored Glycine 0 N--CA 1.49 2.259 0 N-CA-C 109.652 -1.379 . . . . 0.0 109.652 179.912 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 8.4 t -131.09 -170.61 2.4 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.227 -1.161 . . . . 0.0 110.235 -179.952 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 53.3 t -143.31 140.73 30.72 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.292 -0.88 . . . . 0.0 110.096 -179.976 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 30.3 mt-30 -120.28 141.78 49.68 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.127 -0.983 . . . . 0.0 110.619 -179.813 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 43.4 m -124.22 150.57 45.11 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.355 -0.841 . . . . 0.0 109.886 179.602 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . 0.453 ' HB3' ' CD1' ' A' ' 18' ' ' PHE . 0.0 OUTLIER -136.38 161.12 36.68 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.131 -0.981 . . . . 0.0 110.227 -179.91 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.406 ' HG2' ' HA ' ' A' ' 16' ' ' TYR . 0.2 OUTLIER -119.49 173.08 7.2 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.187 -0.945 . . . . 0.0 110.002 179.927 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 2.1 p -78.46 140.82 38.6 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.207 -0.933 . . . . 0.0 110.22 179.929 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 12.0 m -154.71 -38.83 0.09 Allowed 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.323 -0.861 . . . . 0.0 110.169 -179.96 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.341 0 CA-C-O 118.015 -1.436 . . . . 0.0 109.563 -179.991 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.581 0 CA-C-O 121.283 0.564 . . . . 0.0 110.208 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . 0.453 ' O ' ' SG ' ' A' ' 2' ' ' CYS . 10.6 t -99.95 73.66 1.76 Allowed 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.22 -0.925 . . . . 0.0 110.088 179.973 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -79.11 134.08 36.74 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.235 -0.916 . . . . 0.0 110.228 179.988 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . 0.508 ' N ' ' OD1' ' A' ' 4' ' ' ASP . 8.6 p-10 -57.01 -41.3 78.24 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.235 -0.916 . . . . 0.0 110.208 179.9 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 7.0 tpt180 -62.25 -42.46 99.35 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.24 -0.912 . . . . 0.0 109.925 179.942 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -79.34 -17.04 55.34 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.365 -0.834 . . . . 0.0 109.741 179.608 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.454 ' O ' ' SG ' ' A' ' 11' ' ' CYS . 0.9 OUTLIER -78.0 -33.02 51.48 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.43 -0.794 . . . . 0.0 109.874 179.618 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' SER . . . . . 0.459 ' O ' HG13 ' A' ' 12' ' ' ILE . 0.3 OUTLIER -82.04 -43.99 17.21 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.393 -0.817 . . . . 0.0 110.152 179.734 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.4 mt -55.32 -46.94 76.31 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.262 -0.899 . . . . 0.0 110.193 179.943 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 19.9 t0 -63.77 -37.37 87.1 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.274 -0.891 . . . . 0.0 110.168 179.977 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.454 ' SG ' ' O ' ' A' ' 7' ' ' CYS . 82.4 m -66.32 -41.07 90.19 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.26 -0.9 . . . . 0.0 109.849 179.86 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . 0.459 HG13 ' O ' ' A' ' 8' ' ' SER . 81.4 mt -63.83 -35.65 73.92 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.587 0 O-C-N 121.322 -0.861 . . . . 0.0 109.901 179.822 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -70.72 -28.66 64.89 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.275 -0.891 . . . . 0.0 109.83 179.769 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.29 -23.93 46.94 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.313 -0.867 . . . . 0.0 110.132 179.889 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 124.52 -3.15 8.8 Favored Glycine 0 N--CA 1.491 2.348 0 N-CA-C 109.592 -1.403 . . . . 0.0 109.592 179.957 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' TYR . . . . . 0.417 ' CD2' ' CB ' ' A' ' 28' ' ' CYS . 48.1 m-85 -86.96 -175.71 5.46 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.126 -1.22 . . . . 0.0 110.334 -179.955 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 28.1 m-80 -109.18 -55.01 2.47 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.265 -0.897 . . . . 0.0 110.223 -179.979 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . 0.578 ' CE2' ' HB2' ' A' ' 29' ' ' ARG . 8.2 p90 -129.62 170.15 14.14 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.154 -0.967 . . . . 0.0 110.408 179.958 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -140.15 -178.38 16.86 Favored Glycine 0 N--CA 1.49 2.297 0 N-CA-C 109.405 -1.478 . . . . 0.0 109.405 179.952 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -164.62 160.9 20.58 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.227 -1.161 . . . . 0.0 110.323 179.96 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . 0.435 ' HA ' ' O ' ' A' ' 25' ' ' SER . 1.8 t -92.94 141.14 28.74 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.235 -0.916 . . . . 0.0 110.351 -179.851 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.452 ' O ' ' HB2' ' A' ' 25' ' ' SER . 72.8 t -147.42 123.85 2.91 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.614 0 O-C-N 121.301 -0.874 . . . . 0.0 110.058 179.894 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . 0.444 ' HB2' ' O ' ' A' ' 22' ' ' VAL . 3.7 mmm-85 55.43 35.79 25.77 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.275 -0.89 . . . . 0.0 110.13 -179.904 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 73.17 29.19 64.88 Favored Glycine 0 N--CA 1.489 2.218 0 N-CA-C 109.5 -1.44 . . . . 0.0 109.5 -179.925 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' SER . . . . . 0.452 ' HB2' ' O ' ' A' ' 22' ' ' VAL . 69.7 m -129.3 -171.59 2.53 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.283 -1.128 . . . . 0.0 110.307 179.999 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 47.3 t -141.53 121.41 13.59 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.346 -0.846 . . . . 0.0 110.181 179.956 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 4.8 mm-40 -120.21 174.74 6.31 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.171 -0.956 . . . . 0.0 110.458 -179.915 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . 0.417 ' CB ' ' CD2' ' A' ' 16' ' ' TYR . 73.1 m -125.05 149.58 47.65 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.323 -0.861 . . . . 0.0 110.085 179.886 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . 0.578 ' HB2' ' CE2' ' A' ' 18' ' ' PHE . 0.7 OUTLIER -136.42 146.03 45.94 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.216 -0.928 . . . . 0.0 110.258 -179.916 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -96.29 166.6 11.65 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.259 -0.901 . . . . 0.0 110.241 -179.98 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 36.7 p -80.13 168.99 18.44 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.206 -0.934 . . . . 0.0 110.218 179.978 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 75.6 p -132.54 132.54 42.71 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.271 -0.893 . . . . 0.0 110.288 179.962 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.358 0 CA-C-O 117.939 -1.479 . . . . 0.0 109.613 -179.95 . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.593 0 CA-C-O 121.272 0.558 . . . . 0.0 110.199 . . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . 0.434 ' O ' ' SG ' ' A' ' 2' ' ' CYS . 15.8 p -93.52 133.41 36.86 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.263 -0.898 . . . . 0.0 110.236 -179.984 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . 0.443 ' O ' ' HB2' ' A' ' 7' ' ' CYS . 20.4 t-20 -100.54 125.14 46.86 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.3 -0.875 . . . . 0.0 110.253 -179.945 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -66.58 -34.37 77.74 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.197 -0.939 . . . . 0.0 110.38 179.976 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . 0.453 ' O ' ' HB2' ' A' ' 9' ' ' LEU . 1.8 mmm-85 -62.15 -54.47 40.69 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.159 -0.963 . . . . 0.0 110.125 179.951 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -79.5 2.22 22.85 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.239 -0.913 . . . . 0.0 110.045 179.758 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.443 ' HB2' ' O ' ' A' ' 3' ' ' ASN . 14.8 t -95.3 -40.44 9.54 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.254 -0.904 . . . . 0.0 109.997 179.97 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 26.8 t -86.42 -35.39 19.75 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.376 -0.828 . . . . 0.0 110.045 179.875 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . 0.453 ' HB2' ' O ' ' A' ' 5' ' ' ARG . 0.6 OUTLIER -55.22 -47.53 75.18 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.208 -0.932 . . . . 0.0 110.008 179.944 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -65.13 -35.02 79.79 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.321 -0.862 . . . . 0.0 110.122 179.912 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 1.5 t -70.45 -39.37 74.36 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.214 -0.929 . . . . 0.0 110.131 179.968 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 39.8 mt -63.55 -35.44 72.64 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.579 0 O-C-N 121.2 -0.938 . . . . 0.0 109.809 179.703 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -77.77 -27.57 50.31 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.382 -0.824 . . . . 0.0 109.754 179.39 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.51 -27.82 65.51 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.354 -0.841 . . . . 0.0 109.958 179.743 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 121.89 10.82 6.15 Favored Glycine 0 N--CA 1.489 2.192 0 N-CA-C 109.669 -1.373 . . . . 0.0 109.669 179.983 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 60.6 m-85 -93.44 -161.73 0.87 Allowed 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.301 -1.117 . . . . 0.0 110.327 -179.958 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . 0.487 ' HB3' ' CD2' ' A' ' 18' ' ' PHE . 1.8 t-20 -119.76 -51.44 2.26 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.264 -0.898 . . . . 0.0 110.36 -179.882 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . 0.565 ' CE1' ' HB2' ' A' ' 29' ' ' ARG . 6.5 p90 -161.84 156.66 22.93 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.277 -0.889 . . . . 0.0 110.154 -179.817 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . 0.448 ' HA2' ' HA ' ' A' ' 28' ' ' CYS . . . -127.88 -149.69 7.15 Favored Glycine 0 N--CA 1.491 2.363 0 N-CA-C 109.684 -1.366 . . . . 0.0 109.684 179.946 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.469 ' O ' ' HA ' ' A' ' 26' ' ' CYS . 9.7 tttp -175.26 152.98 1.48 Allowed 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.233 -1.157 . . . . 0.0 110.177 179.962 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 0.3 OUTLIER -90.84 129.58 36.88 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.274 -0.891 . . . . 0.0 110.312 179.957 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.446 ' O ' ' N ' ' A' ' 24' ' ' GLY . 84.5 t -109.72 98.35 6.92 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.613 0 O-C-N 121.242 -0.911 . . . . 0.0 110.07 -179.974 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 59.37 -84.81 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.174 -0.954 . . . . 0.0 110.13 -179.844 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . 0.446 ' N ' ' O ' ' A' ' 22' ' ' VAL . . . -126.05 15.71 6.9 Favored Glycine 0 N--CA 1.49 2.297 0 N-CA-C 109.527 -1.429 . . . . 0.0 109.527 179.887 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -130.87 -163.71 1.35 Allowed 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.264 -1.139 . . . . 0.0 110.076 179.88 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . 0.469 ' HA ' ' O ' ' A' ' 20' ' ' LYS . 0.5 OUTLIER -158.24 132.97 8.33 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.167 -0.958 . . . . 0.0 110.33 179.83 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 10.0 mm100 -108.89 -174.14 2.44 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.353 -0.842 . . . . 0.0 110.301 -179.935 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . 0.448 ' HA ' ' HA2' ' A' ' 19' ' ' GLY . 1.1 m -140.46 153.21 46.18 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.327 -0.858 . . . . 0.0 110.207 -179.994 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . 0.565 ' HB2' ' CE1' ' A' ' 18' ' ' PHE . 4.5 mmt180 -144.04 137.95 28.0 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.309 -0.869 . . . . 0.0 110.286 -179.957 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -96.3 -156.68 0.54 Allowed 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.23 -0.919 . . . . 0.0 110.147 179.913 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 31' ' ' THR . . . . . 0.439 HG22 ' OD1' ' A' ' 17' ' ' ASN . 0.1 OUTLIER -113.61 156.84 22.95 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.257 -0.902 . . . . 0.0 110.113 179.914 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 46.9 t -85.83 77.19 9.79 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.248 -0.907 . . . . 0.0 110.225 -179.962 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.317 0 N-CA-C 109.557 -1.417 . . . . 0.0 109.557 179.954 . . . . . . . . 0 0 . 1 . 022 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.651 0 CA-C-O 121.113 0.483 . . . . 0.0 110.088 . . . . . . . . . 0 0 . 1 . 022 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . 0.447 ' SG ' ' O ' ' A' ' 25' ' ' SER . 12.0 p -99.02 137.72 37.14 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.225 -0.922 . . . . 0.0 110.174 -179.943 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 2.8 m-20 -111.9 133.53 54.04 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.279 -0.888 . . . . 0.0 110.143 -179.937 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -50.75 -34.57 27.72 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.211 -0.931 . . . . 0.0 110.101 179.961 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -65.76 -49.89 66.73 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.254 -0.904 . . . . 0.0 110.084 179.812 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -79.68 0.86 28.62 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.243 -0.911 . . . . 0.0 110.098 179.846 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 11.6 t -100.23 -36.75 9.18 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.184 -0.947 . . . . 0.0 110.169 179.908 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 8' ' ' SER . . . . . 0.459 ' O ' HG13 ' A' ' 12' ' ' ILE . 0.1 OUTLIER -86.57 -35.26 19.58 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.296 -0.878 . . . . 0.0 110.091 179.909 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 2.2 mt -55.52 -55.36 32.83 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.258 -0.901 . . . . 0.0 110.136 179.924 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -62.78 -30.59 71.57 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.321 -0.862 . . . . 0.0 110.016 179.819 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 1.2 m -74.81 -39.48 61.66 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.316 -0.865 . . . . 0.0 110.098 179.856 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . 0.459 HG13 ' O ' ' A' ' 8' ' ' SER . 36.0 mt -63.64 -32.02 55.24 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.581 0 O-C-N 121.337 -0.852 . . . . 0.0 110.006 179.881 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -86.76 -20.24 27.93 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.33 -0.856 . . . . 0.0 110.016 179.826 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.62 -22.08 51.33 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.394 -0.816 . . . . 0.0 110.155 179.928 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 126.04 5.42 6.25 Favored Glycine 0 N--CA 1.49 2.271 0 N-CA-C 109.642 -1.383 . . . . 0.0 109.642 -179.999 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 78.0 m-85 -94.41 -172.58 2.82 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.199 -1.177 . . . . 0.0 110.129 179.976 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . 0.467 ' HB3' ' CE2' ' A' ' 18' ' ' PHE . 44.1 t30 -139.08 7.05 2.42 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.135 -0.978 . . . . 0.0 110.2 179.907 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . 0.467 ' CE2' ' HB3' ' A' ' 17' ' ' ASN . 49.1 m-85 -143.62 168.97 18.62 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.252 -0.905 . . . . 0.0 110.155 179.946 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . 0.445 ' HA3' ' OG ' ' A' ' 8' ' ' SER . . . -155.73 100.17 0.19 Allowed Glycine 0 N--CA 1.49 2.283 0 N-CA-C 109.434 -1.466 . . . . 0.0 109.434 179.953 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -120.39 137.97 54.01 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.205 -1.174 . . . . 0.0 110.247 -179.806 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -87.32 153.35 21.54 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.214 -0.929 . . . . 0.0 110.191 -179.981 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.477 ' HB ' ' CB ' ' A' ' 25' ' ' SER . 35.8 t -126.57 61.44 0.29 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.56 0 O-C-N 121.247 -0.908 . . . . 0.0 110.167 179.893 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 3.3 mpp_? 60.26 63.86 1.33 Allowed 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.364 -0.835 . . . . 0.0 110.141 -179.808 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 92.15 13.09 58.02 Favored Glycine 0 N--CA 1.49 2.29 0 N-CA-C 109.493 -1.443 . . . . 0.0 109.493 -179.885 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 25' ' ' SER . . . . . 0.477 ' CB ' ' HB ' ' A' ' 22' ' ' VAL . 0.6 OUTLIER -133.28 -175.93 3.97 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.257 -1.143 . . . . 0.0 110.164 179.971 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 12.2 t -150.26 114.87 5.24 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.237 -0.914 . . . . 0.0 110.386 -179.977 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.451 ' O ' ' SG ' ' A' ' 28' ' ' CYS . 2.7 mm100 -114.79 161.5 18.1 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.188 -0.945 . . . . 0.0 110.123 179.844 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . 0.451 ' SG ' ' O ' ' A' ' 27' ' ' GLN . 86.4 m -150.0 -178.45 6.49 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.223 -0.923 . . . . 0.0 110.333 -179.952 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -146.98 163.1 37.3 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.272 -0.892 . . . . 0.0 110.195 -179.986 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -119.95 148.38 43.6 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.235 -0.915 . . . . 0.0 110.183 179.927 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 77.7 p -93.07 151.31 19.95 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.305 -0.872 . . . . 0.0 110.164 -179.984 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 6.2 m -112.78 -28.1 7.89 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.216 -0.927 . . . . 0.0 110.259 -179.974 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.31 0 CA-C-O 118.035 -1.425 . . . . 0.0 109.542 -179.996 . . . . . . . . 0 0 . 1 . 023 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.638 0 CA-C-O 121.246 0.546 . . . . 0.0 110.189 . . . . . . . . . 0 0 . 1 . 023 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . 0.465 ' O ' ' HB3' ' A' ' 3' ' ' ASN . 26.6 p -106.14 -25.66 11.92 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.365 -0.834 . . . . 0.0 110.253 -179.911 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . 0.465 ' HB3' ' O ' ' A' ' 2' ' ' CYS . 8.9 t-20 62.71 126.24 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.228 -0.92 . . . . 0.0 110.104 -179.743 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -76.11 -18.78 59.02 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.237 -0.914 . . . . 0.0 110.412 -179.776 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -67.85 -55.78 11.64 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.256 -0.903 . . . . 0.0 110.288 -179.814 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 42.9 m-20 -79.33 -6.64 57.19 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.244 -0.91 . . . . 0.0 110.314 -179.799 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 53.1 t -90.28 -42.32 11.05 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.225 -0.922 . . . . 0.0 110.082 179.854 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 3.1 m -78.2 -43.18 29.2 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.266 -0.896 . . . . 0.0 110.174 -179.996 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 40.2 mt -54.61 -47.95 72.79 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.307 -0.871 . . . . 0.0 110.215 -179.893 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . 0.466 ' O ' ' HG3' ' A' ' 14' ' ' LYS . 0.2 OUTLIER -66.6 -33.35 75.46 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.276 -0.89 . . . . 0.0 110.361 179.978 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 7.4 m -68.26 -45.73 72.36 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.24 -0.913 . . . . 0.0 110.369 179.998 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 68.2 mt -68.13 -33.19 59.5 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.645 0 O-C-N 121.228 -0.92 . . . . 0.0 110.351 -179.866 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -67.04 -37.65 84.45 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.193 -0.942 . . . . 0.0 110.427 -179.878 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . 0.466 ' HG3' ' O ' ' A' ' 10' ' ' ASP . 8.3 mttm -63.02 -27.49 69.45 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.243 -0.91 . . . . 0.0 110.325 -179.834 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 133.23 -2.62 4.7 Favored Glycine 0 N--CA 1.491 2.31 0 N-CA-C 109.745 -1.342 . . . . 0.0 109.745 179.958 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 16' ' ' TYR . . . . . 0.4 ' HA ' ' HG2' ' A' ' 30' ' ' ARG . 96.8 m-85 -83.79 179.35 7.6 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.149 -1.207 . . . . 0.0 110.354 -179.859 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . 0.578 ' HB3' ' CD2' ' A' ' 18' ' ' PHE . 1.5 t-20 -103.46 -46.61 4.52 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.347 -0.846 . . . . 0.0 109.875 179.688 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . 0.578 ' CD2' ' HB3' ' A' ' 17' ' ' ASN . 32.6 p90 -154.18 140.09 18.21 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.34 -0.85 . . . . 0.0 110.013 179.643 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . 0.484 ' CA ' ' HA ' ' A' ' 28' ' ' CYS . . . -119.89 -152.03 8.92 Favored Glycine 0 N--CA 1.49 2.242 0 N-CA-C 109.575 -1.41 . . . . 0.0 109.575 -179.97 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -178.36 166.44 1.86 Allowed 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.27 -1.135 . . . . 0.0 110.184 -179.945 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . 0.432 ' HA ' ' O ' ' A' ' 25' ' ' SER . 12.3 t -84.98 142.76 29.39 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.228 -0.92 . . . . 0.0 110.297 -179.938 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.415 ' O ' ' HB2' ' A' ' 23' ' ' ARG . 19.3 t -130.15 88.05 1.07 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.499 0 O-C-N 121.218 -0.926 . . . . 0.0 110.011 179.838 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . 0.415 ' HB2' ' O ' ' A' ' 22' ' ' VAL . 42.5 mtt180 54.23 74.69 0.32 Allowed 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.327 -0.858 . . . . 0.0 110.114 -179.926 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 59.37 28.55 64.79 Favored Glycine 0 N--CA 1.49 2.292 0 N-CA-C 109.521 -1.432 . . . . 0.0 109.521 -179.967 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 25' ' ' SER . . . . . 0.432 ' O ' ' HA ' ' A' ' 21' ' ' CYS . 2.1 m -136.96 176.38 8.77 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.27 -1.135 . . . . 0.0 110.172 -179.979 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 45.9 t -137.23 121.78 18.43 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.222 -0.924 . . . . 0.0 110.312 179.946 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.419 ' O ' ' HA3' ' A' ' 19' ' ' GLY . 1.7 mm-40 -120.03 161.21 21.34 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.278 -0.889 . . . . 0.0 110.14 179.849 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . 0.484 ' HA ' ' CA ' ' A' ' 19' ' ' GLY . 17.9 m -119.79 139.39 52.39 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.341 -0.85 . . . . 0.0 110.03 179.905 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . 0.568 ' HB3' ' CE1' ' A' ' 18' ' ' PHE . 1.1 mtm180 -120.16 143.08 48.4 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.167 -0.958 . . . . 0.0 110.29 -179.989 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.4 ' HG2' ' HA ' ' A' ' 16' ' ' TYR . 0.0 OUTLIER -105.15 163.76 12.33 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.28 -0.888 . . . . 0.0 110.161 179.975 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -84.03 -163.32 0.76 Allowed 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.25 -0.907 . . . . 0.0 110.107 -179.917 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -98.75 82.97 2.88 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.273 -0.892 . . . . 0.0 110.248 179.976 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.343 0 CA-C-O 118.02 -1.433 . . . . 0.0 109.52 179.972 . . . . . . . . 0 0 . 1 . 024 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.613 0 CA-C-O 121.203 0.525 . . . . 0.0 110.112 . . . . . . . . . 0 0 . 1 . 024 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 13.2 p -83.48 145.18 29.08 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.157 -0.964 . . . . 0.0 110.161 -179.991 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -116.1 156.42 26.43 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.143 -0.973 . . . . 0.0 110.278 -179.884 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 33.1 m-20 -61.93 -34.64 76.46 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.225 -0.922 . . . . 0.0 109.933 179.732 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 38.2 ttt180 -79.46 -38.18 35.18 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.289 -0.882 . . . . 0.0 109.855 179.737 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 24.9 t0 -79.52 -12.44 59.86 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.346 -0.846 . . . . 0.0 110.088 179.852 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 28.4 t -96.18 -35.32 11.34 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.313 -0.867 . . . . 0.0 110.172 179.982 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 11.5 p -78.02 -36.02 49.12 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.288 -0.882 . . . . 0.0 110.252 -179.89 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 8.4 mt -53.49 -44.56 69.14 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.226 -0.921 . . . . 0.0 110.303 -179.999 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . 0.452 ' O ' ' HG3' ' A' ' 14' ' ' LYS . 19.8 t0 -72.24 -31.92 66.25 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.144 -0.972 . . . . 0.0 110.107 179.817 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.45 ' O ' ' HB2' ' A' ' 16' ' ' TYR . 55.7 m -66.76 -38.19 86.1 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.29 -0.881 . . . . 0.0 110.222 179.987 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 16.0 mt -71.54 -45.32 68.44 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.569 0 O-C-N 121.199 -0.938 . . . . 0.0 110.102 -179.99 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 1.4 ttt -63.79 -29.15 70.39 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.228 -0.92 . . . . 0.0 110.111 179.916 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . 0.452 ' HG3' ' O ' ' A' ' 10' ' ' ASP . 22.6 mttt -68.4 -20.25 64.66 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.359 -0.838 . . . . 0.0 110.153 179.842 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 119.82 -5.14 12.76 Favored Glycine 0 N--CA 1.491 2.323 0 N-CA-C 109.624 -1.39 . . . . 0.0 109.624 179.958 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 16' ' ' TYR . . . . . 0.45 ' HB2' ' O ' ' A' ' 11' ' ' CYS . 58.5 m-85 -86.73 -155.73 0.28 Allowed 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.238 -1.154 . . . . 0.0 110.083 179.96 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -129.2 -65.02 0.88 Allowed 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.117 -0.99 . . . . 0.0 110.259 -179.995 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . 0.531 ' CE1' ' HB3' ' A' ' 29' ' ' ARG . 39.7 p90 -129.11 139.83 51.81 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.272 -0.892 . . . . 0.0 110.301 -179.958 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . 0.462 ' HA3' ' O ' ' A' ' 27' ' ' GLN . . . -121.68 -162.88 11.77 Favored Glycine 0 N--CA 1.49 2.285 0 N-CA-C 109.571 -1.412 . . . . 0.0 109.571 179.997 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -162.31 151.76 15.84 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.35 -1.089 . . . . 0.0 110.198 -179.949 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . 0.429 ' HA ' ' O ' ' A' ' 25' ' ' SER . 0.8 OUTLIER -86.11 140.87 29.83 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.242 -0.911 . . . . 0.0 110.125 179.844 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.5 ' O ' ' CB ' ' A' ' 25' ' ' SER . 15.6 t -136.27 96.41 1.5 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.604 0 O-C-N 121.143 -0.973 . . . . 0.0 110.128 -179.998 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . 0.419 ' O ' ' C ' ' A' ' 24' ' ' GLY . 16.7 mtt180 52.16 85.43 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.192 -0.942 . . . . 0.0 110.144 -179.908 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . 0.419 ' C ' ' O ' ' A' ' 23' ' ' ARG . . . 44.88 33.34 3.51 Favored Glycine 0 N--CA 1.491 2.3 0 N-CA-C 109.362 -1.495 . . . . 0.0 109.362 -179.791 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 25' ' ' SER . . . . . 0.5 ' CB ' ' O ' ' A' ' 22' ' ' VAL . 0.8 OUTLIER -138.03 165.14 27.33 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.237 -1.155 . . . . 0.0 110.15 -179.913 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 24.6 t -134.84 127.62 31.13 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.185 -0.947 . . . . 0.0 110.312 -179.979 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.462 ' O ' ' HA3' ' A' ' 19' ' ' GLY . 27.5 mt-30 -118.85 159.6 23.46 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.339 -0.851 . . . . 0.0 109.978 179.82 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 61.9 m -120.67 136.0 54.96 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.196 -0.94 . . . . 0.0 110.26 -179.866 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . 0.531 ' HB3' ' CE1' ' A' ' 18' ' ' PHE . 5.8 mmt180 -124.3 136.46 54.14 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.312 -0.867 . . . . 0.0 110.285 -179.968 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -106.12 177.36 4.88 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.383 -0.823 . . . . 0.0 110.182 179.901 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -79.68 131.65 36.01 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.241 -0.912 . . . . 0.0 110.177 -179.906 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -122.36 -24.38 5.03 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.254 -0.904 . . . . 0.0 110.135 -179.965 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.329 0 CA-C-O 117.997 -1.446 . . . . 0.0 109.528 -179.909 . . . . . . . . 0 0 . 1 . 025 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.658 0 CA-C-O 121.205 0.526 . . . . 0.0 110.195 . . . . . . . . . 0 0 . 1 . 025 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . 0.446 ' O ' ' HB2' ' A' ' 3' ' ' ASN . 28.5 p -101.2 -8.66 22.0 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.29 -0.881 . . . . 0.0 110.307 -179.999 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 3' ' ' ASN . . . . . 0.446 ' HB2' ' O ' ' A' ' 2' ' ' CYS . 29.5 m-20 57.97 98.2 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.283 -0.885 . . . . 0.0 110.163 -179.919 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -69.47 -38.2 77.62 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.21 -0.931 . . . . 0.0 110.307 -179.928 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.85 -39.85 95.19 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.262 -0.899 . . . . 0.0 110.308 -179.98 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -79.68 -21.94 44.07 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.283 -0.886 . . . . 0.0 110.332 -179.9 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 8.6 t -78.41 -34.4 48.08 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.233 -0.917 . . . . 0.0 110.05 179.863 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 22.8 m -81.31 -34.72 31.71 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.241 -0.912 . . . . 0.0 110.118 179.909 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 8.6 mt -61.86 -51.95 66.1 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.217 -0.927 . . . . 0.0 110.205 179.855 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -62.64 -29.41 70.6 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.183 -0.948 . . . . 0.0 109.942 179.776 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 1.3 m -72.59 -47.86 44.53 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.289 -0.882 . . . . 0.0 110.143 179.816 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 12' ' ' ILE . . . . . 0.412 ' O ' HG23 ' A' ' 12' ' ' ILE . 40.9 mt -63.38 -22.45 30.84 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.599 0 O-C-N 121.306 -0.871 . . . . 0.0 109.88 179.828 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -77.86 -40.89 38.69 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.374 -0.829 . . . . 0.0 110.039 179.779 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -59.66 -48.35 82.02 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.277 -0.889 . . . . 0.0 110.089 179.936 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 144.65 36.71 0.07 OUTLIER Glycine 0 N--CA 1.492 2.388 0 N-CA-C 109.934 -1.266 . . . . 0.0 109.934 179.752 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 16' ' ' TYR . . . . . 0.522 ' CD1' ' HG3' ' A' ' 30' ' ' ARG . 64.8 m-85 -108.64 -164.38 0.95 Allowed 'General case' 0 N--CA 1.487 1.394 0 O-C-N 121.119 -1.224 . . . . 0.0 110.042 179.744 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . 0.565 ' HB3' ' CD1' ' A' ' 18' ' ' PHE . 51.9 t-20 -128.84 -54.41 1.22 Allowed 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.123 -0.985 . . . . 0.0 110.486 -179.941 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . 0.599 ' N ' ' CD1' ' A' ' 18' ' ' PHE . 5.8 p90 -131.73 150.4 52.16 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.129 -0.982 . . . . 0.0 110.177 179.95 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . 0.457 ' HA2' ' HA ' ' A' ' 28' ' ' CYS . . . -155.82 -176.64 28.2 Favored Glycine 0 N--CA 1.49 2.272 0 N-CA-C 109.812 -1.315 . . . . 0.0 109.812 -179.868 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -174.66 171.89 3.15 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.279 -1.13 . . . . 0.0 110.112 -179.974 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 21' ' ' CYS . . . . . 0.407 ' HA ' ' O ' ' A' ' 25' ' ' SER . 52.1 t -90.35 135.92 33.38 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.223 -0.923 . . . . 0.0 110.136 179.921 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.465 ' HB ' ' HB3' ' A' ' 25' ' ' SER . 5.2 t -113.98 85.45 0.82 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.625 0 O-C-N 121.146 -0.971 . . . . 0.0 110.196 -179.995 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 54.01 72.34 0.45 Allowed 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.264 -0.898 . . . . 0.0 110.223 179.917 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 65.0 34.76 90.74 Favored Glycine 0 N--CA 1.49 2.282 0 N-CA-C 109.624 -1.39 . . . . 0.0 109.624 179.853 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 25' ' ' SER . . . . . 0.465 ' HB3' ' HB ' ' A' ' 22' ' ' VAL . 8.7 t -140.26 175.59 9.47 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.237 -1.155 . . . . 0.0 110.263 -179.993 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 52.8 t -135.27 97.72 3.78 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.265 -0.897 . . . . 0.0 110.136 179.909 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.457 ' HB2' ' CG2' ' A' ' 22' ' ' VAL . 28.1 mt-30 -113.42 151.23 31.63 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.269 -0.894 . . . . 0.0 110.251 -179.877 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . 0.457 ' HA ' ' HA2' ' A' ' 19' ' ' GLY . 91.2 m -144.77 168.96 18.97 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.297 -0.877 . . . . 0.0 110.16 179.857 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . 0.564 ' HB2' ' CE2' ' A' ' 18' ' ' PHE . 1.8 mpt_? -136.21 167.63 20.92 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.308 -0.87 . . . . 0.0 110.283 -179.752 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 30' ' ' ARG . . . . . 0.522 ' HG3' ' CD1' ' A' ' 16' ' ' TYR . 0.0 OUTLIER -118.24 -155.87 0.62 Allowed 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.275 -0.89 . . . . 0.0 110.17 -179.987 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 69.7 p -113.01 127.78 56.32 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.277 -0.889 . . . . 0.0 110.207 179.96 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 3.6 t -93.91 133.03 37.76 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.175 -0.953 . . . . 0.0 110.236 179.931 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.376 0 N-CA-C 109.508 -1.437 . . . . 0.0 109.508 -179.9 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 2' ' ' CYS . . . . . 0.458 ' O ' ' SG ' ' A' ' 7' ' ' CYS . 11.4 t . . . . . 0 N--CA 1.49 1.546 0 CA-C-O 121.25 0.548 . . . . 0.0 110.206 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 3' ' ' ASN . . . . . 0.464 ' O ' ' HB2' ' A' ' 7' ' ' CYS . 15.7 m120 48.0 84.22 0.03 OUTLIER 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.211 -0.931 . . . . 0.0 110.107 -179.96 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -52.02 -25.77 9.24 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.296 -0.877 . . . . 0.0 110.688 -179.824 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 5' ' ' ARG . . . . . 0.466 ' O ' ' HB2' ' A' ' 9' ' ' LEU . 0.0 OUTLIER -79.39 -45.24 19.91 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.073 -1.017 . . . . 0.0 110.481 -179.694 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -79.6 -18.4 51.7 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.193 -0.942 . . . . 0.0 110.218 -179.887 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.468 ' O ' ' HB2' ' A' ' 11' ' ' CYS . 0.5 OUTLIER -83.53 -43.36 15.81 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.301 -0.874 . . . . 0.0 110.08 179.849 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 8' ' ' SER . . . . . 0.435 ' O ' HG13 ' A' ' 12' ' ' ILE . 86.0 p -72.17 -39.64 68.53 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.266 -0.896 . . . . 0.0 110.335 -179.92 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.466 ' HB2' ' O ' ' A' ' 5' ' ' ARG . 0.2 OUTLIER -63.14 -51.4 66.65 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.248 -0.907 . . . . 0.0 110.343 -179.84 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -62.85 -35.95 81.64 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.261 -0.899 . . . . 0.0 110.457 -179.793 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.468 ' HB2' ' O ' ' A' ' 7' ' ' CYS . 0.5 OUTLIER -73.39 -43.83 59.74 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.109 -0.995 . . . . 0.0 110.425 -179.942 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 12' ' ' ILE . . . . . 0.435 HG13 ' O ' ' A' ' 8' ' ' SER . 47.6 mt -63.42 -23.18 32.65 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.614 0 O-C-N 121.185 -0.947 . . . . 0.0 109.885 179.906 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 1.9 ttt -80.22 -39.52 28.92 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.318 -0.864 . . . . 0.0 109.859 179.62 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 40.4 mtmt -54.03 -29.61 44.4 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.251 -0.905 . . . . 0.0 110.076 179.752 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 128.44 5.82 4.93 Favored Glycine 0 N--CA 1.491 2.321 0 N-CA-C 109.839 -1.304 . . . . 0.0 109.839 179.852 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 25.7 m-85 -80.37 -177.97 6.42 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.149 -1.206 . . . . 0.0 110.143 -179.975 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' ASN . . . . . 0.468 ' HB3' ' CD2' ' A' ' 18' ' ' PHE . 32.2 t30 -108.31 -51.39 2.9 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.189 -0.945 . . . . 0.0 110.174 -179.915 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 18' ' ' PHE . . . . . 0.564 ' CE1' ' CB ' ' A' ' 29' ' ' ARG . 8.9 p90 -151.42 159.07 44.4 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.283 -0.886 . . . . 0.0 110.372 -179.917 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 19' ' ' GLY . . . . . 0.518 ' CA ' ' HA ' ' A' ' 28' ' ' CYS . . . -153.42 -162.05 10.77 Favored Glycine 0 N--CA 1.49 2.279 0 N-CA-C 109.372 -1.491 . . . . 0.0 109.372 179.938 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.439 ' HB3' ' O ' ' A' ' 19' ' ' GLY . 1.6 pttt 176.79 160.94 0.39 Allowed 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.288 -1.125 . . . . 0.0 110.275 179.891 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 74.1 m -82.92 137.81 34.08 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.153 -0.967 . . . . 0.0 110.086 179.899 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.489 ' O ' ' N ' ' A' ' 25' ' ' SER . 41.7 t -131.85 131.11 61.96 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.568 0 O-C-N 121.271 -0.893 . . . . 0.0 110.208 179.951 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 23' ' ' ARG . . . . . 0.426 ' C ' ' O ' ' A' ' 22' ' ' VAL . 0.8 OUTLIER 42.88 40.97 2.36 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.287 -0.883 . . . . 0.0 110.288 179.955 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 72.47 27.17 70.11 Favored Glycine 0 N--CA 1.491 2.35 0 N-CA-C 109.728 -1.349 . . . . 0.0 109.728 179.964 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' SER . . . . . 0.489 ' N ' ' O ' ' A' ' 22' ' ' VAL . 13.3 m -121.06 -173.37 2.59 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.217 -1.167 . . . . 0.0 110.112 179.927 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 16.9 t -134.68 101.16 4.84 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.284 -0.885 . . . . 0.0 110.312 -179.959 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 12.3 mm100 -118.61 154.37 32.76 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.253 -0.904 . . . . 0.0 110.154 179.954 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' CYS . . . . . 0.518 ' HA ' ' CA ' ' A' ' 19' ' ' GLY . 64.0 m -139.24 168.22 20.32 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.235 -0.916 . . . . 0.0 110.095 -179.944 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.564 ' CB ' ' CE1' ' A' ' 18' ' ' PHE . 0.2 OUTLIER -128.81 154.65 46.21 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.131 -0.981 . . . . 0.0 110.419 -179.8 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.491 1.612 0 O-C-N 121.374 -0.828 . . . . 0.0 110.091 179.915 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 18.3 p . . . . . 0 N--CA 1.491 1.578 0 CA-C-O 121.244 0.545 . . . . 0.0 110.071 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 90.4 m-20 -114.6 146.26 41.02 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.185 -0.947 . . . . 0.0 110.319 -179.753 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 28.8 m-20 -64.96 -24.44 67.52 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.23 -0.919 . . . . 0.0 109.954 179.802 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.05 -54.07 12.46 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.352 -0.843 . . . . 0.0 110.274 -179.973 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 8.6 t0 -78.58 -4.66 49.93 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.356 -0.84 . . . . 0.0 109.783 179.822 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 5.1 t -95.15 -50.77 4.92 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.422 -0.799 . . . . 0.0 109.548 179.454 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 7.1 m -65.78 -39.8 91.34 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.365 -0.834 . . . . 0.0 109.906 179.633 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.409 HD23 ' HA ' ' A' ' 9' ' ' LEU . 6.5 mt -54.32 -39.24 66.85 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.193 -0.942 . . . . 0.0 110.015 179.828 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -72.25 -35.24 68.75 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.294 -0.878 . . . . 0.0 110.106 179.911 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.444 ' O ' ' HB2' ' A' ' 16' ' ' TYR . 92.0 m -66.57 -42.29 87.24 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.325 -0.859 . . . . 0.0 109.942 179.891 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 23.7 mt -67.43 -35.47 73.56 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.588 0 O-C-N 121.265 -0.897 . . . . 0.0 110.217 179.965 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 3.6 ttt -63.79 -46.33 85.69 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.232 -0.918 . . . . 0.0 110.186 179.996 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -59.19 -21.17 59.04 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.244 -0.91 . . . . 0.0 110.279 -179.941 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 115.63 7.86 15.1 Favored Glycine 0 N--CA 1.49 2.275 0 N-CA-C 109.606 -1.398 . . . . 0.0 109.606 179.849 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' TYR . . . . . 0.444 ' HB2' ' O ' ' A' ' 11' ' ' CYS . 24.7 m-85 -91.02 -159.33 0.62 Allowed 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.134 -1.215 . . . . 0.0 110.3 -179.986 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 17' ' ' ASN . . . . . 0.476 ' HB3' ' CD2' ' A' ' 18' ' ' PHE . 4.8 m-80 -116.88 -70.98 0.76 Allowed 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.209 -0.932 . . . . 0.0 110.372 -179.939 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 18' ' ' PHE . . . . . 0.527 ' CE1' ' HB2' ' A' ' 29' ' ' ARG . 14.8 p90 -128.42 -177.67 4.26 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.21 -0.931 . . . . 0.0 110.274 -179.862 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -151.53 -164.84 12.46 Favored Glycine 0 N--CA 1.49 2.258 0 N-CA-C 109.332 -1.507 . . . . 0.0 109.332 179.975 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.494 ' O ' ' HA ' ' A' ' 26' ' ' CYS . 0.3 OUTLIER -162.16 147.54 12.89 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.15 -1.206 . . . . 0.0 110.3 179.989 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 21' ' ' CYS . . . . . 0.515 ' C ' HG23 ' A' ' 22' ' ' VAL . 0.8 OUTLIER -82.3 139.08 34.37 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.353 -0.842 . . . . 0.0 110.385 -179.99 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.575 HG12 ' HG3' ' A' ' 23' ' ' ARG . 15.1 t -151.57 112.25 0.46 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.607 0 O-C-N 121.303 -0.873 . . . . 0.0 110.255 -179.987 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 23' ' ' ARG . . . . . 0.575 ' HG3' HG12 ' A' ' 22' ' ' VAL . 83.7 mtt180 61.02 73.38 0.48 Allowed 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.253 -0.904 . . . . 0.0 110.347 179.974 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 24' ' ' GLY . . . . . 0.419 ' C ' ' O ' ' A' ' 23' ' ' ARG . . . 42.65 28.12 0.6 Allowed Glycine 0 N--CA 1.492 2.386 0 N-CA-C 109.611 -1.396 . . . . 0.0 109.611 179.893 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 25' ' ' SER . . . . . 0.407 ' N ' ' O ' ' A' ' 23' ' ' ARG . 0.5 OUTLIER -141.22 -163.74 1.61 Allowed 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.276 -1.132 . . . . 0.0 110.041 179.971 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 26' ' ' CYS . . . . . 0.494 ' HA ' ' O ' ' A' ' 20' ' ' LYS . 0.5 OUTLIER -167.07 142.86 4.24 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.234 -0.916 . . . . 0.0 110.171 179.917 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 6.3 mm-40 -119.84 176.18 5.53 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.387 -0.821 . . . . 0.0 110.302 -179.92 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 85.4 m -120.47 135.46 55.05 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.346 -0.846 . . . . 0.0 109.956 179.885 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.527 ' HB2' ' CE1' ' A' ' 18' ' ' PHE . 0.4 OUTLIER -120.53 150.35 40.99 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.26 -0.9 . . . . 0.0 110.395 -179.815 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 5.4 ttt180 . . . . . 0 N--CA 1.492 1.628 0 O-C-N 121.313 -0.867 . . . . 0.0 109.964 179.994 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 2' ' ' CYS . . . . . 0.456 ' SG ' ' O ' ' A' ' 25' ' ' SER . 45.8 t . . . . . 0 N--CA 1.491 1.605 0 CA-C-O 121.179 0.514 . . . . 0.0 110.246 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 66.5 m-80 -116.62 140.79 49.0 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.337 -0.852 . . . . 0.0 110.113 -179.98 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 4' ' ' ASP . . . . . 0.407 ' O ' ' OG ' ' A' ' 8' ' ' SER . 2.8 m-20 -63.05 -13.4 35.39 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.249 -0.907 . . . . 0.0 110.096 179.994 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 5' ' ' ARG . . . . . 0.859 ' O ' HD12 ' A' ' 9' ' ' LEU . 0.0 OUTLIER -80.89 -40.05 25.32 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.373 -0.83 . . . . 0.0 110.2 179.994 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 6' ' ' ASP . . . . . 0.415 ' O ' ' CB ' ' A' ' 10' ' ' ASP . 1.0 OUTLIER -79.62 -29.29 41.02 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.175 -0.953 . . . . 0.0 110.146 -179.958 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -76.38 -47.2 24.1 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.183 -0.948 . . . . 0.0 110.039 179.873 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 8' ' ' SER . . . . . 0.407 ' OG ' ' O ' ' A' ' 4' ' ' ASP . 7.3 m -65.85 -39.81 91.12 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.192 -0.942 . . . . 0.0 109.994 179.884 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.859 HD12 ' O ' ' A' ' 5' ' ' ARG . 4.0 mt -73.77 -36.57 65.09 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.32 -0.862 . . . . 0.0 110.164 179.775 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 10' ' ' ASP . . . . . 0.415 ' CB ' ' O ' ' A' ' 6' ' ' ASP . 36.9 t0 -76.43 -42.32 44.43 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.239 -0.913 . . . . 0.0 110.126 179.909 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.447 ' O ' ' HB2' ' A' ' 16' ' ' TYR . 93.9 m -67.28 -40.81 86.19 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.244 -0.91 . . . . 0.0 110.174 179.992 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 44.7 mt -66.23 -40.0 85.77 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.616 0 O-C-N 121.307 -0.871 . . . . 0.0 110.267 179.932 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' MET . . . . . 0.42 ' HB2' ' O ' ' A' ' 9' ' ' LEU . 2.3 ttp -68.29 -34.58 76.41 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.255 -0.903 . . . . 0.0 110.205 -179.994 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -64.05 -19.1 64.97 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.321 -0.862 . . . . 0.0 110.178 -179.991 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 15' ' ' GLY . . . . . 0.445 ' O ' ' NH1' ' A' ' 30' ' ' ARG . . . 109.91 16.42 10.7 Favored Glycine 0 N--CA 1.49 2.263 0 N-CA-C 109.662 -1.375 . . . . 0.0 109.662 -179.985 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 16' ' ' TYR . . . . . 0.459 ' HA ' ' NH1' ' A' ' 30' ' ' ARG . 31.5 m-85 -97.36 -160.92 0.83 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.311 -1.111 . . . . 0.0 110.178 -179.873 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 17' ' ' ASN . . . . . 0.551 ' ND2' ' CD2' ' A' ' 18' ' ' PHE . 9.0 t30 -119.4 -64.47 1.27 Allowed 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.237 -0.915 . . . . 0.0 110.272 -179.881 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 18' ' ' PHE . . . . . 0.594 ' CE1' ' HB3' ' A' ' 29' ' ' ARG . 6.6 p90 -143.77 145.28 32.26 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.184 -0.947 . . . . 0.0 110.289 -179.897 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 19' ' ' GLY . . . . . 0.459 ' HA3' ' HA ' ' A' ' 28' ' ' CYS . . . -132.99 -150.1 6.31 Favored Glycine 0 N--CA 1.491 2.331 0 N-CA-C 109.736 -1.345 . . . . 0.0 109.736 -179.965 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -170.66 173.52 5.36 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.185 -1.186 . . . . 0.0 110.229 -179.949 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 9.7 m -104.42 125.64 50.81 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.255 -0.903 . . . . 0.0 110.13 179.852 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.47 ' HB ' ' HB2' ' A' ' 25' ' ' SER . 9.9 t -86.81 43.12 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.633 0 O-C-N 121.2 -0.938 . . . . 0.0 110.037 179.858 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 3.4 mtm180 54.13 33.8 18.66 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.324 -0.86 . . . . 0.0 110.362 179.731 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 158.13 -19.36 0.34 Allowed Glycine 0 N--CA 1.491 2.319 0 C-N-CA 119.767 -1.206 . . . . 0.0 110.086 179.802 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' SER . . . . . 0.47 ' HB2' ' HB ' ' A' ' 22' ' ' VAL . 22.6 m -127.66 -176.55 3.79 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 120.993 -1.298 . . . . 0.0 110.681 -179.824 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 26' ' ' CYS . . . . . 0.45 ' SG ' ' SG ' ' A' ' 2' ' ' CYS . 0.1 OUTLIER -134.58 120.14 19.27 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.442 -0.787 . . . . 0.0 109.887 -179.863 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 1.8 mm-40 -118.68 167.2 11.88 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.202 -0.936 . . . . 0.0 110.494 -179.754 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' CYS . . . . . 0.459 ' HA ' ' HA3' ' A' ' 19' ' ' GLY . 17.7 m -136.52 152.05 50.1 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.206 -0.934 . . . . 0.0 109.97 179.849 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.594 ' HB3' ' CE1' ' A' ' 18' ' ' PHE . 0.0 OUTLIER -132.5 152.03 51.69 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.155 -0.966 . . . . 0.0 110.398 -179.868 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.459 ' NH1' ' HA ' ' A' ' 16' ' ' TYR . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.665 0 O-C-N 121.303 -0.873 . . . . 0.0 110.036 179.889 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 2' ' ' CYS . . . . . 0.439 ' HB2' ' SG ' ' A' ' 26' ' ' CYS . 23.3 p . . . . . 0 N--CA 1.491 1.611 0 CA-C-O 121.281 0.562 . . . . 0.0 110.342 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 3' ' ' ASN . . . . . 0.455 ' O ' ' SG ' ' A' ' 7' ' ' CYS . 0.1 OUTLIER -112.6 110.22 20.25 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.159 -0.963 . . . . 0.0 110.226 179.955 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 4' ' ' ASP . . . . . 0.507 ' OD1' ' N ' ' A' ' 4' ' ' ASP . 0.8 OUTLIER -50.9 -35.46 33.11 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.291 -0.881 . . . . 0.0 110.32 -179.901 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 5' ' ' ARG . . . . . 0.777 ' O ' HD12 ' A' ' 9' ' ' LEU . 0.1 OUTLIER -62.31 -49.04 77.19 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.201 -0.937 . . . . 0.0 110.195 -179.945 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 6' ' ' ASP . . . . . 0.466 ' O ' ' HB2' ' A' ' 10' ' ' ASP . 0.3 OUTLIER -79.2 -6.65 57.09 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.314 -0.866 . . . . 0.0 110.0 179.873 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.455 ' SG ' ' O ' ' A' ' 3' ' ' ASN . 87.4 m -89.81 -40.29 12.55 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.227 -0.921 . . . . 0.0 109.915 179.634 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 8.5 t -77.49 -39.24 47.07 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.297 -0.877 . . . . 0.0 110.082 179.693 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.777 HD12 ' O ' ' A' ' 5' ' ' ARG . 12.7 mt -72.54 -38.78 67.89 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.309 -0.869 . . . . 0.0 110.063 179.875 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 10' ' ' ASP . . . . . 0.474 ' O ' ' HG2' ' A' ' 14' ' ' LYS . 12.1 t70 -69.41 -43.21 73.87 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.293 -0.88 . . . . 0.0 109.999 179.821 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.401 ' O ' ' HB2' ' A' ' 16' ' ' TYR . 53.4 m -65.95 -40.36 91.27 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.289 -0.882 . . . . 0.0 109.733 179.82 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 27.1 mt -63.73 -32.1 55.63 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.509 0 O-C-N 121.286 -0.884 . . . . 0.0 109.494 179.411 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -65.27 -45.06 85.99 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.367 -0.833 . . . . 0.0 109.694 179.506 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 14' ' ' LYS . . . . . 0.474 ' HG2' ' O ' ' A' ' 10' ' ' ASP . 11.8 mmmm -57.61 -17.57 15.14 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.34 -0.85 . . . . 0.0 109.855 179.621 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 107.02 40.07 1.89 Allowed Glycine 0 N--CA 1.491 2.328 0 N-CA-C 109.222 -1.551 . . . . 0.0 109.222 -179.712 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' TYR . . . . . 0.401 ' HB2' ' O ' ' A' ' 11' ' ' CYS . 12.3 m-85 -121.88 -165.54 1.27 Allowed 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.346 -1.091 . . . . 0.0 110.418 -179.74 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 17' ' ' ASN . . . . . 0.589 ' HB3' ' CD2' ' A' ' 18' ' ' PHE . 9.5 m-80 -98.11 -53.54 3.34 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.33 -0.856 . . . . 0.0 110.154 179.904 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 18' ' ' PHE . . . . . 0.589 ' CD2' ' HB3' ' A' ' 17' ' ' ASN . 11.0 p90 -161.27 -171.11 2.89 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.194 -0.941 . . . . 0.0 110.268 179.848 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -140.64 -179.23 17.95 Favored Glycine 0 N--CA 1.491 2.34 0 N-CA-C 109.639 -1.384 . . . . 0.0 109.639 179.985 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.43 ' O ' ' HA ' ' A' ' 26' ' ' CYS . 0.2 OUTLIER -149.41 151.17 33.59 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.254 -1.145 . . . . 0.0 110.387 179.978 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 21' ' ' CYS . . . . . 0.434 ' SG ' ' SG ' ' A' ' 26' ' ' CYS . 0.8 OUTLIER -89.88 132.49 35.26 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.228 -0.92 . . . . 0.0 110.245 -179.971 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.522 ' O ' ' CB ' ' A' ' 25' ' ' SER . 99.1 t -136.31 100.93 2.43 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.594 0 O-C-N 121.271 -0.893 . . . . 0.0 110.317 -179.941 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 50.92 80.3 0.08 Allowed 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.266 -0.896 . . . . 0.0 110.431 179.843 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 47.78 23.71 2.55 Favored Glycine 0 N--CA 1.49 2.278 0 N-CA-C 109.696 -1.362 . . . . 0.0 109.696 179.866 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' SER . . . . . 0.522 ' CB ' ' O ' ' A' ' 22' ' ' VAL . 1.2 t -127.16 173.67 9.53 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.217 -1.167 . . . . 0.0 110.137 179.968 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 26' ' ' CYS . . . . . 0.439 ' SG ' ' HB2' ' A' ' 2' ' ' CYS . 0.0 OUTLIER -158.47 123.57 4.32 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.227 -0.921 . . . . 0.0 110.318 179.919 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 25.1 mm-40 -120.28 -175.06 2.92 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.223 -0.923 . . . . 0.0 110.34 179.878 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 56.8 m -119.99 145.66 46.59 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.214 -0.929 . . . . 0.0 110.123 179.931 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.565 ' CB ' ' CE1' ' A' ' 18' ' ' PHE . 0.4 OUTLIER -126.99 165.04 20.17 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.167 -0.958 . . . . 0.0 110.141 -179.905 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.493 1.678 0 O-C-N 121.25 -0.906 . . . . 0.0 110.23 -179.979 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 2' ' ' CYS . . . . . 0.439 ' SG ' ' O ' ' A' ' 25' ' ' SER . 6.5 t . . . . . 0 N--CA 1.49 1.57 0 CA-C-O 121.18 0.514 . . . . 0.0 110.171 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 2.8 m-80 -110.13 140.21 44.46 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.296 -0.878 . . . . 0.0 110.195 179.962 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -51.13 -43.44 61.17 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.203 -0.936 . . . . 0.0 110.182 -179.945 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 21.6 mtp180 -72.74 -42.81 63.69 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.253 -0.904 . . . . 0.0 110.203 179.998 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 1.3 t0 -79.92 3.93 18.36 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.36 -0.838 . . . . 0.0 110.154 179.964 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 8.6 t -107.21 -31.85 8.05 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.214 -0.929 . . . . 0.0 110.222 -179.966 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 8' ' ' SER . . . . . 0.447 ' O ' HG13 ' A' ' 12' ' ' ILE . 36.7 t -93.12 -31.19 14.9 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.267 -0.895 . . . . 0.0 110.218 179.941 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.402 HD23 ' HA ' ' A' ' 9' ' ' LEU . 34.5 mt -57.2 -57.83 10.88 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.176 -0.953 . . . . 0.0 110.139 -179.992 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -62.7 -38.54 90.82 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.33 -0.856 . . . . 0.0 110.237 -179.997 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -66.21 -38.32 87.68 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.246 -0.909 . . . . 0.0 110.02 -179.984 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 12' ' ' ILE . . . . . 0.447 HG13 ' O ' ' A' ' 8' ' ' SER . 11.0 mt -63.94 -34.3 67.51 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.549 0 O-C-N 121.292 -0.88 . . . . 0.0 109.669 179.587 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 36.9 mtt -67.9 -38.86 83.49 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.411 -0.806 . . . . 0.0 110.068 179.68 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 33.8 mtmt -55.07 -33.28 62.62 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.303 -0.873 . . . . 0.0 110.378 -179.882 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 130.69 2.07 4.92 Favored Glycine 0 N--CA 1.491 2.31 0 N-CA-C 109.871 -1.291 . . . . 0.0 109.871 179.948 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 81.2 m-85 -79.41 -178.02 6.05 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.063 -1.257 . . . . 0.0 110.214 -179.96 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' ASN . . . . . 0.484 ' HB3' ' CD2' ' A' ' 18' ' ' PHE . 4.4 t30 -103.73 -66.09 0.97 Allowed 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.287 -0.883 . . . . 0.0 110.272 -179.976 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 18' ' ' PHE . . . . . 0.53 ' CE1' ' HB2' ' A' ' 29' ' ' ARG . 7.2 p90 -138.58 159.07 43.0 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.164 -0.96 . . . . 0.0 110.387 -179.958 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 19' ' ' GLY . . . . . 0.523 ' CA ' ' HA ' ' A' ' 28' ' ' CYS . . . -156.64 172.35 34.33 Favored Glycine 0 N--CA 1.489 2.22 0 N-CA-C 109.816 -1.314 . . . . 0.0 109.816 179.992 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -143.2 166.8 23.71 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.333 -1.098 . . . . 0.0 110.14 179.923 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 21' ' ' CYS . . . . . 0.505 ' HA ' ' O ' ' A' ' 25' ' ' SER . 47.0 t -98.94 116.04 30.27 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.222 -0.924 . . . . 0.0 110.079 179.863 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.595 ' O ' HG12 ' A' ' 22' ' ' VAL . 41.1 t -80.22 82.86 1.25 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.676 0 O-C-N 121.155 -0.965 . . . . 0.0 110.085 -179.933 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 61.73 -77.03 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.298 -0.876 . . . . 0.0 109.895 -179.927 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 24' ' ' GLY . . . . . 0.519 ' N ' ' O ' ' A' ' 22' ' ' VAL . . . -127.24 39.32 1.97 Allowed Glycine 0 N--CA 1.489 2.183 0 N-CA-C 109.285 -1.526 . . . . 0.0 109.285 179.711 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 25' ' ' SER . . . . . 0.505 ' O ' ' HA ' ' A' ' 21' ' ' CYS . 0.3 OUTLIER -147.01 172.97 12.9 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.326 -1.102 . . . . 0.0 110.039 -179.951 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 49.3 t -134.85 98.31 3.99 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.201 -0.937 . . . . 0.0 110.248 -179.884 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' GLN . . . . . 0.408 ' C ' ' SG ' ' A' ' 28' ' ' CYS . 4.6 mm-40 -105.43 157.99 16.97 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.292 -0.88 . . . . 0.0 109.915 179.943 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 28' ' ' CYS . . . . . 0.523 ' HA ' ' CA ' ' A' ' 19' ' ' GLY . 34.3 m -142.65 170.72 15.17 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.079 -1.013 . . . . 0.0 110.541 -179.803 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.53 ' HB2' ' CE1' ' A' ' 18' ' ' PHE . 27.9 mmt180 -142.1 164.72 29.41 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.388 -0.82 . . . . 0.0 110.304 -179.75 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 54.3 mtp180 . . . . . 0 N--CA 1.491 1.6 0 O-C-N 121.282 -0.886 . . . . 0.0 110.139 179.973 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 2' ' ' CYS . . . . . 0.471 ' HA ' ' HB2' ' A' ' 26' ' ' CYS . 12.1 t . . . . . 0 N--CA 1.491 1.611 0 CA-C-O 121.293 0.568 . . . . 0.0 110.288 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 3' ' ' ASN . . . . . 0.41 ' O ' ' N ' ' A' ' 7' ' ' CYS . 1.4 m-20 -145.92 131.57 18.89 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.215 -0.928 . . . . 0.0 110.11 179.861 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 4' ' ' ASP . . . . . 0.425 ' O ' ' OG ' ' A' ' 8' ' ' SER . 65.6 m-20 -50.87 -37.25 42.31 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.219 -0.926 . . . . 0.0 110.259 179.997 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 5' ' ' ARG . . . . . 0.461 ' O ' ' HB2' ' A' ' 9' ' ' LEU . 0.0 OUTLIER -73.44 -41.54 63.1 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.307 -0.871 . . . . 0.0 110.147 179.999 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 33.8 m-20 -80.0 -22.75 42.11 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.227 -0.921 . . . . 0.0 110.308 -179.944 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.41 ' N ' ' O ' ' A' ' 3' ' ' ASN . 41.4 m -76.36 -36.24 58.28 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.395 -0.816 . . . . 0.0 110.091 -179.914 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 8' ' ' SER . . . . . 0.427 ' O ' HG13 ' A' ' 12' ' ' ILE . 0.7 OUTLIER -85.02 -33.69 22.48 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.242 -0.912 . . . . 0.0 110.517 -179.703 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.461 ' HB2' ' O ' ' A' ' 5' ' ' ARG . 0.7 OUTLIER -71.59 -52.95 15.43 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.173 -0.954 . . . . 0.0 110.322 -179.838 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 10' ' ' ASP . . . . . 0.401 ' O ' ' HG3' ' A' ' 14' ' ' LYS . 2.3 t0 -62.69 -24.71 67.79 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.193 -0.942 . . . . 0.0 110.147 179.899 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.402 ' SG ' ' O ' ' A' ' 7' ' ' CYS . 3.6 m -78.96 -45.65 19.94 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.185 -0.947 . . . . 0.0 110.287 -179.986 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 12' ' ' ILE . . . . . 0.427 HG13 ' O ' ' A' ' 8' ' ' SER . 64.2 mt -63.57 -30.25 49.36 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.626 0 O-C-N 121.123 -0.985 . . . . 0.0 110.222 179.991 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 13' ' ' MET . . . . . 0.451 ' HG3' ' O ' ' A' ' 9' ' ' LEU . 11.9 mtp -84.24 -27.35 28.0 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.272 -0.893 . . . . 0.0 110.178 179.832 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 14' ' ' LYS . . . . . 0.401 ' HG3' ' O ' ' A' ' 10' ' ' ASP . 0.1 OUTLIER -78.93 -27.17 43.68 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.254 -0.904 . . . . 0.0 110.29 179.942 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 121.88 17.69 3.73 Favored Glycine 0 N--CA 1.492 2.415 0 N-CA-C 109.634 -1.387 . . . . 0.0 109.634 179.87 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' TYR . . . . . 0.473 ' HB3' ' SG ' ' A' ' 28' ' ' CYS . 45.0 m-85 -100.22 -170.45 1.87 Allowed 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.242 -1.152 . . . . 0.0 110.263 -179.99 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 17' ' ' ASN . . . . . 0.568 ' HB3' ' CD2' ' A' ' 18' ' ' PHE . 2.4 m120 -122.54 -56.92 1.77 Allowed 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.274 -0.891 . . . . 0.0 110.241 179.929 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 18' ' ' PHE . . . . . 0.58 ' CE1' ' HB3' ' A' ' 29' ' ' ARG . 11.6 p90 -147.33 153.88 40.23 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.188 -0.945 . . . . 0.0 110.186 -179.922 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 19' ' ' GLY . . . . . 0.539 ' CA ' ' HA ' ' A' ' 28' ' ' CYS . . . -136.74 -146.86 5.24 Favored Glycine 0 N--CA 1.492 2.367 0 N-CA-C 109.745 -1.342 . . . . 0.0 109.745 -179.924 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 175.04 141.99 0.05 Allowed 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.27 -1.135 . . . . 0.0 110.209 -179.957 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 21' ' ' CYS . . . . . 0.489 ' HA ' ' O ' ' A' ' 25' ' ' SER . 0.1 OUTLIER -97.04 125.61 41.61 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.203 -0.935 . . . . 0.0 110.456 -179.868 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.642 ' O ' HG12 ' A' ' 22' ' ' VAL . 60.7 t -94.39 45.47 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.564 0 O-C-N 121.348 -0.845 . . . . 0.0 109.964 179.812 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 61.32 84.85 0.13 Allowed 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.321 -0.862 . . . . 0.0 110.384 -179.96 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 103.63 -20.17 42.59 Favored Glycine 0 N--CA 1.491 2.34 0 N-CA-C 109.782 -1.327 . . . . 0.0 109.782 179.756 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' SER . . . . . 0.489 ' O ' ' HA ' ' A' ' 21' ' ' CYS . 3.0 t -132.2 162.21 31.5 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.122 -1.222 . . . . 0.0 110.33 -179.875 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 26' ' ' CYS . . . . . 0.471 ' HB2' ' HA ' ' A' ' 2' ' ' CYS . 18.2 t -138.7 123.34 18.58 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.288 -0.883 . . . . 0.0 110.426 -179.926 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 76.9 mt-30 -108.74 175.2 5.55 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.344 -0.847 . . . . 0.0 110.085 179.872 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' CYS . . . . . 0.539 ' HA ' ' CA ' ' A' ' 19' ' ' GLY . 6.9 t -148.68 156.4 42.33 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.298 -0.876 . . . . 0.0 110.431 -179.856 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.58 ' HB3' ' CE1' ' A' ' 18' ' ' PHE . 6.2 mmm-85 -144.53 137.14 26.62 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.244 -0.91 . . . . 0.0 110.215 179.903 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.458 ' HG3' ' CD2' ' A' ' 16' ' ' TYR . 1.7 mpp_? . . . . . 0 N--CA 1.491 1.598 0 O-C-N 121.302 -0.874 . . . . 0.0 110.177 -179.958 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 2' ' ' CYS . . . . . 0.478 ' O ' ' HB2' ' A' ' 21' ' ' CYS . 17.7 p . . . . . 0 N--CA 1.492 1.63 0 CA-C-O 121.271 0.558 . . . . 0.0 110.182 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 3' ' ' ASN . . . . . 0.417 ' OD1' ' O ' ' A' ' 3' ' ' ASN . 53.2 p-10 -51.98 154.89 2.0 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.178 -0.951 . . . . 0.0 110.132 179.994 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 4' ' ' ASP . . . . . 0.484 ' OD2' ' HG2' ' A' ' 20' ' ' LYS . 0.6 OUTLIER -65.23 -15.93 62.99 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.358 -0.839 . . . . 0.0 110.385 -179.798 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 5' ' ' ARG . . . . . 0.405 ' HB3' ' ND2' ' A' ' 3' ' ' ASN . 0.0 OUTLIER -75.33 -54.45 7.06 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.271 -0.893 . . . . 0.0 110.522 -179.788 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 2.1 t0 -79.77 -25.85 40.85 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.255 -0.903 . . . . 0.0 110.674 -179.683 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.4 ' O ' ' SG ' ' A' ' 11' ' ' CYS . 30.9 t -76.76 -33.83 58.06 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.204 -0.935 . . . . 0.0 110.25 -179.868 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 8' ' ' SER . . . . . 0.451 ' HB3' ' O ' ' A' ' 4' ' ' ASP . 22.7 p -79.58 -43.19 23.43 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.182 -0.949 . . . . 0.0 110.317 179.939 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -53.49 -42.04 66.87 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.258 -0.901 . . . . 0.0 110.203 -179.982 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 3.3 t70 -63.45 -27.19 69.11 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.298 -0.876 . . . . 0.0 110.097 179.733 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.4 ' SG ' ' O ' ' A' ' 7' ' ' CYS . 79.4 m -71.51 -41.4 69.3 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.271 -0.893 . . . . 0.0 110.107 -179.983 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 36.1 mt -63.65 -45.62 96.98 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.576 0 O-C-N 121.316 -0.865 . . . . 0.0 110.034 179.851 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 1.2 ttp -64.28 -31.42 72.62 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.243 -0.911 . . . . 0.0 109.98 179.767 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.47 -32.16 66.01 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.34 -0.85 . . . . 0.0 110.152 -179.945 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 137.3 -7.41 3.71 Favored Glycine 0 N--CA 1.491 2.323 0 N-CA-C 109.509 -1.436 . . . . 0.0 109.509 -179.904 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 26.2 m-85 -87.89 -170.12 2.86 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.321 -1.105 . . . . 0.0 110.15 -179.888 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 35.2 t-20 -120.61 -40.81 2.63 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.333 -0.854 . . . . 0.0 110.237 179.864 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' PHE . . . . . 0.605 ' CE2' ' CB ' ' A' ' 29' ' ' ARG . 38.4 p90 -146.58 146.96 30.64 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.342 -0.849 . . . . 0.0 110.193 179.829 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 19' ' ' GLY . . . . . 0.435 ' CA ' ' HA ' ' A' ' 28' ' ' CYS . . . -137.34 -173.01 12.73 Favored Glycine 0 N--CA 1.491 2.302 0 N-CA-C 109.524 -1.43 . . . . 0.0 109.524 -179.937 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.484 ' HG2' ' OD2' ' A' ' 4' ' ' ASP . 0.0 OUTLIER -161.96 159.25 26.32 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.191 -1.182 . . . . 0.0 110.258 179.963 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 21' ' ' CYS . . . . . 0.488 ' HA ' ' O ' ' A' ' 25' ' ' SER . 40.7 t -87.43 139.47 30.52 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.29 -0.881 . . . . 0.0 110.018 -179.977 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.49 ' HB ' ' HB2' ' A' ' 25' ' ' SER . 43.0 t -117.89 92.49 2.15 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.684 0 O-C-N 121.154 -0.966 . . . . 0.0 110.679 -179.8 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER 50.66 53.87 12.2 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.477 -0.764 . . . . 0.0 111.108 179.328 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 89.97 15.98 56.86 Favored Glycine 0 N--CA 1.491 2.345 0 C-N-CA 119.886 -1.15 . . . . 0.0 110.312 179.205 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' SER . . . . . 0.49 ' HB2' ' HB ' ' A' ' 22' ' ' VAL . 1.1 m -122.04 178.99 4.67 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.006 -1.29 . . . . 0.0 110.134 179.719 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 46.0 t -145.75 95.03 2.58 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.258 -0.901 . . . . 0.0 110.32 -179.911 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -105.64 178.42 4.57 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.333 -0.855 . . . . 0.0 110.195 179.83 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 28' ' ' CYS . . . . . 0.435 ' HA ' ' CA ' ' A' ' 19' ' ' GLY . 82.0 m -134.69 150.33 50.6 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.259 -0.901 . . . . 0.0 110.284 -179.962 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.605 ' CB ' ' CE2' ' A' ' 18' ' ' PHE . 10.1 mtt180 -122.59 146.37 47.49 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.259 -0.901 . . . . 0.0 110.1 -179.972 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.444 ' O ' ' CZ ' ' A' ' 18' ' ' PHE . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.581 0 O-C-N 121.217 -0.927 . . . . 0.0 110.19 179.985 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 2' ' ' CYS . . . . . 0.446 ' HB3' ' HB3' ' A' ' 21' ' ' CYS . 48.9 t . . . . . 0 N--CA 1.491 1.608 0 CA-C-O 121.241 0.544 . . . . 0.0 110.257 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 2.6 m-20 -82.41 139.34 34.08 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.197 -0.939 . . . . 0.0 110.24 179.941 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 46.7 m-20 -66.85 -30.92 71.22 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.195 -0.941 . . . . 0.0 110.118 179.912 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 5' ' ' ARG . . . . . 0.525 ' O ' HD12 ' A' ' 9' ' ' LEU . 6.5 mtp180 -75.98 -41.84 50.12 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.277 -0.89 . . . . 0.0 110.098 179.868 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -79.64 -23.04 42.84 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.253 -0.904 . . . . 0.0 110.323 179.967 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 46.7 t -78.75 -38.06 39.71 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.21 -0.931 . . . . 0.0 110.145 179.877 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 38.1 t -75.06 -42.05 57.72 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.245 -0.909 . . . . 0.0 110.079 179.879 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.525 HD12 ' O ' ' A' ' 5' ' ' ARG . 61.5 mt -53.86 -47.02 71.42 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.306 -0.871 . . . . 0.0 110.292 -179.963 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 10' ' ' ASP . . . . . 0.487 ' O ' ' HG3' ' A' ' 14' ' ' LYS . 5.5 m-20 -62.66 -38.82 91.83 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.272 -0.893 . . . . 0.0 110.108 179.959 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.449 ' O ' ' HB2' ' A' ' 16' ' ' TYR . 87.5 m -66.69 -39.13 87.97 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.285 -0.885 . . . . 0.0 110.042 179.94 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 12' ' ' ILE . . . . . 0.414 HG21 HD13 ' A' ' 12' ' ' ILE . 17.1 mt -63.67 -33.23 60.43 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.633 0 O-C-N 121.356 -0.84 . . . . 0.0 110.187 -179.865 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 13' ' ' MET . . . . . 0.446 ' HA ' ' CE ' ' A' ' 13' ' ' MET . 0.3 OUTLIER -71.28 -39.94 71.21 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.321 -0.862 . . . . 0.0 110.198 -179.977 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 14' ' ' LYS . . . . . 0.487 ' HG3' ' O ' ' A' ' 10' ' ' ASP . 1.1 mtmm -59.42 -14.58 12.72 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.126 -0.984 . . . . 0.0 110.218 -179.852 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 108.2 11.86 23.05 Favored Glycine 0 N--CA 1.49 2.262 0 N-CA-C 109.452 -1.459 . . . . 0.0 109.452 -179.931 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' TYR . . . . . 0.449 ' HB2' ' O ' ' A' ' 11' ' ' CYS . 5.8 m-85 -93.69 -165.08 1.26 Allowed 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.209 -1.171 . . . . 0.0 110.202 179.953 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -113.56 -62.12 1.64 Allowed 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.32 -0.863 . . . . 0.0 109.907 179.888 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 18' ' ' PHE . . . . . 0.492 ' CE1' ' HB2' ' A' ' 29' ' ' ARG . 1.0 OUTLIER -133.09 159.97 38.54 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.36 -0.837 . . . . 0.0 110.017 179.777 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -137.46 173.61 22.19 Favored Glycine 0 N--CA 1.491 2.306 0 N-CA-C 109.638 -1.385 . . . . 0.0 109.638 -179.799 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 19.3 ttpt -153.35 144.92 23.31 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.278 -1.13 . . . . 0.0 110.0 -179.919 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' CYS . . . . . 0.496 ' C ' HG23 ' A' ' 22' ' ' VAL . 83.5 m -84.1 153.75 23.57 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.248 -0.907 . . . . 0.0 110.323 -179.93 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.538 ' O ' ' CG ' ' A' ' 23' ' ' ARG . 58.1 t -150.16 145.52 17.14 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.557 0 O-C-N 121.279 -0.888 . . . . 0.0 110.155 179.947 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 23' ' ' ARG . . . . . 0.538 ' CG ' ' O ' ' A' ' 22' ' ' VAL . 16.1 ptt180 38.22 33.46 0.06 Allowed 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.632 -0.667 . . . . 0.0 110.697 179.998 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 24' ' ' GLY . . . . . 0.408 ' N ' ' O ' ' A' ' 22' ' ' VAL . . . 79.91 37.55 22.13 Favored Glycine 0 N--CA 1.489 2.231 0 N-CA-C 109.523 -1.431 . . . . 0.0 109.523 -179.938 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 25' ' ' SER . . . . . 0.485 ' N ' ' O ' ' A' ' 22' ' ' VAL . 7.7 t -138.05 -168.85 2.44 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.268 -1.136 . . . . 0.0 110.173 179.999 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 26' ' ' CYS . . . . . 0.442 ' HB2' ' SG ' ' A' ' 2' ' ' CYS . 49.4 t -141.15 120.16 12.8 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.26 -0.9 . . . . 0.0 110.265 -179.959 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 24.6 mt-30 -118.75 166.15 13.13 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.232 -0.918 . . . . 0.0 110.208 -179.988 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 18.1 m -128.81 148.59 50.89 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.255 -0.903 . . . . 0.0 110.091 -179.904 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.492 ' HB2' ' CE1' ' A' ' 18' ' ' PHE . 8.4 mmm-85 -129.02 168.02 16.65 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.182 -0.949 . . . . 0.0 110.299 179.969 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 15.2 mtm180 . . . . . 0 N--CA 1.491 1.58 0 O-C-N 121.334 -0.854 . . . . 0.0 110.331 -179.987 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 16.3 p . . . . . 0 N--CA 1.49 1.567 0 CA-C-O 121.268 0.556 . . . . 0.0 110.195 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 6.2 m120 -100.32 128.05 46.48 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.142 -0.974 . . . . 0.0 110.305 -179.889 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -66.41 -48.56 69.67 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.306 -0.871 . . . . 0.0 110.044 179.909 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 5' ' ' ARG . . . . . 0.766 ' O ' HD12 ' A' ' 9' ' ' LEU . 1.5 ttt85 -62.53 -35.89 80.87 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.295 -0.878 . . . . 0.0 109.723 179.701 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 1.9 t0 -79.53 -20.97 45.83 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.357 -0.839 . . . . 0.0 109.563 179.47 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.423 ' O ' ' HB2' ' A' ' 11' ' ' CYS . 7.5 t -80.34 -45.71 17.33 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.432 -0.793 . . . . 0.0 109.874 179.639 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 8' ' ' SER . . . . . 0.688 ' O ' HD12 ' A' ' 12' ' ' ILE . 0.4 OUTLIER -68.35 -44.28 75.58 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.428 -0.795 . . . . 0.0 110.207 -179.971 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.766 HD12 ' O ' ' A' ' 5' ' ' ARG . 0.2 OUTLIER -53.99 -43.43 69.99 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.272 -0.893 . . . . 0.0 110.023 179.939 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 10' ' ' ASP . . . . . 0.474 ' O ' ' HG3' ' A' ' 14' ' ' LYS . 11.5 t0 -74.02 -43.5 57.75 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.319 -0.863 . . . . 0.0 110.255 179.953 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.423 ' HB2' ' O ' ' A' ' 7' ' ' CYS . 0.0 OUTLIER -66.48 -39.95 89.04 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.166 -0.959 . . . . 0.0 110.433 -179.779 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 12' ' ' ILE . . . . . 0.688 HD12 ' O ' ' A' ' 8' ' ' SER . 14.3 mt -63.4 -47.05 93.65 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.672 0 O-C-N 121.141 -0.975 . . . . 0.0 110.034 179.962 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -64.41 -25.32 67.97 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.156 -0.965 . . . . 0.0 109.83 179.719 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 14' ' ' LYS . . . . . 0.474 ' HG3' ' O ' ' A' ' 10' ' ' ASP . 3.4 mttt -73.29 -36.75 66.36 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.293 -0.879 . . . . 0.0 110.151 179.78 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 147.47 -13.78 1.4 Allowed Glycine 0 N--CA 1.491 2.349 0 N-CA-C 109.666 -1.374 . . . . 0.0 109.666 179.941 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' TYR . . . . . 0.474 ' CE2' ' HD2' ' A' ' 30' ' ' ARG . 85.6 m-85 -74.05 -168.7 0.65 Allowed 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.117 -1.225 . . . . 0.0 110.299 179.997 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 17' ' ' ASN . . . . . 0.573 ' HB3' ' CD2' ' A' ' 18' ' ' PHE . 0.7 OUTLIER -132.12 -53.06 0.97 Allowed 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.193 -0.942 . . . . 0.0 110.339 -179.967 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 18' ' ' PHE . . . . . 0.605 ' CE1' ' HB2' ' A' ' 29' ' ' ARG . 9.4 p90 -141.62 152.82 44.33 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.138 -0.977 . . . . 0.0 110.428 179.928 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -148.72 -152.18 5.65 Favored Glycine 0 N--CA 1.489 2.222 0 N-CA-C 109.565 -1.414 . . . . 0.0 109.565 179.977 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.496 ' O ' ' HA ' ' A' ' 26' ' ' CYS . 0.0 OUTLIER -174.18 149.42 1.42 Allowed 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.267 -1.137 . . . . 0.0 110.096 -179.989 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -90.14 129.04 36.47 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.258 -0.901 . . . . 0.0 110.322 179.977 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.456 ' O ' ' HB2' ' A' ' 23' ' ' ARG . 54.0 t -111.08 94.1 2.91 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.58 0 O-C-N 121.264 -0.898 . . . . 0.0 110.33 -179.955 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 23' ' ' ARG . . . . . 0.456 ' HB2' ' O ' ' A' ' 22' ' ' VAL . 5.4 mtt-85 61.32 -88.67 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.328 -0.858 . . . . 0.0 110.506 179.863 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -119.94 24.21 7.97 Favored Glycine 0 N--CA 1.489 2.197 0 N-CA-C 109.784 -1.327 . . . . 0.0 109.784 -179.703 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' SER . . . . . 0.453 ' O ' ' N ' ' A' ' 22' ' ' VAL . 0.3 OUTLIER -147.98 -174.54 4.59 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.165 -1.197 . . . . 0.0 110.076 179.856 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 26' ' ' CYS . . . . . 0.496 ' HA ' ' O ' ' A' ' 20' ' ' LYS . 9.2 t -149.67 150.7 32.54 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.257 -0.902 . . . . 0.0 110.48 179.942 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 27' ' ' GLN . . . . . 0.43 ' O ' ' SG ' ' A' ' 28' ' ' CYS . 36.0 mt-30 -113.5 175.25 5.53 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.381 -0.824 . . . . 0.0 109.763 179.64 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 28' ' ' CYS . . . . . 0.43 ' SG ' ' O ' ' A' ' 27' ' ' GLN . 7.5 m -155.66 141.4 18.0 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.214 -0.929 . . . . 0.0 110.339 -179.883 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.605 ' HB2' ' CE1' ' A' ' 18' ' ' PHE . 1.0 OUTLIER -134.1 137.63 44.71 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.31 -0.869 . . . . 0.0 110.109 -179.974 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.474 ' HD2' ' CE2' ' A' ' 16' ' ' TYR . 0.4 OUTLIER . . . . . 0 N--CA 1.492 1.662 0 O-C-N 121.299 -0.876 . . . . 0.0 110.415 -179.811 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 2' ' ' CYS . . . . . 0.445 ' SG ' ' HB2' ' A' ' 26' ' ' CYS . 39.6 t . . . . . 0 N--CA 1.492 1.642 0 CA-C-O 121.199 0.523 . . . . 0.0 110.124 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 10.8 m120 -83.56 115.15 21.98 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.308 -0.87 . . . . 0.0 110.136 179.96 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -58.03 -21.74 46.57 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.267 -0.896 . . . . 0.0 110.147 179.96 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 5' ' ' ARG . . . . . 0.451 ' O ' HD12 ' A' ' 9' ' ' LEU . 0.0 OUTLIER -78.51 -45.62 21.54 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.21 -0.931 . . . . 0.0 110.097 179.975 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 21.0 m-20 -79.03 -18.41 53.6 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.244 -0.91 . . . . 0.0 109.818 179.791 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.477 ' O ' ' HB2' ' A' ' 11' ' ' CYS . 8.1 t -78.37 -54.08 6.58 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.345 -0.847 . . . . 0.0 109.947 179.801 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 8' ' ' SER . . . . . 0.44 ' O ' HG13 ' A' ' 12' ' ' ILE . 0.3 OUTLIER -64.58 -42.03 95.88 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.288 -0.882 . . . . 0.0 110.133 179.932 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.451 HD12 ' O ' ' A' ' 5' ' ' ARG . 0.3 OUTLIER -54.05 -51.85 62.73 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.146 -0.971 . . . . 0.0 110.231 -179.997 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 2.4 t0 -69.36 -38.77 78.24 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.278 -0.889 . . . . 0.0 110.417 -179.923 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.477 ' HB2' ' O ' ' A' ' 7' ' ' CYS . 0.1 OUTLIER -66.58 -39.79 88.62 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.159 -0.963 . . . . 0.0 110.132 -179.957 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 12' ' ' ILE . . . . . 0.44 HG13 ' O ' ' A' ' 8' ' ' SER . 15.5 mt -63.63 -38.72 83.0 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.563 0 O-C-N 121.278 -0.889 . . . . 0.0 109.833 179.87 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 2.6 mmm -69.87 -28.87 66.01 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.271 -0.893 . . . . 0.0 109.999 179.715 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -67.15 -32.06 72.91 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.255 -0.903 . . . . 0.0 110.205 179.836 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 138.25 -7.51 3.44 Favored Glycine 0 N--CA 1.491 2.313 0 N-CA-C 109.581 -1.408 . . . . 0.0 109.581 -179.823 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 97.2 m-85 -80.09 -163.73 0.59 Allowed 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.135 -1.215 . . . . 0.0 110.242 179.914 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' ASN . . . . . 0.589 ' HB3' ' CD2' ' A' ' 18' ' ' PHE . 0.7 OUTLIER -133.11 -63.31 0.77 Allowed 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.297 -0.877 . . . . 0.0 110.203 179.871 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 18' ' ' PHE . . . . . 0.596 ' CE1' ' HB2' ' A' ' 29' ' ' ARG . 5.4 p90 -133.89 145.75 49.92 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.12 -0.988 . . . . 0.0 110.38 179.78 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 19' ' ' GLY . . . . . 0.471 ' CA ' ' HA ' ' A' ' 28' ' ' CYS . . . -140.29 -150.51 5.47 Favored Glycine 0 N--CA 1.489 2.219 0 N-CA-C 109.529 -1.428 . . . . 0.0 109.529 -179.973 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 4.1 tttm -173.61 152.97 2.18 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.179 -1.189 . . . . 0.0 110.265 179.932 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' CYS . . . . . 0.433 ' SG ' ' SG ' ' A' ' 26' ' ' CYS . 22.1 m -91.31 144.27 25.78 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.346 -0.846 . . . . 0.0 110.315 179.969 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.419 ' O ' ' HB2' ' A' ' 23' ' ' ARG . 39.2 t -139.25 115.73 9.92 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.67 0 O-C-N 121.323 -0.86 . . . . 0.0 110.159 179.919 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 23' ' ' ARG . . . . . 0.419 ' HB2' ' O ' ' A' ' 22' ' ' VAL . 0.1 OUTLIER 56.31 -92.85 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.344 -0.848 . . . . 0.0 110.3 179.939 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -131.65 23.62 4.21 Favored Glycine 0 N--CA 1.49 2.238 0 N-CA-C 109.456 -1.457 . . . . 0.0 109.456 -179.955 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 4.0 t -142.34 172.47 12.65 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.226 -1.161 . . . . 0.0 109.931 179.872 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' CYS . . . . . 0.445 ' HB2' ' SG ' ' A' ' 2' ' ' CYS . 1.0 OUTLIER -138.46 145.37 40.8 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.084 -1.01 . . . . 0.0 110.837 -179.749 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 27' ' ' GLN . . . . . 0.464 ' O ' ' HA3' ' A' ' 19' ' ' GLY . 14.1 mm-40 -119.97 170.18 9.5 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.34 -0.85 . . . . 0.0 109.791 179.572 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 28' ' ' CYS . . . . . 0.471 ' HA ' ' CA ' ' A' ' 19' ' ' GLY . 96.6 m -150.4 157.93 43.59 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.076 -1.015 . . . . 0.0 110.452 -179.949 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.596 ' HB2' ' CE1' ' A' ' 18' ' ' PHE . 9.7 mtp180 -128.96 159.59 35.38 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.207 -0.933 . . . . 0.0 110.395 179.967 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.583 0 O-C-N 121.205 -0.935 . . . . 0.0 110.143 179.866 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 2' ' ' CYS . . . . . 0.439 ' O ' ' CB ' ' A' ' 3' ' ' ASN . 16.4 p . . . . . 0 N--CA 1.491 1.576 0 CA-C-O 121.233 0.539 . . . . 0.0 110.025 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 3' ' ' ASN . . . . . 0.439 ' CB ' ' O ' ' A' ' 2' ' ' CYS . 1.0 OUTLIER 66.16 84.78 0.15 Allowed 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.272 -0.893 . . . . 0.0 109.872 -179.829 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -53.02 -40.42 63.86 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.314 -0.866 . . . . 0.0 110.372 -179.792 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 5' ' ' ARG . . . . . 0.84 ' O ' HD12 ' A' ' 9' ' ' LEU . 8.0 ptm180 -62.35 -36.35 81.95 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.172 -0.955 . . . . 0.0 110.093 -179.916 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 22.7 t0 -81.16 -12.75 59.13 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.232 -0.917 . . . . 0.0 109.915 179.717 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.416 ' O ' ' SG ' ' A' ' 11' ' ' CYS . 0.8 OUTLIER -82.44 -39.76 22.14 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.324 -0.86 . . . . 0.0 110.095 179.923 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 8' ' ' SER . . . . . 0.503 ' O ' HD12 ' A' ' 12' ' ' ILE . 2.2 t -84.52 -35.15 23.09 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.312 -0.867 . . . . 0.0 110.001 179.918 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.84 HD12 ' O ' ' A' ' 5' ' ' ARG . 5.6 mt -65.01 -46.91 79.41 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.353 -0.842 . . . . 0.0 109.992 179.808 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -64.16 -39.78 94.72 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.166 -0.959 . . . . 0.0 110.062 179.767 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.416 ' SG ' ' O ' ' A' ' 7' ' ' CYS . 82.5 m -67.37 -41.28 85.33 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.282 -0.886 . . . . 0.0 110.21 179.807 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 12' ' ' ILE . . . . . 0.503 HD12 ' O ' ' A' ' 8' ' ' SER . 53.6 mt -66.81 -44.0 89.4 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.603 0 O-C-N 121.297 -0.877 . . . . 0.0 110.258 179.981 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -69.1 -20.24 64.07 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.14 -0.975 . . . . 0.0 110.096 -179.962 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.61 -21.48 60.31 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.266 -0.896 . . . . 0.0 110.253 -179.961 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 124.32 -1.0 8.9 Favored Glycine 0 N--CA 1.491 2.328 0 N-CA-C 109.749 -1.341 . . . . 0.0 109.749 179.823 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 16' ' ' TYR . . . . . 0.445 ' N ' ' CD1' ' A' ' 16' ' ' TYR . 30.4 m-85 -89.09 -158.69 0.52 Allowed 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.138 -1.213 . . . . 0.0 110.236 -179.998 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 17' ' ' ASN . . . . . 0.577 ' HB3' ' CD2' ' A' ' 18' ' ' PHE . 5.3 t30 -120.1 -40.7 2.69 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.146 -0.971 . . . . 0.0 110.239 179.978 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 18' ' ' PHE . . . . . 0.577 ' CD2' ' HB3' ' A' ' 17' ' ' ASN . 12.3 p90 -157.1 158.01 35.6 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.127 -0.983 . . . . 0.0 110.404 179.874 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 19' ' ' GLY . . . . . 0.44 ' O ' ' HB3' ' A' ' 20' ' ' LYS . . . -138.88 -165.12 10.15 Favored Glycine 0 N--CA 1.492 2.37 0 N-CA-C 109.427 -1.469 . . . . 0.0 109.427 179.993 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.44 ' HB3' ' O ' ' A' ' 19' ' ' GLY . 0.0 OUTLIER -176.75 163.04 2.25 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.264 -1.139 . . . . 0.0 110.207 179.965 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 21' ' ' CYS . . . . . 0.591 ' O ' HG23 ' A' ' 22' ' ' VAL . 2.8 t -92.03 155.7 17.92 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.331 -0.856 . . . . 0.0 110.375 -179.93 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.591 HG23 ' O ' ' A' ' 21' ' ' CYS . 73.0 t -157.48 103.63 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.567 0 O-C-N 121.319 -0.863 . . . . 0.0 110.027 179.785 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 23' ' ' ARG . . . . . 0.442 ' HB2' ' O ' ' A' ' 22' ' ' VAL . 0.0 OUTLIER 57.87 66.15 1.18 Allowed 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.219 -0.926 . . . . 0.0 110.122 -179.854 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 50.48 44.59 45.93 Favored Glycine 0 N--CA 1.491 2.344 0 N-CA-C 109.499 -1.44 . . . . 0.0 109.499 -179.975 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 25' ' ' SER . . . . . 0.405 ' O ' ' SG ' ' A' ' 21' ' ' CYS . 0.2 OUTLIER -142.26 164.91 28.86 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.203 -1.175 . . . . 0.0 110.209 179.988 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -134.93 111.21 9.65 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.242 -0.911 . . . . 0.0 110.09 179.938 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 10.6 mm-40 -117.77 168.06 10.81 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.368 -0.833 . . . . 0.0 110.273 -179.793 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 23.3 m -124.44 142.71 51.1 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.301 -0.875 . . . . 0.0 110.05 179.84 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.481 ' HB2' ' CE1' ' A' ' 18' ' ' PHE . 3.8 mmp_? -129.72 136.43 49.66 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.194 -0.942 . . . . 0.0 110.25 -179.933 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 10.4 mtp85 . . . . . 0 N--CA 1.492 1.649 0 O-C-N 121.242 -0.911 . . . . 0.0 110.226 -179.941 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 2' ' ' CYS . . . . . 0.415 ' C ' ' SG ' ' A' ' 21' ' ' CYS . 7.2 t . . . . . 0 N--CA 1.492 1.652 0 CA-C-O 121.317 0.58 . . . . 0.0 110.115 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 3' ' ' ASN . . . . . 0.489 ' O ' ' HB3' ' A' ' 7' ' ' CYS . 0.8 OUTLIER -126.44 129.61 49.05 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.387 -0.821 . . . . 0.0 110.036 -179.971 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 10.4 m-20 -54.64 -41.9 70.63 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.275 -0.89 . . . . 0.0 110.675 -179.749 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 5' ' ' ARG . . . . . 0.726 ' O ' HD12 ' A' ' 9' ' ' LEU . 3.0 ttt180 -81.88 -35.34 29.35 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.13 -0.981 . . . . 0.0 110.264 -179.808 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 6' ' ' ASP . . . . . 0.449 ' O ' ' HB2' ' A' ' 10' ' ' ASP . 3.0 t70 -79.4 -25.66 42.08 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.357 -0.839 . . . . 0.0 110.167 -179.943 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.489 ' HB3' ' O ' ' A' ' 3' ' ' ASN . 17.0 t -87.25 -42.11 13.19 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.316 -0.865 . . . . 0.0 110.067 179.937 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 8' ' ' SER . . . . . 0.475 ' O ' ' HB ' ' A' ' 12' ' ' ILE . 84.6 p -67.92 -46.49 71.4 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.366 -0.834 . . . . 0.0 110.285 -179.854 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.726 HD12 ' O ' ' A' ' 5' ' ' ARG . 3.0 mt -65.27 -38.3 89.87 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.181 -0.949 . . . . 0.0 110.414 -179.883 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 10' ' ' ASP . . . . . 0.449 ' HB2' ' O ' ' A' ' 6' ' ' ASP . 26.1 m-20 -74.11 -48.82 27.0 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.213 -0.929 . . . . 0.0 110.502 -179.844 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.496 ' SG ' ' CB ' ' A' ' 16' ' ' TYR . 53.0 t -68.71 -39.18 80.57 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.185 -0.947 . . . . 0.0 110.631 -179.764 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 12' ' ' ILE . . . . . 0.475 ' HB ' ' O ' ' A' ' 8' ' ' SER . 46.8 mt -63.48 -39.3 84.8 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.553 0 O-C-N 121.095 -1.003 . . . . 0.0 110.152 179.942 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 13' ' ' MET . . . . . 0.438 ' HB2' ' O ' ' A' ' 9' ' ' LEU . 5.4 ttm -77.85 -19.07 55.51 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.243 -0.91 . . . . 0.0 109.981 179.759 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.11 -24.47 61.49 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.299 -0.876 . . . . 0.0 110.128 179.849 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 132.49 -2.93 5.03 Favored Glycine 0 N--CA 1.49 2.239 0 N-CA-C 109.559 -1.416 . . . . 0.0 109.559 -179.969 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' TYR . . . . . 0.587 ' CD1' ' HB3' ' A' ' 28' ' ' CYS . 82.2 m-85 -82.22 -172.24 3.87 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.287 -1.126 . . . . 0.0 110.183 -179.956 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 17' ' ' ASN . . . . . 0.52 ' C ' ' CD1' ' A' ' 18' ' ' PHE . 1.8 t-20 -127.18 -32.13 2.52 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.244 -0.91 . . . . 0.0 110.269 -179.935 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 18' ' ' PHE . . . . . 0.52 ' CD1' ' C ' ' A' ' 17' ' ' ASN . 2.9 m-85 -123.84 169.47 11.54 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.123 -0.986 . . . . 0.0 110.37 -179.912 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -156.67 129.12 2.34 Favored Glycine 0 N--CA 1.491 2.341 0 N-CA-C 109.439 -1.464 . . . . 0.0 109.439 179.853 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.446 ' O ' ' SG ' ' A' ' 26' ' ' CYS . 32.8 tttp -144.5 140.91 29.17 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.131 -1.217 . . . . 0.0 110.367 -179.843 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 21' ' ' CYS . . . . . 0.461 ' HA ' ' HA ' ' A' ' 26' ' ' CYS . 0.0 OUTLIER -97.58 131.62 44.0 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.185 -0.947 . . . . 0.0 110.206 -179.993 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.478 ' N ' ' O ' ' A' ' 25' ' ' SER . 54.2 t -151.23 127.83 2.01 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.615 0 O-C-N 121.149 -0.969 . . . . 0.0 110.471 179.998 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 23' ' ' ARG . . . . . 0.443 ' CB ' ' O ' ' A' ' 22' ' ' VAL . 14.9 ttp180 64.56 57.51 1.11 Allowed 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.32 -0.863 . . . . 0.0 110.314 179.829 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 50.24 22.19 4.81 Favored Glycine 0 N--CA 1.49 2.285 0 N-CA-C 109.5 -1.44 . . . . 0.0 109.5 -179.973 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 25' ' ' SER . . . . . 0.478 ' O ' ' N ' ' A' ' 22' ' ' VAL . 41.3 m -142.2 177.94 7.89 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.348 -1.089 . . . . 0.0 109.915 -179.986 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 26' ' ' CYS . . . . . 0.461 ' HA ' ' HA ' ' A' ' 21' ' ' CYS . 0.7 OUTLIER -136.8 143.13 43.02 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.145 -0.972 . . . . 0.0 110.392 179.998 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 2.4 mt-30 -115.19 156.3 25.59 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.309 -0.869 . . . . 0.0 109.971 179.821 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 28' ' ' CYS . . . . . 0.587 ' HB3' ' CD1' ' A' ' 16' ' ' TYR . 32.1 m -125.37 171.27 10.57 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.258 -0.901 . . . . 0.0 110.314 -179.861 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -143.19 139.66 30.4 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.376 -0.828 . . . . 0.0 110.033 179.891 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.489 1.518 0 O-C-N 121.218 -0.926 . . . . 0.0 110.252 -179.998 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 2' ' ' CYS . . . . . 0.464 ' O ' ' O ' ' A' ' 3' ' ' ASN . 16.7 p . . . . . 0 N--CA 1.491 1.575 0 CA-C-O 121.263 0.554 . . . . 0.0 110.301 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 3' ' ' ASN . . . . . 0.503 ' O ' ' HB2' ' A' ' 7' ' ' CYS . 2.1 m-20 58.89 124.53 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.289 -0.882 . . . . 0.0 110.54 179.683 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 4' ' ' ASP . . . . . 0.495 ' HA ' ' HB3' ' A' ' 7' ' ' CYS . 23.7 m-20 -80.14 -24.82 40.19 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.159 -0.963 . . . . 0.0 110.227 179.811 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 5.3 ttt180 -63.81 -60.77 2.86 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.329 -0.857 . . . . 0.0 110.471 -179.831 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 5.6 t70 -79.65 6.31 10.99 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.232 -0.918 . . . . 0.0 110.155 -179.943 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.503 ' HB2' ' O ' ' A' ' 3' ' ' ASN . 4.9 t -99.58 -36.05 9.65 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.347 -0.846 . . . . 0.0 110.073 179.89 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -93.26 -29.3 15.75 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.314 -0.866 . . . . 0.0 110.22 179.923 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 2.7 mt -55.27 -55.65 29.04 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.31 -0.869 . . . . 0.0 110.332 -179.937 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 3.1 t0 -65.62 -35.97 82.37 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.156 -0.965 . . . . 0.0 110.369 -179.877 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -66.67 -49.47 66.07 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.255 -0.903 . . . . 0.0 110.2 179.997 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 61.2 mt -63.65 -24.1 35.0 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.637 0 O-C-N 121.328 -0.858 . . . . 0.0 109.894 179.855 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 2.7 mtt -79.66 -26.55 41.0 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.314 -0.866 . . . . 0.0 110.003 179.801 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.21 -25.79 60.9 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.274 -0.891 . . . . 0.0 110.102 179.907 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 134.51 -9.04 4.65 Favored Glycine 0 N--CA 1.491 2.331 0 N-CA-C 109.62 -1.392 . . . . 0.0 109.62 179.986 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 23.1 m-85 -68.02 -158.45 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.159 -1.201 . . . . 0.0 110.165 -179.98 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 17' ' ' ASN . . . . . 0.59 ' HB3' ' CD2' ' A' ' 18' ' ' PHE . 0.1 OUTLIER -135.71 -53.1 0.76 Allowed 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.343 -0.848 . . . . 0.0 110.118 179.953 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 18' ' ' PHE . . . . . 0.592 ' CE1' ' HB2' ' A' ' 29' ' ' ARG . 6.1 p90 -152.93 157.61 40.88 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.226 -0.921 . . . . 0.0 110.37 179.799 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 19' ' ' GLY . . . . . 0.432 ' HA3' ' HA ' ' A' ' 28' ' ' CYS . . . -154.05 -160.5 9.83 Favored Glycine 0 N--CA 1.49 2.24 0 N-CA-C 109.474 -1.45 . . . . 0.0 109.474 179.883 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -172.75 176.02 3.25 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.097 -1.237 . . . . 0.0 110.335 179.981 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 21' ' ' CYS . . . . . 0.448 ' SG ' ' O ' ' A' ' 25' ' ' SER . 8.4 t -83.99 132.9 34.71 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.29 -0.881 . . . . 0.0 110.317 179.943 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.443 ' O ' ' HB2' ' A' ' 25' ' ' SER . 71.0 t -118.27 92.13 2.04 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.675 0 O-C-N 121.293 -0.879 . . . . 0.0 110.254 -179.947 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 23' ' ' ARG . . . . . 0.458 ' O ' ' OG ' ' A' ' 25' ' ' SER . 4.7 tmm_? 50.81 84.15 0.04 OUTLIER 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.311 -0.868 . . . . 0.0 110.363 179.909 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 51.62 22.71 8.58 Favored Glycine 0 N--CA 1.49 2.24 0 N-CA-C 109.69 -1.364 . . . . 0.0 109.69 179.964 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 25' ' ' SER . . . . . 0.458 ' OG ' ' O ' ' A' ' 23' ' ' ARG . 1.1 m -135.78 -161.66 1.18 Allowed 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.333 -1.098 . . . . 0.0 109.718 179.794 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -167.03 124.62 1.26 Allowed 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.231 -0.918 . . . . 0.0 110.677 179.937 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 27' ' ' GLN . . . . . 0.446 ' O ' ' SG ' ' A' ' 28' ' ' CYS . 33.8 mm-40 -119.06 -179.86 3.95 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.427 -0.796 . . . . 0.0 109.694 179.639 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 28' ' ' CYS . . . . . 0.446 ' SG ' ' O ' ' A' ' 27' ' ' GLN . 84.3 m -149.49 157.9 43.7 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.114 -0.991 . . . . 0.0 109.914 179.921 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.592 ' HB2' ' CE1' ' A' ' 18' ' ' PHE . 6.2 mmm180 -134.31 156.52 48.32 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.105 -0.997 . . . . 0.0 110.483 -179.642 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.601 0 O-C-N 121.292 -0.88 . . . . 0.0 110.122 179.92 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 2' ' ' CYS . . . . . 0.425 ' O ' ' CB ' ' A' ' 3' ' ' ASN . 20.6 p . . . . . 0 N--CA 1.492 1.639 0 CA-C-O 121.24 0.543 . . . . 0.0 110.269 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 3' ' ' ASN . . . . . 0.467 ' O ' ' N ' ' A' ' 7' ' ' CYS . 0.8 OUTLIER 173.66 137.76 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.195 -0.941 . . . . 0.0 110.251 -179.969 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 4' ' ' ASP . . . . . 0.4 ' O ' ' HB3' ' A' ' 8' ' ' SER . 0.7 OUTLIER -53.36 -34.96 59.67 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.122 -0.986 . . . . 0.0 110.203 -179.989 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 5' ' ' ARG . . . . . 0.806 ' O ' HD12 ' A' ' 9' ' ' LEU . 0.1 OUTLIER -78.4 -39.69 38.22 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.279 -0.888 . . . . 0.0 110.415 -179.946 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 4.3 t0 -84.8 -19.02 33.18 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.301 -0.875 . . . . 0.0 110.287 -179.889 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.467 ' N ' ' O ' ' A' ' 3' ' ' ASN . 10.1 t -87.64 -27.9 22.2 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.235 -0.916 . . . . 0.0 110.113 179.977 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 8' ' ' SER . . . . . 0.4 ' HB3' ' O ' ' A' ' 4' ' ' ASP . 6.0 t -92.41 -33.04 14.7 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.285 -0.884 . . . . 0.0 110.337 -179.882 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.806 HD12 ' O ' ' A' ' 5' ' ' ARG . 0.8 OUTLIER -57.02 -55.9 28.75 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.173 -0.954 . . . . 0.0 110.284 -179.792 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -67.09 -38.22 85.32 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.15 -0.969 . . . . 0.0 110.179 -179.949 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.418 ' SG ' ' O ' ' A' ' 7' ' ' CYS . 55.0 m -68.11 -44.74 75.47 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.285 -0.885 . . . . 0.0 110.185 -179.975 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 19.8 mt -63.56 -41.13 91.57 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.589 0 O-C-N 121.187 -0.945 . . . . 0.0 109.997 179.882 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -69.08 -34.77 75.65 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.27 -0.894 . . . . 0.0 110.024 179.83 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -65.85 -57.12 8.66 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.294 -0.879 . . . . 0.0 109.945 179.832 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 159.91 36.65 0.02 OUTLIER Glycine 0 N--CA 1.491 2.352 0 N-CA-C 109.663 -1.375 . . . . 0.0 109.663 -179.991 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 16' ' ' TYR . . . . . 0.462 ' CD2' ' HG2' ' A' ' 30' ' ' ARG . 36.8 m-85 -113.09 -173.43 2.25 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.154 -1.203 . . . . 0.0 110.19 -179.996 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 17' ' ' ASN . . . . . 0.537 ' CG ' ' CE2' ' A' ' 18' ' ' PHE . 7.8 p30 -121.81 -34.92 3.29 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.312 -0.867 . . . . 0.0 109.942 179.662 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 18' ' ' PHE . . . . . 0.594 ' CE1' ' HB2' ' A' ' 29' ' ' ARG . 3.3 p90 -164.77 154.25 13.3 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.327 -0.858 . . . . 0.0 110.051 179.804 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 19' ' ' GLY . . . . . 0.443 ' O ' ' HB3' ' A' ' 20' ' ' LYS . . . -155.04 -162.77 11.49 Favored Glycine 0 N--CA 1.491 2.301 0 N-CA-C 109.391 -1.484 . . . . 0.0 109.391 179.997 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.443 ' HB3' ' O ' ' A' ' 19' ' ' GLY . 0.0 OUTLIER 178.45 165.7 0.8 Allowed 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.214 -1.168 . . . . 0.0 110.19 179.974 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 21' ' ' CYS . . . . . 0.488 ' HA ' ' O ' ' A' ' 25' ' ' SER . 39.3 t -83.0 145.67 29.19 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.2 -0.937 . . . . 0.0 109.968 179.839 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.431 ' O ' ' C ' ' A' ' 23' ' ' ARG . 92.5 t -138.47 126.46 29.08 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.597 0 O-C-N 121.197 -0.939 . . . . 0.0 110.393 -179.915 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 23' ' ' ARG . . . . . 0.431 ' C ' ' O ' ' A' ' 22' ' ' VAL . 3.0 ttp180 42.15 39.74 1.48 Allowed 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.259 -0.9 . . . . 0.0 110.149 -179.989 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 79.91 31.55 39.18 Favored Glycine 0 N--CA 1.49 2.281 0 N-CA-C 109.318 -1.513 . . . . 0.0 109.318 -179.879 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 25' ' ' SER . . . . . 0.488 ' O ' ' HA ' ' A' ' 21' ' ' CYS . 44.2 m -128.63 -164.19 1.36 Allowed 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.281 -1.129 . . . . 0.0 110.025 179.967 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 7.3 t -153.11 97.33 2.17 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.274 -0.891 . . . . 0.0 109.979 179.951 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 27' ' ' GLN . . . . . 0.431 ' O ' ' SG ' ' A' ' 28' ' ' CYS . 14.5 mm-40 -106.67 164.26 12.23 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.294 -0.879 . . . . 0.0 110.522 -179.792 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 28' ' ' CYS . . . . . 0.431 ' SG ' ' O ' ' A' ' 27' ' ' GLN . 81.0 m -149.5 161.58 41.83 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.357 -0.84 . . . . 0.0 109.843 179.891 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.594 ' HB2' ' CE1' ' A' ' 18' ' ' PHE . 14.2 mmm180 -123.28 164.35 18.95 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.156 -0.965 . . . . 0.0 110.328 -179.888 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.472 ' C ' ' ND2' ' A' ' 17' ' ' ASN . 59.4 mtp180 . . . . . 0 N--CA 1.492 1.631 0 O-C-N 121.241 -0.912 . . . . 0.0 110.065 179.855 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 2' ' ' CYS . . . . . 0.417 ' O ' ' C ' ' A' ' 3' ' ' ASN . 21.4 p . . . . . 0 N--CA 1.491 1.575 0 CA-C-O 121.195 0.521 . . . . 0.0 110.296 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 3' ' ' ASN . . . . . 0.46 ' O ' ' HB2' ' A' ' 7' ' ' CYS . 3.3 m-20 -42.93 149.66 0.19 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.221 -0.924 . . . . 0.0 110.19 -179.927 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 19.7 m-20 -68.55 -33.19 73.67 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.233 -0.917 . . . . 0.0 110.246 179.983 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 5' ' ' ARG . . . . . 0.599 ' O ' HD12 ' A' ' 9' ' ' LEU . 2.1 mtp180 -72.22 -41.57 66.74 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.245 -0.909 . . . . 0.0 110.177 179.97 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -79.92 3.16 20.77 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.239 -0.913 . . . . 0.0 110.196 179.879 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.46 ' HB2' ' O ' ' A' ' 3' ' ' ASN . 7.0 t -107.97 -30.46 8.45 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.182 -0.949 . . . . 0.0 110.227 -179.923 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -93.46 -43.33 8.79 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.216 -0.928 . . . . 0.0 110.186 -179.839 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.599 HD12 ' O ' ' A' ' 5' ' ' ARG . 47.3 mt -56.37 -49.61 73.92 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.214 -0.929 . . . . 0.0 110.298 -179.787 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 56.8 t0 -64.43 -45.94 85.35 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.261 -0.899 . . . . 0.0 110.289 -179.838 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.442 ' HA ' ' HG3' ' A' ' 14' ' ' LYS . 0.5 OUTLIER -66.21 -32.98 74.73 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.315 -0.866 . . . . 0.0 110.184 -179.896 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 24.2 mt -63.41 -39.36 85.02 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.547 0 O-C-N 121.19 -0.944 . . . . 0.0 109.373 179.616 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 4.6 ttm -71.18 -27.62 63.65 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.364 -0.835 . . . . 0.0 109.397 179.274 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' LYS . . . . . 0.442 ' HG3' ' HA ' ' A' ' 11' ' ' CYS . 2.7 mmpt? -63.47 -35.6 80.98 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.411 -0.806 . . . . 0.0 110.094 179.61 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 133.27 2.02 3.81 Favored Glycine 0 N--CA 1.491 2.34 0 N-CA-C 110.141 -1.184 . . . . 0.0 110.141 179.875 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 16' ' ' TYR . . . . . 0.51 ' HA ' ' CG ' ' A' ' 30' ' ' ARG . 17.8 m-85 -85.86 -167.58 1.91 Allowed 'General case' 0 N--CA 1.49 1.563 0 O-C-N 120.915 -1.344 . . . . 0.0 110.145 179.919 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 17' ' ' ASN . . . . . 0.58 ' HB3' ' CD2' ' A' ' 18' ' ' PHE . 0.7 OUTLIER -112.78 -62.52 1.57 Allowed 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.331 -0.856 . . . . 0.0 109.944 179.713 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 18' ' ' PHE . . . . . 0.58 ' CD2' ' HB3' ' A' ' 17' ' ' ASN . 7.5 p90 -143.71 151.66 40.32 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.274 -0.892 . . . . 0.0 110.142 179.597 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 19' ' ' GLY . . . . . 0.509 ' CA ' ' HA ' ' A' ' 28' ' ' CYS . . . -149.52 -164.6 11.79 Favored Glycine 0 N--CA 1.49 2.26 0 N-CA-C 109.501 -1.44 . . . . 0.0 109.501 -179.994 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.4 ' HB3' ' O ' ' A' ' 19' ' ' GLY . 0.0 OUTLIER -178.42 178.56 0.85 Allowed 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.226 -1.161 . . . . 0.0 110.111 179.972 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 21' ' ' CYS . . . . . 0.471 ' HA ' ' O ' ' A' ' 25' ' ' SER . 50.8 t -83.41 152.94 24.77 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.206 -0.934 . . . . 0.0 110.111 179.99 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.538 ' CG2' ' HB2' ' A' ' 27' ' ' GLN . 46.8 t -127.6 69.85 0.38 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.593 0 O-C-N 121.235 -0.916 . . . . 0.0 110.396 -179.994 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 23' ' ' ARG . . . . . 0.429 ' CB ' ' O ' ' A' ' 22' ' ' VAL . 0.4 OUTLIER 66.13 50.14 1.44 Allowed 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.275 -0.89 . . . . 0.0 110.368 179.849 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 94.53 16.95 40.83 Favored Glycine 0 N--CA 1.491 2.301 0 N-CA-C 109.674 -1.37 . . . . 0.0 109.674 179.857 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 25' ' ' SER . . . . . 0.471 ' O ' ' HA ' ' A' ' 21' ' ' CYS . 0.6 OUTLIER -133.49 -166.32 1.76 Allowed 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.1 -1.235 . . . . 0.0 110.154 179.922 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 0.3 OUTLIER -148.36 105.49 3.62 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.154 -0.966 . . . . 0.0 110.27 -179.973 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 27' ' ' GLN . . . . . 0.538 ' HB2' ' CG2' ' A' ' 22' ' ' VAL . 3.2 mm100 -105.89 179.34 4.3 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.17 -0.956 . . . . 0.0 110.277 179.927 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 28' ' ' CYS . . . . . 0.509 ' HA ' ' CA ' ' A' ' 19' ' ' GLY . 66.4 m -151.9 164.76 36.44 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.348 -0.845 . . . . 0.0 109.929 179.817 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.502 ' HB2' ' CE1' ' A' ' 18' ' ' PHE . 0.0 OUTLIER -142.97 133.04 24.32 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.055 -1.028 . . . . 0.0 110.47 179.975 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.51 ' CG ' ' HA ' ' A' ' 16' ' ' TYR . 9.4 mtm180 . . . . . 0 N--CA 1.49 1.547 0 O-C-N 121.357 -0.839 . . . . 0.0 110.253 179.988 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 2' ' ' CYS . . . . . 0.435 ' O ' ' SG ' ' A' ' 2' ' ' CYS . 32.0 p . . . . . 0 N--CA 1.491 1.588 0 CA-C-O 121.226 0.536 . . . . 0.0 110.246 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 3' ' ' ASN . . . . . 0.44 ' O ' ' SG ' ' A' ' 7' ' ' CYS . 0.1 OUTLIER -88.11 146.01 25.65 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.242 -0.911 . . . . 0.0 110.161 -179.982 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 2.4 p30 -69.07 -41.52 77.44 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.279 -0.888 . . . . 0.0 110.369 -179.988 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.81 -33.8 66.44 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.079 -1.013 . . . . 0.0 110.184 179.978 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 14.7 t0 -78.54 -11.03 59.94 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.259 -0.901 . . . . 0.0 109.743 179.894 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.44 ' SG ' ' O ' ' A' ' 3' ' ' ASN . 19.3 m -93.5 -42.34 9.29 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.347 -0.846 . . . . 0.0 109.606 179.418 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 8' ' ' SER . . . . . 0.616 ' O ' HD12 ' A' ' 12' ' ' ILE . 6.7 p -67.21 -37.52 83.77 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.346 -0.846 . . . . 0.0 109.912 179.669 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.479 ' O ' ' HB2' ' A' ' 13' ' ' MET . 18.5 mt -66.38 -25.71 66.91 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.296 -0.877 . . . . 0.0 110.235 179.854 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -75.27 -47.01 29.99 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.296 -0.878 . . . . 0.0 110.392 -179.775 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.464 ' O ' ' HB2' ' A' ' 16' ' ' TYR . 30.7 m -67.06 -44.22 80.7 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.286 -0.884 . . . . 0.0 110.472 -179.668 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 12' ' ' ILE . . . . . 0.616 HD12 ' O ' ' A' ' 8' ' ' SER . 31.8 mt -63.36 -38.61 82.61 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.654 0 O-C-N 121.188 -0.945 . . . . 0.0 110.457 -179.721 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 13' ' ' MET . . . . . 0.479 ' HB2' ' O ' ' A' ' 9' ' ' LEU . 1.9 tpp -65.31 -46.64 79.55 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.223 -0.923 . . . . 0.0 110.246 179.956 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 6.4 mtpt -63.01 -31.43 72.56 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.209 -0.932 . . . . 0.0 110.328 -179.889 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 139.67 -7.48 3.03 Favored Glycine 0 N--CA 1.49 2.254 0 N-CA-C 109.804 -1.318 . . . . 0.0 109.804 179.963 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 16' ' ' TYR . . . . . 0.464 ' HB2' ' O ' ' A' ' 11' ' ' CYS . 99.1 m-85 -76.73 -171.42 1.89 Allowed 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.209 -1.171 . . . . 0.0 110.092 179.999 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 17' ' ' ASN . . . . . 0.448 ' HB3' ' CD2' ' A' ' 18' ' ' PHE . 0.1 OUTLIER -118.24 -42.56 2.78 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.082 -1.012 . . . . 0.0 110.521 -179.749 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 18' ' ' PHE . . . . . 0.448 ' CD2' ' HB3' ' A' ' 17' ' ' ASN . 2.9 p90 -159.81 158.53 31.23 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.091 -1.006 . . . . 0.0 110.549 -179.885 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 19' ' ' GLY . . . . . 0.479 ' HA3' ' O ' ' A' ' 27' ' ' GLN . . . -144.47 -148.66 4.9 Favored Glycine 0 N--CA 1.491 2.339 0 N-CA-C 109.42 -1.472 . . . . 0.0 109.42 179.948 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.486 ' O ' ' HA ' ' A' ' 26' ' ' CYS . 0.3 OUTLIER -176.12 168.93 2.87 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.231 -1.158 . . . . 0.0 110.253 179.97 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 21' ' ' CYS . . . . . 0.446 ' SG ' ' SG ' ' A' ' 26' ' ' CYS . 1.2 m -87.62 142.19 28.04 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.351 -0.843 . . . . 0.0 110.166 -179.92 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 22.1 t -131.98 76.57 0.48 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.7 0 O-C-N 121.35 -0.843 . . . . 0.0 110.145 179.897 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 2.3 mtm-85 60.26 77.22 0.33 Allowed 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.335 -0.853 . . . . 0.0 110.243 179.98 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 62.8 11.81 38.62 Favored Glycine 0 N--CA 1.49 2.278 0 N-CA-C 109.578 -1.409 . . . . 0.0 109.578 179.979 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 25' ' ' SER . . . . . 0.42 ' O ' ' HA ' ' A' ' 21' ' ' CYS . 0.1 OUTLIER -130.33 176.34 8.21 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.221 -1.164 . . . . 0.0 109.926 179.877 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 26' ' ' CYS . . . . . 0.486 ' HA ' ' O ' ' A' ' 20' ' ' LYS . 0.5 OUTLIER -154.08 132.26 11.84 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.172 -0.955 . . . . 0.0 110.204 -179.972 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 27' ' ' GLN . . . . . 0.479 ' O ' ' HA3' ' A' ' 19' ' ' GLY . 2.5 mm100 -120.13 174.81 6.26 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.289 -0.882 . . . . 0.0 110.409 -179.885 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 28' ' ' CYS . . . . . 0.445 ' HB3' ' HB3' ' A' ' 11' ' ' CYS . 56.5 m -126.96 144.31 51.04 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.367 -0.833 . . . . 0.0 110.163 179.919 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 17.1 mmt180 -122.6 148.49 45.17 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.251 -0.905 . . . . 0.0 110.258 -179.925 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.659 0 O-C-N 121.323 -0.861 . . . . 0.0 110.222 179.996 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 17.9 p . . . . . 0 N--CA 1.492 1.636 0 CA-C-O 121.291 0.567 . . . . 0.0 110.254 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 35.0 m120 -117.55 133.58 55.8 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.231 -0.918 . . . . 0.0 110.122 179.978 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 4' ' ' ASP . . . . . 0.459 ' N ' ' OD1' ' A' ' 4' ' ' ASP . 0.9 OUTLIER -61.85 -30.41 70.83 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.262 -0.899 . . . . 0.0 110.224 179.95 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.08 -29.55 64.23 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.255 -0.903 . . . . 0.0 110.089 179.904 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -79.47 -14.36 58.96 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.297 -0.877 . . . . 0.0 110.126 179.869 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -96.97 -25.15 15.49 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.291 -0.881 . . . . 0.0 109.888 179.863 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 8' ' ' SER . . . . . 0.42 ' OG ' ' O ' ' A' ' 4' ' ' ASP . 0.1 OUTLIER -82.82 -43.78 16.26 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.339 -0.85 . . . . 0.0 110.083 179.846 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -62.37 -49.61 74.86 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.267 -0.896 . . . . 0.0 110.087 179.818 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -62.47 -27.08 68.88 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.26 -0.9 . . . . 0.0 109.638 179.681 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.54 ' O ' ' N ' ' A' ' 16' ' ' TYR . 0.1 OUTLIER -66.77 -46.12 76.34 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.395 -0.816 . . . . 0.0 109.641 179.428 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 89.4 mt -75.49 -33.34 27.02 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.502 0 O-C-N 121.339 -0.85 . . . . 0.0 110.2 179.971 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 1.7 ttt -69.0 -52.92 23.78 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.121 -0.987 . . . . 0.0 110.226 -179.989 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 4.1 mttt -60.8 -30.51 70.11 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.321 -0.862 . . . . 0.0 110.344 -179.977 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 122.68 14.55 4.26 Favored Glycine 0 N--CA 1.491 2.365 0 N-CA-C 109.756 -1.337 . . . . 0.0 109.756 179.944 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 16' ' ' TYR . . . . . 0.54 ' N ' ' O ' ' A' ' 11' ' ' CYS . 48.2 m-85 -92.53 -179.98 5.34 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.246 -1.15 . . . . 0.0 110.08 179.879 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 17' ' ' ASN . . . . . 0.511 ' HB2' ' HA ' ' A' ' 30' ' ' ARG . 6.7 m120 -101.56 -52.1 3.3 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.094 -1.004 . . . . 0.0 110.486 -179.792 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 18' ' ' PHE . . . . . 0.541 ' CE2' ' HB2' ' A' ' 29' ' ' ARG . 33.2 p90 -146.91 163.19 36.92 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.103 -0.998 . . . . 0.0 110.567 -179.872 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -138.38 -170.45 11.86 Favored Glycine 0 N--CA 1.491 2.316 0 N-CA-C 109.375 -1.49 . . . . 0.0 109.375 179.944 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -170.52 164.61 8.49 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.216 -1.167 . . . . 0.0 110.2 179.916 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 21' ' ' CYS . . . . . 0.49 ' HA ' ' O ' ' A' ' 25' ' ' SER . 0.8 OUTLIER -90.99 137.72 32.15 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.219 -0.926 . . . . 0.0 110.113 179.943 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.53 ' HB ' ' CB ' ' A' ' 25' ' ' SER . 57.3 t -110.07 76.26 0.42 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.641 0 O-C-N 121.234 -0.916 . . . . 0.0 110.173 -179.98 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 13.6 mtm180 54.37 54.16 9.82 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.229 -0.92 . . . . 0.0 110.208 179.894 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 93.9 15.41 49.09 Favored Glycine 0 N--CA 1.49 2.3 0 N-CA-C 109.753 -1.339 . . . . 0.0 109.753 179.957 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 25' ' ' SER . . . . . 0.53 ' CB ' ' HB ' ' A' ' 22' ' ' VAL . 0.5 OUTLIER -127.36 -176.15 3.65 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.226 -1.161 . . . . 0.0 110.213 -179.946 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 8.1 t -143.56 114.17 7.57 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.207 -0.933 . . . . 0.0 110.175 -179.988 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 21.4 mm100 -117.45 157.6 25.94 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.269 -0.894 . . . . 0.0 110.132 179.961 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -124.32 133.23 53.52 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.325 -0.86 . . . . 0.0 110.084 -179.982 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.541 ' HB2' ' CE2' ' A' ' 18' ' ' PHE . 3.4 mtm180 -123.37 163.6 20.48 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.162 -0.961 . . . . 0.0 110.383 -179.941 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.511 ' HA ' ' HB2' ' A' ' 17' ' ' ASN . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.618 0 O-C-N 121.327 -0.858 . . . . 0.0 110.118 179.955 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 2' ' ' CYS . . . . . 0.443 ' O ' ' CB ' ' A' ' 3' ' ' ASN . 18.3 p . . . . . 0 N--CA 1.49 1.542 0 CA-C-O 121.262 0.553 . . . . 0.0 110.244 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 3' ' ' ASN . . . . . 0.455 ' O ' ' CB ' ' A' ' 7' ' ' CYS . 17.3 t-20 64.9 93.42 0.06 Allowed 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.24 -0.913 . . . . 0.0 110.158 -179.801 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 93.0 m-20 -57.35 -35.78 70.37 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.26 -0.9 . . . . 0.0 110.359 -179.908 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 5' ' ' ARG . . . . . 0.454 ' O ' ' HB2' ' A' ' 9' ' ' LEU . 1.3 ttm-85 -62.6 -57.26 11.72 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.081 -1.012 . . . . 0.0 110.161 -179.935 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -79.89 6.63 10.63 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.279 -0.888 . . . . 0.0 110.211 179.916 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.455 ' CB ' ' O ' ' A' ' 3' ' ' ASN . 39.5 t -107.22 -34.0 7.25 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.268 -0.895 . . . . 0.0 110.232 -179.946 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 8' ' ' SER . . . . . 0.454 ' O ' HG13 ' A' ' 12' ' ' ILE . 19.4 m -93.96 -42.2 9.18 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.293 -0.879 . . . . 0.0 110.434 -179.777 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.454 ' HB2' ' O ' ' A' ' 5' ' ' ARG . 0.2 OUTLIER -53.32 -49.24 67.48 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.187 -0.946 . . . . 0.0 110.362 -179.71 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -62.87 -46.73 86.49 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.152 -0.967 . . . . 0.0 110.158 179.914 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -66.64 -38.96 87.96 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.197 -0.939 . . . . 0.0 110.179 -179.885 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 12' ' ' ILE . . . . . 0.454 HG13 ' O ' ' A' ' 8' ' ' SER . 14.2 mt -64.65 -33.58 64.13 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.611 0 O-C-N 121.232 -0.918 . . . . 0.0 110.149 179.907 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 7.3 ttm -73.85 -30.17 62.52 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.265 -0.897 . . . . 0.0 110.098 179.906 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 3.9 mtpp -59.64 -30.44 68.72 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.298 -0.876 . . . . 0.0 110.307 -179.978 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 138.98 -6.32 3.13 Favored Glycine 0 N--CA 1.49 2.298 0 N-CA-C 109.829 -1.308 . . . . 0.0 109.829 179.978 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 94.9 m-85 -77.15 177.37 7.89 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.174 -1.192 . . . . 0.0 110.202 179.988 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 17' ' ' ASN . . . . . 0.46 ' HB3' ' CD2' ' A' ' 18' ' ' PHE . 34.2 t-20 -102.81 -59.52 1.69 Allowed 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.207 -0.933 . . . . 0.0 110.367 179.994 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 18' ' ' PHE . . . . . 0.507 ' CE1' ' CB ' ' A' ' 29' ' ' ARG . 17.1 p90 -140.82 161.81 36.93 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.232 -0.918 . . . . 0.0 110.309 179.974 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 19' ' ' GLY . . . . . 0.506 ' HA2' ' HA ' ' A' ' 28' ' ' CYS . . . -148.04 -160.6 9.06 Favored Glycine 0 N--CA 1.49 2.285 0 N-CA-C 109.5 -1.44 . . . . 0.0 109.5 -179.927 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -177.63 170.64 1.98 Allowed 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.226 -1.161 . . . . 0.0 110.178 179.935 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 21' ' ' CYS . . . . . 0.475 ' C ' HG23 ' A' ' 22' ' ' VAL . 4.0 t -93.49 155.11 17.52 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.284 -0.885 . . . . 0.0 110.217 -179.936 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.475 HG23 ' C ' ' A' ' 21' ' ' CYS . 98.0 t -149.79 94.49 0.18 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.64 0 O-C-N 121.29 -0.881 . . . . 0.0 110.115 179.933 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER 50.62 65.79 1.35 Allowed 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.26 -0.9 . . . . 0.0 110.239 179.999 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 61.33 37.71 94.51 Favored Glycine 0 N--CA 1.491 2.32 0 N-CA-C 109.603 -1.399 . . . . 0.0 109.603 179.986 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 25' ' ' SER . . . . . 0.441 ' HB3' ' HB ' ' A' ' 22' ' ' VAL . 2.4 t -134.94 170.8 15.33 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.322 -1.104 . . . . 0.0 110.189 179.97 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 1.3 m -134.61 102.57 5.34 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.282 -0.886 . . . . 0.0 110.07 179.888 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 10.4 mm100 -105.24 164.82 11.55 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.399 -0.813 . . . . 0.0 110.318 -179.718 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 28' ' ' CYS . . . . . 0.506 ' HA ' ' HA2' ' A' ' 19' ' ' GLY . 59.4 m -145.79 158.03 43.88 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.301 -0.875 . . . . 0.0 110.294 -179.88 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.507 ' CB ' ' CE1' ' A' ' 18' ' ' PHE . 0.0 OUTLIER -138.37 149.13 45.26 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.306 -0.871 . . . . 0.0 110.159 179.927 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.587 0 O-C-N 121.315 -0.865 . . . . 0.0 110.266 179.977 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 2' ' ' CYS . . . . . 0.449 ' O ' ' O ' ' A' ' 3' ' ' ASN . 19.4 p . . . . . 0 N--CA 1.491 1.607 0 CA-C-O 121.267 0.556 . . . . 0.0 110.2 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 3' ' ' ASN . . . . . 0.449 ' O ' ' O ' ' A' ' 2' ' ' CYS . 2.1 t-20 59.92 124.02 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.256 -0.903 . . . . 0.0 110.208 -179.99 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 4' ' ' ASP . . . . . 0.452 ' OD1' ' HB2' ' A' ' 21' ' ' CYS . 0.3 OUTLIER -66.26 -28.63 68.86 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.276 -0.89 . . . . 0.0 110.239 -179.914 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 62.1 ttt180 -68.16 -44.96 74.83 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.26 -0.9 . . . . 0.0 110.149 -179.903 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 74.6 m-20 -79.4 -17.16 54.94 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.223 -0.923 . . . . 0.0 110.079 179.974 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.415 ' SG ' ' O ' ' A' ' 20' ' ' LYS . 14.7 t -82.73 -33.31 27.56 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.376 -0.827 . . . . 0.0 110.083 179.846 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 8' ' ' SER . . . . . 0.748 ' O ' HD12 ' A' ' 12' ' ' ILE . 34.8 p -80.94 -50.11 10.14 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.359 -0.838 . . . . 0.0 110.286 -179.909 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -56.01 -22.53 27.59 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.165 -0.96 . . . . 0.0 110.064 179.928 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -73.96 -47.02 40.39 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.309 -0.87 . . . . 0.0 110.125 179.934 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.457 ' O ' ' HB2' ' A' ' 16' ' ' TYR . 21.0 m -67.22 -44.73 78.8 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.184 -0.948 . . . . 0.0 109.989 179.918 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 12' ' ' ILE . . . . . 0.748 HD12 ' O ' ' A' ' 8' ' ' SER . 2.5 mt -63.74 -30.48 50.03 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.601 0 O-C-N 121.239 -0.913 . . . . 0.0 110.069 179.844 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -74.98 -28.25 60.48 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.223 -0.923 . . . . 0.0 110.126 179.82 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 3.2 mtpp -82.73 -18.07 42.09 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.327 -0.858 . . . . 0.0 110.339 179.973 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 117.65 8.87 10.6 Favored Glycine 0 N--CA 1.491 2.362 0 N-CA-C 109.635 -1.386 . . . . 0.0 109.635 179.836 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 16' ' ' TYR . . . . . 0.457 ' HB2' ' O ' ' A' ' 11' ' ' CYS . 40.4 m-85 -83.77 -172.5 4.19 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.18 -1.188 . . . . 0.0 110.139 179.965 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 17' ' ' ASN . . . . . 0.586 ' HB3' ' CE1' ' A' ' 18' ' ' PHE . 0.4 OUTLIER -133.05 0.49 3.45 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.219 -0.925 . . . . 0.0 110.475 -179.819 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 18' ' ' PHE . . . . . 0.586 ' CE1' ' HB3' ' A' ' 17' ' ' ASN . 5.9 m-85 -141.37 162.49 35.36 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.137 -0.977 . . . . 0.0 110.414 -179.948 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 19' ' ' GLY . . . . . 0.443 ' HA3' ' HA ' ' A' ' 8' ' ' SER . . . -156.85 121.4 1.07 Allowed Glycine 0 N--CA 1.49 2.239 0 N-CA-C 109.355 -1.498 . . . . 0.0 109.355 179.904 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.415 ' O ' ' SG ' ' A' ' 7' ' ' CYS . 23.1 ttpt -134.64 149.74 50.59 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.155 -1.203 . . . . 0.0 110.424 -179.787 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 21' ' ' CYS . . . . . 0.452 ' HB2' ' OD1' ' A' ' 4' ' ' ASP . 0.1 OUTLIER -105.57 126.54 52.25 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.357 -0.84 . . . . 0.0 110.042 179.829 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.42 HG23 ' C ' ' A' ' 21' ' ' CYS . 59.0 t -145.59 139.14 21.48 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.637 0 O-C-N 121.291 -0.881 . . . . 0.0 110.26 -179.897 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 42.2 mtm180 47.67 53.73 10.83 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.27 -0.893 . . . . 0.0 110.261 179.87 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 51.7 29.49 25.71 Favored Glycine 0 N--CA 1.49 2.259 0 N-CA-C 109.652 -1.379 . . . . 0.0 109.652 179.912 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 8.4 t -131.09 -170.61 2.4 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.227 -1.161 . . . . 0.0 110.235 -179.952 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 53.3 t -143.31 140.73 30.72 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.292 -0.88 . . . . 0.0 110.096 -179.976 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 30.3 mt-30 -120.28 141.78 49.68 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.127 -0.983 . . . . 0.0 110.619 -179.813 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 43.4 m -124.22 150.57 45.11 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.355 -0.841 . . . . 0.0 109.886 179.602 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.476 ' HB3' ' CD1' ' A' ' 18' ' ' PHE . 0.0 OUTLIER -136.38 161.12 36.68 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.131 -0.981 . . . . 0.0 110.227 -179.91 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.425 ' HG2' ' HA ' ' A' ' 16' ' ' TYR . 0.2 OUTLIER . . . . . 0 N--CA 1.493 1.691 0 O-C-N 121.187 -0.945 . . . . 0.0 110.002 179.927 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 2' ' ' CYS . . . . . 0.453 ' O ' ' SG ' ' A' ' 2' ' ' CYS . 10.6 t . . . . . 0 N--CA 1.491 1.597 0 CA-C-O 121.273 0.558 . . . . 0.0 110.088 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -79.11 134.08 36.74 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.235 -0.916 . . . . 0.0 110.228 179.988 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 4' ' ' ASP . . . . . 0.508 ' OD1' ' N ' ' A' ' 4' ' ' ASP . 8.6 p-10 -57.01 -41.3 78.24 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.235 -0.916 . . . . 0.0 110.208 179.9 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 7.0 tpt180 -62.25 -42.46 99.35 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.24 -0.912 . . . . 0.0 109.925 179.942 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -79.34 -17.04 55.34 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.365 -0.834 . . . . 0.0 109.741 179.608 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.454 ' O ' ' SG ' ' A' ' 11' ' ' CYS . 0.9 OUTLIER -78.0 -33.02 51.48 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.43 -0.794 . . . . 0.0 109.874 179.618 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 8' ' ' SER . . . . . 0.452 ' O ' HG13 ' A' ' 12' ' ' ILE . 0.3 OUTLIER -82.04 -43.99 17.21 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.393 -0.817 . . . . 0.0 110.152 179.734 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.4 mt -55.32 -46.94 76.31 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.262 -0.899 . . . . 0.0 110.193 179.943 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 19.9 t0 -63.77 -37.37 87.1 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.274 -0.891 . . . . 0.0 110.168 179.977 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.454 ' SG ' ' O ' ' A' ' 7' ' ' CYS . 82.4 m -66.32 -41.07 90.19 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.26 -0.9 . . . . 0.0 109.849 179.86 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 12' ' ' ILE . . . . . 0.452 HG13 ' O ' ' A' ' 8' ' ' SER . 81.4 mt -63.83 -35.65 73.92 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.587 0 O-C-N 121.322 -0.861 . . . . 0.0 109.901 179.822 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -70.72 -28.66 64.89 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.275 -0.891 . . . . 0.0 109.83 179.769 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.29 -23.93 46.94 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.313 -0.867 . . . . 0.0 110.132 179.889 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 124.52 -3.15 8.8 Favored Glycine 0 N--CA 1.491 2.348 0 N-CA-C 109.592 -1.403 . . . . 0.0 109.592 179.957 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 16' ' ' TYR . . . . . 0.417 ' CD2' ' CB ' ' A' ' 28' ' ' CYS . 48.1 m-85 -86.96 -175.71 5.46 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.126 -1.22 . . . . 0.0 110.334 -179.955 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 28.1 m-80 -109.18 -55.01 2.47 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.265 -0.897 . . . . 0.0 110.223 -179.979 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 18' ' ' PHE . . . . . 0.605 ' CE2' ' HB2' ' A' ' 29' ' ' ARG . 8.2 p90 -129.62 170.15 14.14 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.154 -0.967 . . . . 0.0 110.408 179.958 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -140.15 -178.38 16.86 Favored Glycine 0 N--CA 1.49 2.297 0 N-CA-C 109.405 -1.478 . . . . 0.0 109.405 179.952 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -164.62 160.9 20.58 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.227 -1.161 . . . . 0.0 110.323 179.96 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 21' ' ' CYS . . . . . 0.466 ' HA ' ' O ' ' A' ' 25' ' ' SER . 1.8 t -92.94 141.14 28.74 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.235 -0.916 . . . . 0.0 110.351 -179.851 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.442 ' O ' ' HB2' ' A' ' 25' ' ' SER . 72.8 t -147.42 123.85 2.91 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.614 0 O-C-N 121.301 -0.874 . . . . 0.0 110.058 179.894 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 23' ' ' ARG . . . . . 0.436 ' HB2' ' O ' ' A' ' 22' ' ' VAL . 3.7 mmm-85 55.43 35.79 25.77 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.275 -0.89 . . . . 0.0 110.13 -179.904 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 73.17 29.19 64.88 Favored Glycine 0 N--CA 1.489 2.218 0 N-CA-C 109.5 -1.44 . . . . 0.0 109.5 -179.925 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 25' ' ' SER . . . . . 0.466 ' O ' ' HA ' ' A' ' 21' ' ' CYS . 69.7 m -129.3 -171.59 2.53 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.283 -1.128 . . . . 0.0 110.307 179.999 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 47.3 t -141.53 121.41 13.59 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.346 -0.846 . . . . 0.0 110.181 179.956 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 4.8 mm-40 -120.21 174.74 6.31 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.171 -0.956 . . . . 0.0 110.458 -179.915 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 28' ' ' CYS . . . . . 0.417 ' CB ' ' CD2' ' A' ' 16' ' ' TYR . 73.1 m -125.05 149.58 47.65 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.323 -0.861 . . . . 0.0 110.085 179.886 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.605 ' HB2' ' CE2' ' A' ' 18' ' ' PHE . 0.7 OUTLIER -136.42 146.03 45.94 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.216 -0.928 . . . . 0.0 110.258 -179.916 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.491 1.624 0 O-C-N 121.259 -0.901 . . . . 0.0 110.241 -179.98 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 2' ' ' CYS . . . . . 0.434 ' O ' ' SG ' ' A' ' 2' ' ' CYS . 15.8 p . . . . . 0 N--CA 1.492 1.648 0 CA-C-O 121.246 0.546 . . . . 0.0 110.236 . . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 3' ' ' ASN . . . . . 0.467 ' O ' ' HB2' ' A' ' 7' ' ' CYS . 20.4 t-20 -100.54 125.14 46.86 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.3 -0.875 . . . . 0.0 110.253 -179.945 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 4' ' ' ASP . . . . . 0.472 ' HA ' ' HB3' ' A' ' 7' ' ' CYS . 3.6 m-20 -66.58 -34.37 77.74 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.197 -0.939 . . . . 0.0 110.38 179.976 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 5' ' ' ARG . . . . . 0.454 ' O ' ' HB2' ' A' ' 9' ' ' LEU . 1.8 mmm-85 -62.15 -54.47 40.69 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.159 -0.963 . . . . 0.0 110.125 179.951 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -79.5 2.22 22.85 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.239 -0.913 . . . . 0.0 110.045 179.758 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.472 ' HB3' ' HA ' ' A' ' 4' ' ' ASP . 14.8 t -95.3 -40.44 9.54 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.254 -0.904 . . . . 0.0 109.997 179.97 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 26.8 t -86.42 -35.39 19.75 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.376 -0.828 . . . . 0.0 110.045 179.875 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.454 ' HB2' ' O ' ' A' ' 5' ' ' ARG . 0.6 OUTLIER -55.22 -47.53 75.18 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.208 -0.932 . . . . 0.0 110.008 179.944 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -65.13 -35.02 79.79 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.321 -0.862 . . . . 0.0 110.122 179.912 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 1.5 t -70.45 -39.37 74.36 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.214 -0.929 . . . . 0.0 110.131 179.968 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 39.8 mt -63.55 -35.44 72.64 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.579 0 O-C-N 121.2 -0.938 . . . . 0.0 109.809 179.703 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -77.77 -27.57 50.31 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.382 -0.824 . . . . 0.0 109.754 179.39 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.51 -27.82 65.51 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.354 -0.841 . . . . 0.0 109.958 179.743 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 121.89 10.82 6.15 Favored Glycine 0 N--CA 1.489 2.192 0 N-CA-C 109.669 -1.373 . . . . 0.0 109.669 179.983 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 60.6 m-85 -93.44 -161.73 0.87 Allowed 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.301 -1.117 . . . . 0.0 110.327 -179.958 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 17' ' ' ASN . . . . . 0.477 ' HB3' ' CD2' ' A' ' 18' ' ' PHE . 1.8 t-20 -119.76 -51.44 2.26 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.264 -0.898 . . . . 0.0 110.36 -179.882 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 18' ' ' PHE . . . . . 0.588 ' CE1' ' HB2' ' A' ' 29' ' ' ARG . 6.5 p90 -161.84 156.66 22.93 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.277 -0.889 . . . . 0.0 110.154 -179.817 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 19' ' ' GLY . . . . . 0.514 ' HA2' ' HA ' ' A' ' 28' ' ' CYS . . . -127.88 -149.69 7.15 Favored Glycine 0 N--CA 1.491 2.363 0 N-CA-C 109.684 -1.366 . . . . 0.0 109.684 179.946 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.507 ' O ' ' HA ' ' A' ' 26' ' ' CYS . 9.7 tttp -175.26 152.98 1.48 Allowed 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.233 -1.157 . . . . 0.0 110.177 179.962 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 0.3 OUTLIER -90.84 129.58 36.88 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.274 -0.891 . . . . 0.0 110.312 179.957 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.446 ' O ' ' N ' ' A' ' 24' ' ' GLY . 84.5 t -109.72 98.35 6.92 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.613 0 O-C-N 121.242 -0.911 . . . . 0.0 110.07 -179.974 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 59.37 -84.81 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.174 -0.954 . . . . 0.0 110.13 -179.844 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 24' ' ' GLY . . . . . 0.446 ' N ' ' O ' ' A' ' 22' ' ' VAL . . . -126.05 15.71 6.9 Favored Glycine 0 N--CA 1.49 2.297 0 N-CA-C 109.527 -1.429 . . . . 0.0 109.527 179.887 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -130.87 -163.71 1.35 Allowed 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.264 -1.139 . . . . 0.0 110.076 179.88 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 26' ' ' CYS . . . . . 0.507 ' HA ' ' O ' ' A' ' 20' ' ' LYS . 0.5 OUTLIER -158.24 132.97 8.33 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.167 -0.958 . . . . 0.0 110.33 179.83 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 10.0 mm100 -108.89 -174.14 2.44 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.353 -0.842 . . . . 0.0 110.301 -179.935 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 28' ' ' CYS . . . . . 0.514 ' HA ' ' HA2' ' A' ' 19' ' ' GLY . 1.1 m -140.46 153.21 46.18 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.327 -0.858 . . . . 0.0 110.207 -179.994 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.588 ' HB2' ' CE1' ' A' ' 18' ' ' PHE . 4.5 mmt180 -144.04 137.95 28.0 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.309 -0.869 . . . . 0.0 110.286 -179.957 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.656 0 O-C-N 121.23 -0.919 . . . . 0.0 110.147 179.913 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 2' ' ' CYS . . . . . 0.447 ' SG ' ' O ' ' A' ' 25' ' ' SER . 12.0 p . . . . . 0 N--CA 1.491 1.616 0 CA-C-O 121.255 0.55 . . . . 0.0 110.174 . . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 2.8 m-20 -111.9 133.53 54.04 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.279 -0.888 . . . . 0.0 110.143 -179.937 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -50.75 -34.57 27.72 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.211 -0.931 . . . . 0.0 110.101 179.961 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -65.76 -49.89 66.73 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.254 -0.904 . . . . 0.0 110.084 179.812 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -79.68 0.86 28.62 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.243 -0.911 . . . . 0.0 110.098 179.846 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 11.6 t -100.23 -36.75 9.18 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.184 -0.947 . . . . 0.0 110.169 179.908 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 8' ' ' SER . . . . . 0.441 ' OG ' ' HA3' ' A' ' 19' ' ' GLY . 0.1 OUTLIER -86.57 -35.26 19.58 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.296 -0.878 . . . . 0.0 110.091 179.909 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.478 ' HA ' HD12 ' A' ' 12' ' ' ILE . 2.2 mt -55.52 -55.36 32.83 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.258 -0.901 . . . . 0.0 110.136 179.924 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -62.78 -30.59 71.57 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.321 -0.862 . . . . 0.0 110.016 179.819 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 1.2 m -74.81 -39.48 61.66 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.316 -0.865 . . . . 0.0 110.098 179.856 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 12' ' ' ILE . . . . . 0.478 HD12 ' HA ' ' A' ' 9' ' ' LEU . 36.0 mt -63.64 -32.02 55.24 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.581 0 O-C-N 121.337 -0.852 . . . . 0.0 110.006 179.881 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -86.76 -20.24 27.93 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.33 -0.856 . . . . 0.0 110.016 179.826 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.62 -22.08 51.33 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.394 -0.816 . . . . 0.0 110.155 179.928 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 126.04 5.42 6.25 Favored Glycine 0 N--CA 1.49 2.271 0 N-CA-C 109.642 -1.383 . . . . 0.0 109.642 -179.999 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 78.0 m-85 -94.41 -172.58 2.82 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.199 -1.177 . . . . 0.0 110.129 179.976 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 17' ' ' ASN . . . . . 0.479 ' HB3' ' CE2' ' A' ' 18' ' ' PHE . 44.1 t30 -139.08 7.05 2.42 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.135 -0.978 . . . . 0.0 110.2 179.907 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 18' ' ' PHE . . . . . 0.479 ' CE2' ' HB3' ' A' ' 17' ' ' ASN . 49.1 m-85 -143.62 168.97 18.62 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.252 -0.905 . . . . 0.0 110.155 179.946 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 19' ' ' GLY . . . . . 0.441 ' HA3' ' OG ' ' A' ' 8' ' ' SER . . . -155.73 100.17 0.19 Allowed Glycine 0 N--CA 1.49 2.283 0 N-CA-C 109.434 -1.466 . . . . 0.0 109.434 179.953 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -120.39 137.97 54.01 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.205 -1.174 . . . . 0.0 110.247 -179.806 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -87.32 153.35 21.54 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.214 -0.929 . . . . 0.0 110.191 -179.981 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.502 HG21 ' HG3' ' A' ' 27' ' ' GLN . 35.8 t -126.57 61.44 0.29 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.56 0 O-C-N 121.247 -0.908 . . . . 0.0 110.167 179.893 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 3.3 mpp_? 60.26 63.86 1.33 Allowed 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.364 -0.835 . . . . 0.0 110.141 -179.808 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 92.15 13.09 58.02 Favored Glycine 0 N--CA 1.49 2.29 0 N-CA-C 109.493 -1.443 . . . . 0.0 109.493 -179.885 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 25' ' ' SER . . . . . 0.487 ' CB ' ' HB ' ' A' ' 22' ' ' VAL . 0.6 OUTLIER -133.28 -175.93 3.97 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.257 -1.143 . . . . 0.0 110.164 179.971 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 12.2 t -150.26 114.87 5.24 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.237 -0.914 . . . . 0.0 110.386 -179.977 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 27' ' ' GLN . . . . . 0.502 ' HG3' HG21 ' A' ' 22' ' ' VAL . 2.7 mm100 -114.79 161.5 18.1 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.188 -0.945 . . . . 0.0 110.123 179.844 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 28' ' ' CYS . . . . . 0.451 ' SG ' ' O ' ' A' ' 27' ' ' GLN . 86.4 m -150.0 -178.45 6.49 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.223 -0.923 . . . . 0.0 110.333 -179.952 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -146.98 163.1 37.3 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.272 -0.892 . . . . 0.0 110.195 -179.986 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.667 0 O-C-N 121.235 -0.915 . . . . 0.0 110.183 179.927 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 2' ' ' CYS . . . . . 0.473 ' O ' ' HB3' ' A' ' 3' ' ' ASN . 26.6 p . . . . . 0 N--CA 1.492 1.642 0 CA-C-O 121.234 0.54 . . . . 0.0 110.253 . . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 3' ' ' ASN . . . . . 0.473 ' HB3' ' O ' ' A' ' 2' ' ' CYS . 8.9 t-20 62.71 126.24 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.228 -0.92 . . . . 0.0 110.104 -179.743 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -76.11 -18.78 59.02 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.237 -0.914 . . . . 0.0 110.412 -179.776 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -67.85 -55.78 11.64 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.256 -0.903 . . . . 0.0 110.288 -179.814 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 42.9 m-20 -79.33 -6.64 57.19 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.244 -0.91 . . . . 0.0 110.314 -179.799 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 53.1 t -90.28 -42.32 11.05 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.225 -0.922 . . . . 0.0 110.082 179.854 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 3.1 m -78.2 -43.18 29.2 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.266 -0.896 . . . . 0.0 110.174 -179.996 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 40.2 mt -54.61 -47.95 72.79 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.307 -0.871 . . . . 0.0 110.215 -179.893 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 10' ' ' ASP . . . . . 0.468 ' O ' ' HG3' ' A' ' 14' ' ' LYS . 0.2 OUTLIER -66.6 -33.35 75.46 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.276 -0.89 . . . . 0.0 110.361 179.978 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 7.4 m -68.26 -45.73 72.36 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.24 -0.913 . . . . 0.0 110.369 179.998 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 68.2 mt -68.13 -33.19 59.5 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.645 0 O-C-N 121.228 -0.92 . . . . 0.0 110.351 -179.866 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -67.04 -37.65 84.45 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.193 -0.942 . . . . 0.0 110.427 -179.878 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 14' ' ' LYS . . . . . 0.468 ' HG3' ' O ' ' A' ' 10' ' ' ASP . 8.3 mttm -63.02 -27.49 69.45 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.243 -0.91 . . . . 0.0 110.325 -179.834 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 133.23 -2.62 4.7 Favored Glycine 0 N--CA 1.491 2.31 0 N-CA-C 109.745 -1.342 . . . . 0.0 109.745 179.958 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 16' ' ' TYR . . . . . 0.426 ' HA ' ' HG2' ' A' ' 30' ' ' ARG . 96.8 m-85 -83.79 179.35 7.6 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.149 -1.207 . . . . 0.0 110.354 -179.859 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 17' ' ' ASN . . . . . 0.583 ' HB3' ' CD2' ' A' ' 18' ' ' PHE . 1.5 t-20 -103.46 -46.61 4.52 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.347 -0.846 . . . . 0.0 109.875 179.688 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 18' ' ' PHE . . . . . 0.592 ' CE1' ' HB3' ' A' ' 29' ' ' ARG . 32.6 p90 -154.18 140.09 18.21 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.34 -0.85 . . . . 0.0 110.013 179.643 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 19' ' ' GLY . . . . . 0.512 ' CA ' ' HA ' ' A' ' 28' ' ' CYS . . . -119.89 -152.03 8.92 Favored Glycine 0 N--CA 1.49 2.242 0 N-CA-C 109.575 -1.41 . . . . 0.0 109.575 -179.97 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -178.36 166.44 1.86 Allowed 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.27 -1.135 . . . . 0.0 110.184 -179.945 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 21' ' ' CYS . . . . . 0.462 ' HA ' ' O ' ' A' ' 25' ' ' SER . 12.3 t -84.98 142.76 29.39 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.228 -0.92 . . . . 0.0 110.297 -179.938 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.589 ' O ' HG12 ' A' ' 22' ' ' VAL . 19.3 t -130.15 88.05 1.07 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.499 0 O-C-N 121.218 -0.926 . . . . 0.0 110.011 179.838 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 23' ' ' ARG . . . . . 0.412 ' HB2' ' O ' ' A' ' 22' ' ' VAL . 42.5 mtt180 54.23 74.69 0.32 Allowed 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.327 -0.858 . . . . 0.0 110.114 -179.926 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 59.37 28.55 64.79 Favored Glycine 0 N--CA 1.49 2.292 0 N-CA-C 109.521 -1.432 . . . . 0.0 109.521 -179.967 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 25' ' ' SER . . . . . 0.462 ' O ' ' HA ' ' A' ' 21' ' ' CYS . 2.1 m -136.96 176.38 8.77 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.27 -1.135 . . . . 0.0 110.172 -179.979 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 45.9 t -137.23 121.78 18.43 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.222 -0.924 . . . . 0.0 110.312 179.946 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 27' ' ' GLN . . . . . 0.439 ' O ' ' HA3' ' A' ' 19' ' ' GLY . 1.7 mm-40 -120.03 161.21 21.34 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.278 -0.889 . . . . 0.0 110.14 179.849 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 28' ' ' CYS . . . . . 0.512 ' HA ' ' CA ' ' A' ' 19' ' ' GLY . 17.9 m -119.79 139.39 52.39 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.341 -0.85 . . . . 0.0 110.03 179.905 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.592 ' HB3' ' CE1' ' A' ' 18' ' ' PHE . 1.1 mtm180 -120.16 143.08 48.4 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.167 -0.958 . . . . 0.0 110.29 -179.989 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.426 ' HG2' ' HA ' ' A' ' 16' ' ' TYR . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.639 0 O-C-N 121.28 -0.888 . . . . 0.0 110.161 179.975 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 13.2 p . . . . . 0 N--CA 1.492 1.636 0 CA-C-O 121.255 0.55 . . . . 0.0 110.161 . . . . . . . . . 0 0 . 1 . 024 nuclear build core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -116.1 156.42 26.43 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.143 -0.973 . . . . 0.0 110.278 -179.884 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 33.1 m-20 -61.93 -34.64 76.46 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.225 -0.922 . . . . 0.0 109.933 179.732 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 5' ' ' ARG . . . . . 0.413 ' O ' HD12 ' A' ' 9' ' ' LEU . 38.2 ttt180 -79.46 -38.18 35.18 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.289 -0.882 . . . . 0.0 109.855 179.737 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 24.9 t0 -79.52 -12.44 59.86 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.346 -0.846 . . . . 0.0 110.088 179.852 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 28.4 t -96.18 -35.32 11.34 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.313 -0.867 . . . . 0.0 110.172 179.982 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 11.5 p -78.02 -36.02 49.12 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.288 -0.882 . . . . 0.0 110.252 -179.89 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.413 HD12 ' O ' ' A' ' 5' ' ' ARG . 8.4 mt -53.49 -44.56 69.14 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.226 -0.921 . . . . 0.0 110.303 -179.999 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 10' ' ' ASP . . . . . 0.453 ' O ' ' HG3' ' A' ' 14' ' ' LYS . 19.8 t0 -72.24 -31.92 66.25 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.144 -0.972 . . . . 0.0 110.107 179.817 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.446 ' O ' ' HB2' ' A' ' 16' ' ' TYR . 55.7 m -66.76 -38.19 86.1 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.29 -0.881 . . . . 0.0 110.222 179.987 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 16.0 mt -71.54 -45.32 68.44 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.569 0 O-C-N 121.199 -0.938 . . . . 0.0 110.102 -179.99 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 1.4 ttt -63.79 -29.15 70.39 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.228 -0.92 . . . . 0.0 110.111 179.916 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 14' ' ' LYS . . . . . 0.453 ' HG3' ' O ' ' A' ' 10' ' ' ASP . 22.6 mttt -68.4 -20.25 64.66 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.359 -0.838 . . . . 0.0 110.153 179.842 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 119.82 -5.14 12.76 Favored Glycine 0 N--CA 1.491 2.323 0 N-CA-C 109.624 -1.39 . . . . 0.0 109.624 179.958 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 16' ' ' TYR . . . . . 0.446 ' HB2' ' O ' ' A' ' 11' ' ' CYS . 58.5 m-85 -86.73 -155.73 0.28 Allowed 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.238 -1.154 . . . . 0.0 110.083 179.96 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -129.2 -65.02 0.88 Allowed 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.117 -0.99 . . . . 0.0 110.259 -179.995 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 18' ' ' PHE . . . . . 0.558 ' CE1' ' HB3' ' A' ' 29' ' ' ARG . 39.7 p90 -129.11 139.83 51.81 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.272 -0.892 . . . . 0.0 110.301 -179.958 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 19' ' ' GLY . . . . . 0.481 ' HA3' ' O ' ' A' ' 27' ' ' GLN . . . -121.68 -162.88 11.77 Favored Glycine 0 N--CA 1.49 2.285 0 N-CA-C 109.571 -1.412 . . . . 0.0 109.571 179.997 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -162.31 151.76 15.84 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.35 -1.089 . . . . 0.0 110.198 -179.949 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 21' ' ' CYS . . . . . 0.465 ' HA ' ' O ' ' A' ' 25' ' ' SER . 0.8 OUTLIER -86.11 140.87 29.83 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.242 -0.911 . . . . 0.0 110.125 179.844 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.51 HG21 ' OE1' ' A' ' 27' ' ' GLN . 15.6 t -136.27 96.41 1.5 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.604 0 O-C-N 121.143 -0.973 . . . . 0.0 110.128 -179.998 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 23' ' ' ARG . . . . . 0.419 ' O ' ' C ' ' A' ' 24' ' ' GLY . 16.7 mtt180 52.16 85.43 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.192 -0.942 . . . . 0.0 110.144 -179.908 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 24' ' ' GLY . . . . . 0.419 ' C ' ' O ' ' A' ' 23' ' ' ARG . . . 44.88 33.34 3.51 Favored Glycine 0 N--CA 1.491 2.3 0 N-CA-C 109.362 -1.495 . . . . 0.0 109.362 -179.791 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 25' ' ' SER . . . . . 0.5 ' CB ' ' O ' ' A' ' 22' ' ' VAL . 0.8 OUTLIER -138.03 165.14 27.33 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.237 -1.155 . . . . 0.0 110.15 -179.913 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 24.6 t -134.84 127.62 31.13 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.185 -0.947 . . . . 0.0 110.312 -179.979 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 27' ' ' GLN . . . . . 0.51 ' OE1' HG21 ' A' ' 22' ' ' VAL . 27.5 mt-30 -118.85 159.6 23.46 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.339 -0.851 . . . . 0.0 109.978 179.82 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 61.9 m -120.67 136.0 54.96 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.196 -0.94 . . . . 0.0 110.26 -179.866 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.558 ' HB3' ' CE1' ' A' ' 18' ' ' PHE . 5.8 mmt180 -124.3 136.46 54.14 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.312 -0.867 . . . . 0.0 110.285 -179.968 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.427 ' HG3' ' HA ' ' A' ' 16' ' ' TYR . 0.9 OUTLIER . . . . . 0 N--CA 1.493 1.68 0 O-C-N 121.383 -0.823 . . . . 0.0 110.182 179.901 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 2' ' ' CYS . . . . . 0.428 ' O ' ' HB2' ' A' ' 3' ' ' ASN . 28.5 p . . . . . 0 N--CA 1.491 1.596 0 CA-C-O 121.234 0.54 . . . . 0.0 110.307 . . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 3' ' ' ASN . . . . . 0.428 ' HB2' ' O ' ' A' ' 2' ' ' CYS . 29.5 m-20 57.97 98.2 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.283 -0.885 . . . . 0.0 110.163 -179.919 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -69.47 -38.2 77.62 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.21 -0.931 . . . . 0.0 110.307 -179.928 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.85 -39.85 95.19 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.262 -0.899 . . . . 0.0 110.308 -179.98 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -79.68 -21.94 44.07 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.283 -0.886 . . . . 0.0 110.332 -179.9 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 8.6 t -78.41 -34.4 48.08 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.233 -0.917 . . . . 0.0 110.05 179.863 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 22.8 m -81.31 -34.72 31.71 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.241 -0.912 . . . . 0.0 110.118 179.909 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 8.6 mt -61.86 -51.95 66.1 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.217 -0.927 . . . . 0.0 110.205 179.855 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -62.64 -29.41 70.6 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.183 -0.948 . . . . 0.0 109.942 179.776 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 1.3 m -72.59 -47.86 44.53 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.289 -0.882 . . . . 0.0 110.143 179.816 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 40.9 mt -63.38 -22.45 30.84 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.599 0 O-C-N 121.306 -0.871 . . . . 0.0 109.88 179.828 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -77.86 -40.89 38.69 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.374 -0.829 . . . . 0.0 110.039 179.779 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -59.66 -48.35 82.02 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.277 -0.889 . . . . 0.0 110.089 179.936 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 144.65 36.71 0.07 OUTLIER Glycine 0 N--CA 1.492 2.388 0 N-CA-C 109.934 -1.266 . . . . 0.0 109.934 179.752 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 16' ' ' TYR . . . . . 0.541 ' CD1' ' HG3' ' A' ' 30' ' ' ARG . 64.8 m-85 -108.64 -164.38 0.95 Allowed 'General case' 0 N--CA 1.487 1.394 0 O-C-N 121.119 -1.224 . . . . 0.0 110.042 179.744 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 17' ' ' ASN . . . . . 0.557 ' HB3' ' CD1' ' A' ' 18' ' ' PHE . 51.9 t-20 -128.84 -54.41 1.22 Allowed 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.123 -0.985 . . . . 0.0 110.486 -179.941 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 18' ' ' PHE . . . . . 0.599 ' N ' ' CD1' ' A' ' 18' ' ' PHE . 5.8 p90 -131.73 150.4 52.16 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.129 -0.982 . . . . 0.0 110.177 179.95 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 19' ' ' GLY . . . . . 0.481 ' HA2' ' HA ' ' A' ' 28' ' ' CYS . . . -155.82 -176.64 28.2 Favored Glycine 0 N--CA 1.49 2.272 0 N-CA-C 109.812 -1.315 . . . . 0.0 109.812 -179.868 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -174.66 171.89 3.15 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.279 -1.13 . . . . 0.0 110.112 -179.974 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 21' ' ' CYS . . . . . 0.437 ' HA ' ' O ' ' A' ' 25' ' ' SER . 52.1 t -90.35 135.92 33.38 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.223 -0.923 . . . . 0.0 110.136 179.921 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.487 ' HB ' ' HB3' ' A' ' 25' ' ' SER . 5.2 t -113.98 85.45 0.82 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.625 0 O-C-N 121.146 -0.971 . . . . 0.0 110.196 -179.995 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 54.01 72.34 0.45 Allowed 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.264 -0.898 . . . . 0.0 110.223 179.917 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 65.0 34.76 90.74 Favored Glycine 0 N--CA 1.49 2.282 0 N-CA-C 109.624 -1.39 . . . . 0.0 109.624 179.853 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 25' ' ' SER . . . . . 0.487 ' HB3' ' HB ' ' A' ' 22' ' ' VAL . 8.7 t -140.26 175.59 9.47 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.237 -1.155 . . . . 0.0 110.263 -179.993 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 52.8 t -135.27 97.72 3.78 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.265 -0.897 . . . . 0.0 110.136 179.909 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 27' ' ' GLN . . . . . 0.46 ' HB2' ' CG2' ' A' ' 22' ' ' VAL . 28.1 mt-30 -113.42 151.23 31.63 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.269 -0.894 . . . . 0.0 110.251 -179.877 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 28' ' ' CYS . . . . . 0.481 ' HA ' ' HA2' ' A' ' 19' ' ' GLY . 91.2 m -144.77 168.96 18.97 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.297 -0.877 . . . . 0.0 110.16 179.857 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.59 ' HB2' ' CE2' ' A' ' 18' ' ' PHE . 1.8 mpt_? -136.21 167.63 20.92 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.308 -0.87 . . . . 0.0 110.283 -179.752 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 30' ' ' ARG . . . . . 0.541 ' HG3' ' CD1' ' A' ' 16' ' ' TYR . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.59 0 O-C-N 121.275 -0.89 . . . . 0.0 110.17 -179.987 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.645 0 CA-C-O 121.16 0.505 . . . . 0.0 110.242 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' CYS . . . . . 0.458 ' O ' ' SG ' ' A' ' 7' ' ' CYS . 11.4 t -79.58 -20.94 45.75 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.267 -0.895 . . . . 0.0 110.206 179.964 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 3' ' ' ASN . . . . . 0.464 ' O ' ' HB2' ' A' ' 7' ' ' CYS . 15.7 m120 48.0 84.22 0.03 OUTLIER 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.211 -0.931 . . . . 0.0 110.107 -179.96 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -52.02 -25.77 9.24 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.296 -0.877 . . . . 0.0 110.688 -179.824 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 0.466 ' O ' ' HB2' ' A' ' 9' ' ' LEU . 0.0 OUTLIER -79.39 -45.24 19.91 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.073 -1.017 . . . . 0.0 110.481 -179.694 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -79.6 -18.4 51.7 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.193 -0.942 . . . . 0.0 110.218 -179.887 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.468 ' O ' ' HB2' ' A' ' 11' ' ' CYS . 0.5 OUTLIER -83.53 -43.36 15.81 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.301 -0.874 . . . . 0.0 110.08 179.849 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 8' ' ' SER . . . . . 0.435 ' O ' HG13 ' A' ' 12' ' ' ILE . 86.0 p -72.17 -39.64 68.53 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.266 -0.896 . . . . 0.0 110.335 -179.92 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.466 ' HB2' ' O ' ' A' ' 5' ' ' ARG . 0.2 OUTLIER -63.14 -51.4 66.65 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.248 -0.907 . . . . 0.0 110.343 -179.84 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -62.85 -35.95 81.64 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.261 -0.899 . . . . 0.0 110.457 -179.793 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.468 ' HB2' ' O ' ' A' ' 7' ' ' CYS . 0.5 OUTLIER -73.39 -43.83 59.74 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.109 -0.995 . . . . 0.0 110.425 -179.942 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 12' ' ' ILE . . . . . 0.435 HG13 ' O ' ' A' ' 8' ' ' SER . 47.6 mt -63.42 -23.18 32.65 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.614 0 O-C-N 121.185 -0.947 . . . . 0.0 109.885 179.906 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 1.9 ttt -80.22 -39.52 28.92 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.318 -0.864 . . . . 0.0 109.859 179.62 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 40.4 mtmt -54.03 -29.61 44.4 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.251 -0.905 . . . . 0.0 110.076 179.752 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 128.44 5.82 4.93 Favored Glycine 0 N--CA 1.491 2.321 0 N-CA-C 109.839 -1.304 . . . . 0.0 109.839 179.852 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 25.7 m-85 -80.37 -177.97 6.42 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.149 -1.206 . . . . 0.0 110.143 -179.975 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' ASN . . . . . 0.478 ' CB ' ' OG1' ' A' ' 31' ' ' THR . 32.2 t30 -108.31 -51.39 2.9 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.189 -0.945 . . . . 0.0 110.174 -179.915 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 18' ' ' PHE . . . . . 0.564 ' CE1' ' CB ' ' A' ' 29' ' ' ARG . 8.9 p90 -151.42 159.07 44.4 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.283 -0.886 . . . . 0.0 110.372 -179.917 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 19' ' ' GLY . . . . . 0.518 ' CA ' ' HA ' ' A' ' 28' ' ' CYS . . . -153.42 -162.05 10.77 Favored Glycine 0 N--CA 1.49 2.279 0 N-CA-C 109.372 -1.491 . . . . 0.0 109.372 179.938 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.439 ' HB3' ' O ' ' A' ' 19' ' ' GLY . 1.6 pttt 176.79 160.94 0.39 Allowed 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.288 -1.125 . . . . 0.0 110.275 179.891 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 74.1 m -82.92 137.81 34.08 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.153 -0.967 . . . . 0.0 110.086 179.899 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.489 ' O ' ' N ' ' A' ' 25' ' ' SER . 41.7 t -131.85 131.11 61.96 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.568 0 O-C-N 121.271 -0.893 . . . . 0.0 110.208 179.951 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 23' ' ' ARG . . . . . 0.426 ' C ' ' O ' ' A' ' 22' ' ' VAL . 0.8 OUTLIER 42.88 40.97 2.36 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.287 -0.883 . . . . 0.0 110.288 179.955 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 72.47 27.17 70.11 Favored Glycine 0 N--CA 1.491 2.35 0 N-CA-C 109.728 -1.349 . . . . 0.0 109.728 179.964 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' SER . . . . . 0.489 ' N ' ' O ' ' A' ' 22' ' ' VAL . 13.3 m -121.06 -173.37 2.59 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.217 -1.167 . . . . 0.0 110.112 179.927 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 16.9 t -134.68 101.16 4.84 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.284 -0.885 . . . . 0.0 110.312 -179.959 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 12.3 mm100 -118.61 154.37 32.76 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.253 -0.904 . . . . 0.0 110.154 179.954 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' CYS . . . . . 0.518 ' HA ' ' CA ' ' A' ' 19' ' ' GLY . 64.0 m -139.24 168.22 20.32 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.235 -0.916 . . . . 0.0 110.095 -179.944 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.564 ' CB ' ' CE1' ' A' ' 18' ' ' PHE . 0.2 OUTLIER -128.81 154.65 46.21 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.131 -0.981 . . . . 0.0 110.419 -179.8 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -119.91 136.01 54.67 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.374 -0.828 . . . . 0.0 110.091 179.915 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 31' ' ' THR . . . . . 0.478 ' OG1' ' CB ' ' A' ' 17' ' ' ASN . 0.0 OUTLIER -111.3 165.59 11.81 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.186 -0.946 . . . . 0.0 110.131 179.96 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -149.68 -170.13 3.56 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.253 -0.904 . . . . 0.0 110.243 -179.927 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.404 0 N-CA-C 109.45 -1.46 . . . . 0.0 109.45 179.969 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.67 0 CA-C-O 121.196 0.522 . . . . 0.0 110.159 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 18.3 p -90.26 138.76 31.27 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.286 -0.884 . . . . 0.0 110.071 179.951 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 90.4 m-20 -114.6 146.26 41.02 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.185 -0.947 . . . . 0.0 110.319 -179.753 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 28.8 m-20 -64.96 -24.44 67.52 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.23 -0.919 . . . . 0.0 109.954 179.802 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.05 -54.07 12.46 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.352 -0.843 . . . . 0.0 110.274 -179.973 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 8.6 t0 -78.58 -4.66 49.93 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.356 -0.84 . . . . 0.0 109.783 179.822 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 5.1 t -95.15 -50.77 4.92 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.422 -0.799 . . . . 0.0 109.548 179.454 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 7.1 m -65.78 -39.8 91.34 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.365 -0.834 . . . . 0.0 109.906 179.633 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.409 HD23 ' HA ' ' A' ' 9' ' ' LEU . 6.5 mt -54.32 -39.24 66.85 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.193 -0.942 . . . . 0.0 110.015 179.828 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -72.25 -35.24 68.75 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.294 -0.878 . . . . 0.0 110.106 179.911 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.444 ' O ' ' HB2' ' A' ' 16' ' ' TYR . 92.0 m -66.57 -42.29 87.24 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.325 -0.859 . . . . 0.0 109.942 179.891 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 23.7 mt -67.43 -35.47 73.56 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.588 0 O-C-N 121.265 -0.897 . . . . 0.0 110.217 179.965 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 3.6 ttt -63.79 -46.33 85.69 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.232 -0.918 . . . . 0.0 110.186 179.996 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -59.19 -21.17 59.04 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.244 -0.91 . . . . 0.0 110.279 -179.941 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 115.63 7.86 15.1 Favored Glycine 0 N--CA 1.49 2.275 0 N-CA-C 109.606 -1.398 . . . . 0.0 109.606 179.849 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' TYR . . . . . 0.444 ' HB2' ' O ' ' A' ' 11' ' ' CYS . 24.7 m-85 -91.02 -159.33 0.62 Allowed 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.134 -1.215 . . . . 0.0 110.3 -179.986 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 17' ' ' ASN . . . . . 0.476 ' HB3' ' CD2' ' A' ' 18' ' ' PHE . 1.2 m120 -116.88 -70.98 0.76 Allowed 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.209 -0.932 . . . . 0.0 110.372 -179.939 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 18' ' ' PHE . . . . . 0.527 ' CE1' ' HB2' ' A' ' 29' ' ' ARG . 14.8 p90 -128.42 -177.67 4.26 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.21 -0.931 . . . . 0.0 110.274 -179.862 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -151.53 -164.84 12.46 Favored Glycine 0 N--CA 1.49 2.258 0 N-CA-C 109.332 -1.507 . . . . 0.0 109.332 179.975 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.494 ' O ' ' HA ' ' A' ' 26' ' ' CYS . 0.3 OUTLIER -162.16 147.54 12.89 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.15 -1.206 . . . . 0.0 110.3 179.989 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 21' ' ' CYS . . . . . 0.515 ' C ' HG23 ' A' ' 22' ' ' VAL . 0.8 OUTLIER -82.3 139.08 34.37 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.353 -0.842 . . . . 0.0 110.385 -179.99 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.575 HG12 ' HG3' ' A' ' 23' ' ' ARG . 15.1 t -151.57 112.25 0.46 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.607 0 O-C-N 121.303 -0.873 . . . . 0.0 110.255 -179.987 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 23' ' ' ARG . . . . . 0.575 ' HG3' HG12 ' A' ' 22' ' ' VAL . 83.7 mtt180 61.02 73.38 0.48 Allowed 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.253 -0.904 . . . . 0.0 110.347 179.974 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 24' ' ' GLY . . . . . 0.419 ' C ' ' O ' ' A' ' 23' ' ' ARG . . . 42.65 28.12 0.6 Allowed Glycine 0 N--CA 1.492 2.386 0 N-CA-C 109.611 -1.396 . . . . 0.0 109.611 179.893 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 25' ' ' SER . . . . . 0.407 ' N ' ' O ' ' A' ' 23' ' ' ARG . 0.5 OUTLIER -141.22 -163.74 1.61 Allowed 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.276 -1.132 . . . . 0.0 110.041 179.971 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 26' ' ' CYS . . . . . 0.494 ' HA ' ' O ' ' A' ' 20' ' ' LYS . 0.5 OUTLIER -167.07 142.86 4.24 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.234 -0.916 . . . . 0.0 110.171 179.917 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 6.3 mm-40 -119.84 176.18 5.53 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.387 -0.821 . . . . 0.0 110.302 -179.92 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 85.4 m -120.47 135.46 55.05 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.346 -0.846 . . . . 0.0 109.956 179.885 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.527 ' HB2' ' CE1' ' A' ' 18' ' ' PHE . 0.4 OUTLIER -120.53 150.35 40.99 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.26 -0.9 . . . . 0.0 110.395 -179.815 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 5.4 ttt180 -112.74 157.58 21.13 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.313 -0.867 . . . . 0.0 109.964 179.994 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -82.5 -148.88 0.08 Allowed 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.269 -0.894 . . . . 0.0 110.285 -179.957 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -141.29 118.44 11.31 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.256 -0.902 . . . . 0.0 110.073 -179.993 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.235 0 N-CA-C 109.484 -1.446 . . . . 0.0 109.484 179.963 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.618 0 CA-C-O 121.257 0.551 . . . . 0.0 110.204 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' CYS . . . . . 0.456 ' SG ' ' O ' ' A' ' 25' ' ' SER . 45.8 t -97.87 141.44 30.85 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.256 -0.902 . . . . 0.0 110.246 179.999 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 66.5 m-80 -116.62 140.79 49.0 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.337 -0.852 . . . . 0.0 110.113 -179.98 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' ASP . . . . . 0.407 ' O ' ' OG ' ' A' ' 8' ' ' SER . 2.8 m-20 -63.05 -13.4 35.39 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.249 -0.907 . . . . 0.0 110.096 179.994 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 0.859 ' O ' HD12 ' A' ' 9' ' ' LEU . 0.0 OUTLIER -80.89 -40.05 25.32 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.373 -0.83 . . . . 0.0 110.2 179.994 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 6' ' ' ASP . . . . . 0.415 ' O ' ' CB ' ' A' ' 10' ' ' ASP . 1.0 OUTLIER -79.62 -29.29 41.02 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.175 -0.953 . . . . 0.0 110.146 -179.958 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -76.38 -47.2 24.1 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.183 -0.948 . . . . 0.0 110.039 179.873 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 8' ' ' SER . . . . . 0.407 ' OG ' ' O ' ' A' ' 4' ' ' ASP . 7.3 m -65.85 -39.81 91.12 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.192 -0.942 . . . . 0.0 109.994 179.884 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.859 HD12 ' O ' ' A' ' 5' ' ' ARG . 4.0 mt -73.77 -36.57 65.09 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.32 -0.862 . . . . 0.0 110.164 179.775 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 10' ' ' ASP . . . . . 0.415 ' CB ' ' O ' ' A' ' 6' ' ' ASP . 36.9 t0 -76.43 -42.32 44.43 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.239 -0.913 . . . . 0.0 110.126 179.909 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.447 ' O ' ' HB2' ' A' ' 16' ' ' TYR . 93.9 m -67.28 -40.81 86.19 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.244 -0.91 . . . . 0.0 110.174 179.992 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 44.7 mt -66.23 -40.0 85.77 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.616 0 O-C-N 121.307 -0.871 . . . . 0.0 110.267 179.932 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' MET . . . . . 0.42 ' HB2' ' O ' ' A' ' 9' ' ' LEU . 2.3 ttp -68.29 -34.58 76.41 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.255 -0.903 . . . . 0.0 110.205 -179.994 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -64.05 -19.1 64.97 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.321 -0.862 . . . . 0.0 110.178 -179.991 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 15' ' ' GLY . . . . . 0.445 ' O ' ' NH1' ' A' ' 30' ' ' ARG . . . 109.91 16.42 10.7 Favored Glycine 0 N--CA 1.49 2.263 0 N-CA-C 109.662 -1.375 . . . . 0.0 109.662 -179.985 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 16' ' ' TYR . . . . . 0.459 ' HA ' ' NH1' ' A' ' 30' ' ' ARG . 31.5 m-85 -97.36 -160.92 0.83 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.311 -1.111 . . . . 0.0 110.178 -179.873 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 17' ' ' ASN . . . . . 0.551 ' ND2' ' CD2' ' A' ' 18' ' ' PHE . 9.0 t30 -119.4 -64.47 1.27 Allowed 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.237 -0.915 . . . . 0.0 110.272 -179.881 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 18' ' ' PHE . . . . . 0.594 ' CE1' ' HB3' ' A' ' 29' ' ' ARG . 6.6 p90 -143.77 145.28 32.26 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.184 -0.947 . . . . 0.0 110.289 -179.897 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 19' ' ' GLY . . . . . 0.459 ' HA3' ' HA ' ' A' ' 28' ' ' CYS . . . -132.99 -150.1 6.31 Favored Glycine 0 N--CA 1.491 2.331 0 N-CA-C 109.736 -1.345 . . . . 0.0 109.736 -179.965 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -170.66 173.52 5.36 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.185 -1.186 . . . . 0.0 110.229 -179.949 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 9.7 m -104.42 125.64 50.81 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.255 -0.903 . . . . 0.0 110.13 179.852 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.47 ' HB ' ' HB2' ' A' ' 25' ' ' SER . 9.9 t -86.81 43.12 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.633 0 O-C-N 121.2 -0.938 . . . . 0.0 110.037 179.858 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 3.4 mtm180 54.13 33.8 18.66 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.324 -0.86 . . . . 0.0 110.362 179.731 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 158.13 -19.36 0.34 Allowed Glycine 0 N--CA 1.491 2.319 0 C-N-CA 119.767 -1.206 . . . . 0.0 110.086 179.802 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' SER . . . . . 0.47 ' HB2' ' HB ' ' A' ' 22' ' ' VAL . 22.6 m -127.66 -176.55 3.79 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 120.993 -1.298 . . . . 0.0 110.681 -179.824 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 26' ' ' CYS . . . . . 0.45 ' SG ' ' SG ' ' A' ' 2' ' ' CYS . 0.1 OUTLIER -134.58 120.14 19.27 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.442 -0.787 . . . . 0.0 109.887 -179.863 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 1.8 mm-40 -118.68 167.2 11.88 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.202 -0.936 . . . . 0.0 110.494 -179.754 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' CYS . . . . . 0.459 ' HA ' ' HA3' ' A' ' 19' ' ' GLY . 17.7 m -136.52 152.05 50.1 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.206 -0.934 . . . . 0.0 109.97 179.849 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.594 ' HB3' ' CE1' ' A' ' 18' ' ' PHE . 0.0 OUTLIER -132.5 152.03 51.69 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.155 -0.966 . . . . 0.0 110.398 -179.868 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.459 ' NH1' ' HA ' ' A' ' 16' ' ' TYR . 0.0 OUTLIER -105.46 -166.18 1.19 Allowed 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.303 -0.873 . . . . 0.0 110.036 179.889 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 65.4 p -97.84 -172.71 2.44 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.192 -0.942 . . . . 0.0 110.108 179.95 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -97.34 121.48 39.28 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.111 -0.993 . . . . 0.0 110.227 -179.975 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.222 0 CA-C-O 118.017 -1.435 . . . . 0.0 109.551 -179.994 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.621 0 CA-C-O 121.245 0.545 . . . . 0.0 110.189 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' CYS . . . . . 0.439 ' HB2' ' SG ' ' A' ' 26' ' ' CYS . 23.3 p -73.96 155.3 38.78 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.276 -0.89 . . . . 0.0 110.342 -179.903 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 3' ' ' ASN . . . . . 0.455 ' O ' ' SG ' ' A' ' 7' ' ' CYS . 0.1 OUTLIER -112.6 110.22 20.25 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.159 -0.963 . . . . 0.0 110.226 179.955 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 4' ' ' ASP . . . . . 0.507 ' OD1' ' N ' ' A' ' 4' ' ' ASP . 0.8 OUTLIER -50.9 -35.46 33.11 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.291 -0.881 . . . . 0.0 110.32 -179.901 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 0.777 ' O ' HD12 ' A' ' 9' ' ' LEU . 0.1 OUTLIER -62.31 -49.04 77.19 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.201 -0.937 . . . . 0.0 110.195 -179.945 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 6' ' ' ASP . . . . . 0.466 ' O ' ' HB2' ' A' ' 10' ' ' ASP . 0.3 OUTLIER -79.2 -6.65 57.09 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.314 -0.866 . . . . 0.0 110.0 179.873 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.455 ' SG ' ' O ' ' A' ' 3' ' ' ASN . 87.4 m -89.81 -40.29 12.55 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.227 -0.921 . . . . 0.0 109.915 179.634 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 8.5 t -77.49 -39.24 47.07 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.297 -0.877 . . . . 0.0 110.082 179.693 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.777 HD12 ' O ' ' A' ' 5' ' ' ARG . 12.7 mt -72.54 -38.78 67.89 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.309 -0.869 . . . . 0.0 110.063 179.875 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 10' ' ' ASP . . . . . 0.474 ' O ' ' HG2' ' A' ' 14' ' ' LYS . 12.1 t70 -69.41 -43.21 73.87 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.293 -0.88 . . . . 0.0 109.999 179.821 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.401 ' O ' ' HB2' ' A' ' 16' ' ' TYR . 53.4 m -65.95 -40.36 91.27 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.289 -0.882 . . . . 0.0 109.733 179.82 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 27.1 mt -63.73 -32.1 55.63 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.509 0 O-C-N 121.286 -0.884 . . . . 0.0 109.494 179.411 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -65.27 -45.06 85.99 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.367 -0.833 . . . . 0.0 109.694 179.506 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 14' ' ' LYS . . . . . 0.474 ' HG2' ' O ' ' A' ' 10' ' ' ASP . 11.8 mmmm -57.61 -17.57 15.14 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.34 -0.85 . . . . 0.0 109.855 179.621 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 107.02 40.07 1.89 Allowed Glycine 0 N--CA 1.491 2.328 0 N-CA-C 109.222 -1.551 . . . . 0.0 109.222 -179.712 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' TYR . . . . . 0.401 ' HB2' ' O ' ' A' ' 11' ' ' CYS . 12.3 m-85 -121.88 -165.54 1.27 Allowed 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.346 -1.091 . . . . 0.0 110.418 -179.74 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 17' ' ' ASN . . . . . 0.589 ' HB3' ' CD2' ' A' ' 18' ' ' PHE . 2.7 m120 -98.11 -53.54 3.34 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.33 -0.856 . . . . 0.0 110.154 179.904 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 18' ' ' PHE . . . . . 0.589 ' CD2' ' HB3' ' A' ' 17' ' ' ASN . 11.0 p90 -161.27 -171.11 2.89 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.194 -0.941 . . . . 0.0 110.268 179.848 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -140.64 -179.23 17.95 Favored Glycine 0 N--CA 1.491 2.34 0 N-CA-C 109.639 -1.384 . . . . 0.0 109.639 179.985 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.43 ' O ' ' HA ' ' A' ' 26' ' ' CYS . 0.2 OUTLIER -149.41 151.17 33.59 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.254 -1.145 . . . . 0.0 110.387 179.978 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 21' ' ' CYS . . . . . 0.434 ' SG ' ' SG ' ' A' ' 26' ' ' CYS . 0.8 OUTLIER -89.88 132.49 35.26 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.228 -0.92 . . . . 0.0 110.245 -179.971 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.522 ' O ' ' CB ' ' A' ' 25' ' ' SER . 99.1 t -136.31 100.93 2.43 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.594 0 O-C-N 121.271 -0.893 . . . . 0.0 110.317 -179.941 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 50.92 80.3 0.08 Allowed 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.266 -0.896 . . . . 0.0 110.431 179.843 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 47.78 23.71 2.55 Favored Glycine 0 N--CA 1.49 2.278 0 N-CA-C 109.696 -1.362 . . . . 0.0 109.696 179.866 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' SER . . . . . 0.522 ' CB ' ' O ' ' A' ' 22' ' ' VAL . 1.2 t -127.16 173.67 9.53 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.217 -1.167 . . . . 0.0 110.137 179.968 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 26' ' ' CYS . . . . . 0.439 ' SG ' ' HB2' ' A' ' 2' ' ' CYS . 0.0 OUTLIER -158.47 123.57 4.32 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.227 -0.921 . . . . 0.0 110.318 179.919 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 25.1 mm-40 -120.28 -175.06 2.92 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.223 -0.923 . . . . 0.0 110.34 179.878 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 56.8 m -119.99 145.66 46.59 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.214 -0.929 . . . . 0.0 110.123 179.931 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.565 ' CB ' ' CE1' ' A' ' 18' ' ' PHE . 0.4 OUTLIER -126.99 165.04 20.17 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.167 -0.958 . . . . 0.0 110.141 -179.905 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -112.7 -157.16 0.61 Allowed 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.25 -0.906 . . . . 0.0 110.23 -179.979 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 31' ' ' THR . . . . . 0.53 HG23 ' CG ' ' A' ' 17' ' ' ASN . 0.3 OUTLIER -114.64 -174.97 2.58 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.279 -0.888 . . . . 0.0 110.229 -179.992 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -100.85 -179.64 4.12 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.176 -0.953 . . . . 0.0 110.207 179.971 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.389 0 CA-C-O 117.968 -1.462 . . . . 0.0 109.573 -179.992 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.616 0 CA-C-O 121.254 0.55 . . . . 0.0 110.265 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' CYS . . . . . 0.439 ' SG ' ' O ' ' A' ' 25' ' ' SER . 6.5 t -88.33 120.36 29.62 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.238 -0.914 . . . . 0.0 110.171 179.986 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 2.8 m-80 -110.13 140.21 44.46 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.296 -0.878 . . . . 0.0 110.195 179.962 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -51.13 -43.44 61.17 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.203 -0.936 . . . . 0.0 110.182 -179.945 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 21.6 mtp180 -72.74 -42.81 63.69 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.253 -0.904 . . . . 0.0 110.203 179.998 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 1.3 t0 -79.92 3.93 18.36 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.36 -0.838 . . . . 0.0 110.154 179.964 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 8.6 t -107.21 -31.85 8.05 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.214 -0.929 . . . . 0.0 110.222 -179.966 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' SER . . . . . 0.447 ' O ' HG13 ' A' ' 12' ' ' ILE . 36.7 t -93.12 -31.19 14.9 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.267 -0.895 . . . . 0.0 110.218 179.941 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.402 HD23 ' HA ' ' A' ' 9' ' ' LEU . 34.5 mt -57.2 -57.83 10.88 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.176 -0.953 . . . . 0.0 110.139 -179.992 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -62.7 -38.54 90.82 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.33 -0.856 . . . . 0.0 110.237 -179.997 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -66.21 -38.32 87.68 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.246 -0.909 . . . . 0.0 110.02 -179.984 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 12' ' ' ILE . . . . . 0.447 HG13 ' O ' ' A' ' 8' ' ' SER . 11.0 mt -63.94 -34.3 67.51 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.549 0 O-C-N 121.292 -0.88 . . . . 0.0 109.669 179.587 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 36.9 mtt -67.9 -38.86 83.49 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.411 -0.806 . . . . 0.0 110.068 179.68 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 33.8 mtmt -55.07 -33.28 62.62 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.303 -0.873 . . . . 0.0 110.378 -179.882 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 130.69 2.07 4.92 Favored Glycine 0 N--CA 1.491 2.31 0 N-CA-C 109.871 -1.291 . . . . 0.0 109.871 179.948 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 81.2 m-85 -79.41 -178.02 6.05 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.063 -1.257 . . . . 0.0 110.214 -179.96 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' ASN . . . . . 0.484 ' HB3' ' CD2' ' A' ' 18' ' ' PHE . 4.4 t30 -103.73 -66.09 0.97 Allowed 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.287 -0.883 . . . . 0.0 110.272 -179.976 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 18' ' ' PHE . . . . . 0.53 ' CE1' ' HB2' ' A' ' 29' ' ' ARG . 7.2 p90 -138.58 159.07 43.0 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.164 -0.96 . . . . 0.0 110.387 -179.958 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 19' ' ' GLY . . . . . 0.523 ' CA ' ' HA ' ' A' ' 28' ' ' CYS . . . -156.64 172.35 34.33 Favored Glycine 0 N--CA 1.489 2.22 0 N-CA-C 109.816 -1.314 . . . . 0.0 109.816 179.992 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -143.2 166.8 23.71 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.333 -1.098 . . . . 0.0 110.14 179.923 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 21' ' ' CYS . . . . . 0.505 ' HA ' ' O ' ' A' ' 25' ' ' SER . 47.0 t -98.94 116.04 30.27 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.222 -0.924 . . . . 0.0 110.079 179.863 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.595 ' O ' HG12 ' A' ' 22' ' ' VAL . 41.1 t -80.22 82.86 1.25 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.676 0 O-C-N 121.155 -0.965 . . . . 0.0 110.085 -179.933 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 61.73 -77.03 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.298 -0.876 . . . . 0.0 109.895 -179.927 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 24' ' ' GLY . . . . . 0.519 ' N ' ' O ' ' A' ' 22' ' ' VAL . . . -127.24 39.32 1.97 Allowed Glycine 0 N--CA 1.489 2.183 0 N-CA-C 109.285 -1.526 . . . . 0.0 109.285 179.711 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 25' ' ' SER . . . . . 0.505 ' O ' ' HA ' ' A' ' 21' ' ' CYS . 0.3 OUTLIER -147.01 172.97 12.9 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.326 -1.102 . . . . 0.0 110.039 -179.951 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 49.3 t -134.85 98.31 3.99 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.201 -0.937 . . . . 0.0 110.248 -179.884 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.408 ' C ' ' SG ' ' A' ' 28' ' ' CYS . 4.6 mm-40 -105.43 157.99 16.97 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.292 -0.88 . . . . 0.0 109.915 179.943 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 28' ' ' CYS . . . . . 0.523 ' HA ' ' CA ' ' A' ' 19' ' ' GLY . 34.3 m -142.65 170.72 15.17 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.079 -1.013 . . . . 0.0 110.541 -179.803 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.53 ' HB2' ' CE1' ' A' ' 18' ' ' PHE . 27.9 mmt180 -142.1 164.72 29.41 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.388 -0.82 . . . . 0.0 110.304 -179.75 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 54.3 mtp180 -112.46 -166.95 1.12 Allowed 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.282 -0.886 . . . . 0.0 110.139 179.973 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 2.0 p -95.5 -166.06 1.39 Allowed 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.268 -0.895 . . . . 0.0 110.246 -179.968 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 3.3 p -102.8 88.11 3.12 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.318 -0.864 . . . . 0.0 110.192 -179.89 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.338 0 CA-C-O 117.887 -1.507 . . . . 0.0 109.536 179.984 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.614 0 CA-C-O 121.199 0.523 . . . . 0.0 110.058 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' CYS . . . . . 0.471 ' HA ' ' HB2' ' A' ' 26' ' ' CYS . 12.1 t -96.67 89.8 5.08 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.29 -0.881 . . . . 0.0 110.288 -179.976 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 3' ' ' ASN . . . . . 0.41 ' O ' ' N ' ' A' ' 7' ' ' CYS . 1.4 m-20 -145.92 131.57 18.89 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.215 -0.928 . . . . 0.0 110.11 179.861 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 4' ' ' ASP . . . . . 0.425 ' O ' ' OG ' ' A' ' 8' ' ' SER . 65.6 m-20 -50.87 -37.25 42.31 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.219 -0.926 . . . . 0.0 110.259 179.997 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 0.461 ' O ' ' HB2' ' A' ' 9' ' ' LEU . 0.0 OUTLIER -73.44 -41.54 63.1 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.307 -0.871 . . . . 0.0 110.147 179.999 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 33.8 m-20 -80.0 -22.75 42.11 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.227 -0.921 . . . . 0.0 110.308 -179.944 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.41 ' N ' ' O ' ' A' ' 3' ' ' ASN . 41.4 m -76.36 -36.24 58.28 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.395 -0.816 . . . . 0.0 110.091 -179.914 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 8' ' ' SER . . . . . 0.427 ' O ' HG13 ' A' ' 12' ' ' ILE . 0.7 OUTLIER -85.02 -33.69 22.48 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.242 -0.912 . . . . 0.0 110.517 -179.703 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.461 ' HB2' ' O ' ' A' ' 5' ' ' ARG . 0.7 OUTLIER -71.59 -52.95 15.43 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.173 -0.954 . . . . 0.0 110.322 -179.838 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 10' ' ' ASP . . . . . 0.401 ' O ' ' HG3' ' A' ' 14' ' ' LYS . 2.3 t0 -62.69 -24.71 67.79 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.193 -0.942 . . . . 0.0 110.147 179.899 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.402 ' SG ' ' O ' ' A' ' 7' ' ' CYS . 3.6 m -78.96 -45.65 19.94 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.185 -0.947 . . . . 0.0 110.287 -179.986 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 12' ' ' ILE . . . . . 0.427 HG13 ' O ' ' A' ' 8' ' ' SER . 64.2 mt -63.57 -30.25 49.36 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.626 0 O-C-N 121.123 -0.985 . . . . 0.0 110.222 179.991 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 13' ' ' MET . . . . . 0.451 ' HG3' ' O ' ' A' ' 9' ' ' LEU . 11.9 mtp -84.24 -27.35 28.0 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.272 -0.893 . . . . 0.0 110.178 179.832 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 14' ' ' LYS . . . . . 0.401 ' HG3' ' O ' ' A' ' 10' ' ' ASP . 0.1 OUTLIER -78.93 -27.17 43.68 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.254 -0.904 . . . . 0.0 110.29 179.942 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 121.88 17.69 3.73 Favored Glycine 0 N--CA 1.492 2.415 0 N-CA-C 109.634 -1.387 . . . . 0.0 109.634 179.87 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' TYR . . . . . 0.473 ' HB3' ' SG ' ' A' ' 28' ' ' CYS . 45.0 m-85 -100.22 -170.45 1.87 Allowed 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.242 -1.152 . . . . 0.0 110.263 -179.99 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 17' ' ' ASN . . . . . 0.568 ' HB3' ' CD2' ' A' ' 18' ' ' PHE . 2.4 m120 -122.54 -56.92 1.77 Allowed 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.274 -0.891 . . . . 0.0 110.241 179.929 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 18' ' ' PHE . . . . . 0.58 ' CE1' ' HB3' ' A' ' 29' ' ' ARG . 11.6 p90 -147.33 153.88 40.23 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.188 -0.945 . . . . 0.0 110.186 -179.922 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 19' ' ' GLY . . . . . 0.539 ' CA ' ' HA ' ' A' ' 28' ' ' CYS . . . -136.74 -146.86 5.24 Favored Glycine 0 N--CA 1.492 2.367 0 N-CA-C 109.745 -1.342 . . . . 0.0 109.745 -179.924 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 175.04 141.99 0.05 Allowed 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.27 -1.135 . . . . 0.0 110.209 -179.957 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 21' ' ' CYS . . . . . 0.489 ' HA ' ' O ' ' A' ' 25' ' ' SER . 0.1 OUTLIER -97.04 125.61 41.61 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.203 -0.935 . . . . 0.0 110.456 -179.868 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.642 ' O ' HG12 ' A' ' 22' ' ' VAL . 60.7 t -94.39 45.47 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.564 0 O-C-N 121.348 -0.845 . . . . 0.0 109.964 179.812 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 61.32 84.85 0.13 Allowed 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.321 -0.862 . . . . 0.0 110.384 -179.96 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 103.63 -20.17 42.59 Favored Glycine 0 N--CA 1.491 2.34 0 N-CA-C 109.782 -1.327 . . . . 0.0 109.782 179.756 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' SER . . . . . 0.489 ' O ' ' HA ' ' A' ' 21' ' ' CYS . 3.0 t -132.2 162.21 31.5 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.122 -1.222 . . . . 0.0 110.33 -179.875 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 26' ' ' CYS . . . . . 0.471 ' HB2' ' HA ' ' A' ' 2' ' ' CYS . 18.2 t -138.7 123.34 18.58 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.288 -0.883 . . . . 0.0 110.426 -179.926 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 76.9 mt-30 -108.74 175.2 5.55 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.344 -0.847 . . . . 0.0 110.085 179.872 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' CYS . . . . . 0.539 ' HA ' ' CA ' ' A' ' 19' ' ' GLY . 6.9 t -148.68 156.4 42.33 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.298 -0.876 . . . . 0.0 110.431 -179.856 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.58 ' HB3' ' CE1' ' A' ' 18' ' ' PHE . 6.2 mmm-85 -144.53 137.14 26.62 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.244 -0.91 . . . . 0.0 110.215 179.903 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.458 ' HG3' ' CD2' ' A' ' 16' ' ' TYR . 1.7 mpp_? -89.24 -160.84 0.71 Allowed 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.302 -0.874 . . . . 0.0 110.177 -179.958 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 31' ' ' THR . . . . . 0.539 HG23 ' ND2' ' A' ' 17' ' ' ASN . 0.0 OUTLIER -106.95 171.6 7.28 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.23 -0.919 . . . . 0.0 110.201 179.932 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -163.42 -86.7 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.213 -0.93 . . . . 0.0 110.174 -179.976 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.313 0 N-CA-C 109.461 -1.455 . . . . 0.0 109.461 -179.951 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.608 0 CA-C-O 121.161 0.505 . . . . 0.0 110.165 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' CYS . . . . . 0.478 ' O ' ' HB2' ' A' ' 21' ' ' CYS . 17.7 p -92.15 37.52 0.99 Allowed 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.185 -0.947 . . . . 0.0 110.182 179.933 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 3' ' ' ASN . . . . . 0.417 ' OD1' ' O ' ' A' ' 3' ' ' ASN . 53.2 p-10 -51.98 154.89 2.0 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.178 -0.951 . . . . 0.0 110.132 179.994 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 4' ' ' ASP . . . . . 0.484 ' OD2' ' HG2' ' A' ' 20' ' ' LYS . 0.6 OUTLIER -65.23 -15.93 62.99 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.358 -0.839 . . . . 0.0 110.385 -179.798 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 0.405 ' HB3' ' ND2' ' A' ' 3' ' ' ASN . 0.0 OUTLIER -75.33 -54.45 7.06 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.271 -0.893 . . . . 0.0 110.522 -179.788 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 2.1 t0 -79.77 -25.85 40.85 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.255 -0.903 . . . . 0.0 110.674 -179.683 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.4 ' O ' ' SG ' ' A' ' 11' ' ' CYS . 30.9 t -76.76 -33.83 58.06 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.204 -0.935 . . . . 0.0 110.25 -179.868 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 8' ' ' SER . . . . . 0.451 ' HB3' ' O ' ' A' ' 4' ' ' ASP . 22.7 p -79.58 -43.19 23.43 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.182 -0.949 . . . . 0.0 110.317 179.939 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -53.49 -42.04 66.87 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.258 -0.901 . . . . 0.0 110.203 -179.982 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 3.3 t70 -63.45 -27.19 69.11 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.298 -0.876 . . . . 0.0 110.097 179.733 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.4 ' SG ' ' O ' ' A' ' 7' ' ' CYS . 79.4 m -71.51 -41.4 69.3 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.271 -0.893 . . . . 0.0 110.107 -179.983 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 36.1 mt -63.65 -45.62 96.98 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.576 0 O-C-N 121.316 -0.865 . . . . 0.0 110.034 179.851 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 1.2 ttp -64.28 -31.42 72.62 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.243 -0.911 . . . . 0.0 109.98 179.767 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.47 -32.16 66.01 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.34 -0.85 . . . . 0.0 110.152 -179.945 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 137.3 -7.41 3.71 Favored Glycine 0 N--CA 1.491 2.323 0 N-CA-C 109.509 -1.436 . . . . 0.0 109.509 -179.904 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 26.2 m-85 -87.89 -170.12 2.86 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.321 -1.105 . . . . 0.0 110.15 -179.888 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 35.2 t-20 -120.61 -40.81 2.63 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.333 -0.854 . . . . 0.0 110.237 179.864 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' PHE . . . . . 0.605 ' CE2' ' CB ' ' A' ' 29' ' ' ARG . 38.4 p90 -146.58 146.96 30.64 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.342 -0.849 . . . . 0.0 110.193 179.829 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 19' ' ' GLY . . . . . 0.435 ' CA ' ' HA ' ' A' ' 28' ' ' CYS . . . -137.34 -173.01 12.73 Favored Glycine 0 N--CA 1.491 2.302 0 N-CA-C 109.524 -1.43 . . . . 0.0 109.524 -179.937 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.484 ' HG2' ' OD2' ' A' ' 4' ' ' ASP . 0.0 OUTLIER -161.96 159.25 26.32 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.191 -1.182 . . . . 0.0 110.258 179.963 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 21' ' ' CYS . . . . . 0.488 ' HA ' ' O ' ' A' ' 25' ' ' SER . 40.7 t -87.43 139.47 30.52 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.29 -0.881 . . . . 0.0 110.018 -179.977 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.49 ' HB ' ' HB2' ' A' ' 25' ' ' SER . 43.0 t -117.89 92.49 2.15 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.684 0 O-C-N 121.154 -0.966 . . . . 0.0 110.679 -179.8 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER 50.66 53.87 12.2 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.477 -0.764 . . . . 0.0 111.108 179.328 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 89.97 15.98 56.86 Favored Glycine 0 N--CA 1.491 2.345 0 C-N-CA 119.886 -1.15 . . . . 0.0 110.312 179.205 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' SER . . . . . 0.49 ' HB2' ' HB ' ' A' ' 22' ' ' VAL . 1.1 m -122.04 178.99 4.67 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.006 -1.29 . . . . 0.0 110.134 179.719 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 46.0 t -145.75 95.03 2.58 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.258 -0.901 . . . . 0.0 110.32 -179.911 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -105.64 178.42 4.57 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.333 -0.855 . . . . 0.0 110.195 179.83 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 28' ' ' CYS . . . . . 0.435 ' HA ' ' CA ' ' A' ' 19' ' ' GLY . 82.0 m -134.69 150.33 50.6 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.259 -0.901 . . . . 0.0 110.284 -179.962 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.605 ' CB ' ' CE2' ' A' ' 18' ' ' PHE . 10.1 mtt180 -122.59 146.37 47.49 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.259 -0.901 . . . . 0.0 110.1 -179.972 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.444 ' O ' ' CZ ' ' A' ' 18' ' ' PHE . 0.0 OUTLIER -95.3 174.13 7.19 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.217 -0.927 . . . . 0.0 110.19 179.985 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 30.0 p -77.96 -164.17 0.49 Allowed 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.36 -0.837 . . . . 0.0 110.126 -179.963 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 69.0 p -145.49 48.6 1.26 Allowed 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.178 -0.951 . . . . 0.0 110.173 -179.94 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.193 0 CA-C-O 118.014 -1.437 . . . . 0.0 109.618 179.95 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.617 0 CA-C-O 121.322 0.582 . . . . 0.0 110.17 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' CYS . . . . . 0.446 ' HB3' ' HB3' ' A' ' 21' ' ' CYS . 48.9 t -82.57 120.86 26.06 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.222 -0.924 . . . . 0.0 110.257 179.968 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 2.6 m-20 -82.41 139.34 34.08 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.197 -0.939 . . . . 0.0 110.24 179.941 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 46.7 m-20 -66.85 -30.92 71.22 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.195 -0.941 . . . . 0.0 110.118 179.912 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 0.525 ' O ' HD12 ' A' ' 9' ' ' LEU . 6.5 mtp180 -75.98 -41.84 50.12 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.277 -0.89 . . . . 0.0 110.098 179.868 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -79.64 -23.04 42.84 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.253 -0.904 . . . . 0.0 110.323 179.967 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 46.7 t -78.75 -38.06 39.71 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.21 -0.931 . . . . 0.0 110.145 179.877 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 38.1 t -75.06 -42.05 57.72 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.245 -0.909 . . . . 0.0 110.079 179.879 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.525 HD12 ' O ' ' A' ' 5' ' ' ARG . 61.5 mt -53.86 -47.02 71.42 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.306 -0.871 . . . . 0.0 110.292 -179.963 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 10' ' ' ASP . . . . . 0.487 ' O ' ' HG3' ' A' ' 14' ' ' LYS . 5.5 m-20 -62.66 -38.82 91.83 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.272 -0.893 . . . . 0.0 110.108 179.959 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.449 ' O ' ' HB2' ' A' ' 16' ' ' TYR . 87.5 m -66.69 -39.13 87.97 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.285 -0.885 . . . . 0.0 110.042 179.94 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 12' ' ' ILE . . . . . 0.414 HG21 HD13 ' A' ' 12' ' ' ILE . 17.1 mt -63.67 -33.23 60.43 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.633 0 O-C-N 121.356 -0.84 . . . . 0.0 110.187 -179.865 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 13' ' ' MET . . . . . 0.446 ' HA ' ' CE ' ' A' ' 13' ' ' MET . 0.3 OUTLIER -71.28 -39.94 71.21 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.321 -0.862 . . . . 0.0 110.198 -179.977 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 14' ' ' LYS . . . . . 0.487 ' HG3' ' O ' ' A' ' 10' ' ' ASP . 1.1 mtmm -59.42 -14.58 12.72 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.126 -0.984 . . . . 0.0 110.218 -179.852 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 108.2 11.86 23.05 Favored Glycine 0 N--CA 1.49 2.262 0 N-CA-C 109.452 -1.459 . . . . 0.0 109.452 -179.931 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' TYR . . . . . 0.449 ' HB2' ' O ' ' A' ' 11' ' ' CYS . 5.8 m-85 -93.69 -165.08 1.26 Allowed 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.209 -1.171 . . . . 0.0 110.202 179.953 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -113.56 -62.12 1.64 Allowed 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.32 -0.863 . . . . 0.0 109.907 179.888 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 18' ' ' PHE . . . . . 0.527 ' CE2' HG23 ' A' ' 31' ' ' THR . 1.0 OUTLIER -133.09 159.97 38.54 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.36 -0.837 . . . . 0.0 110.017 179.777 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -137.46 173.61 22.19 Favored Glycine 0 N--CA 1.491 2.306 0 N-CA-C 109.638 -1.385 . . . . 0.0 109.638 -179.799 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 19.3 ttpt -153.35 144.92 23.31 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.278 -1.13 . . . . 0.0 110.0 -179.919 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' CYS . . . . . 0.496 ' C ' HG23 ' A' ' 22' ' ' VAL . 83.5 m -84.1 153.75 23.57 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.248 -0.907 . . . . 0.0 110.323 -179.93 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.538 ' O ' ' CG ' ' A' ' 23' ' ' ARG . 58.1 t -150.16 145.52 17.14 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.557 0 O-C-N 121.279 -0.888 . . . . 0.0 110.155 179.947 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 23' ' ' ARG . . . . . 0.538 ' CG ' ' O ' ' A' ' 22' ' ' VAL . 16.1 ptt180 38.22 33.46 0.06 Allowed 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.632 -0.667 . . . . 0.0 110.697 179.998 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 24' ' ' GLY . . . . . 0.408 ' N ' ' O ' ' A' ' 22' ' ' VAL . . . 79.91 37.55 22.13 Favored Glycine 0 N--CA 1.489 2.231 0 N-CA-C 109.523 -1.431 . . . . 0.0 109.523 -179.938 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 25' ' ' SER . . . . . 0.485 ' N ' ' O ' ' A' ' 22' ' ' VAL . 7.7 t -138.05 -168.85 2.44 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.268 -1.136 . . . . 0.0 110.173 179.999 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 26' ' ' CYS . . . . . 0.442 ' HB2' ' SG ' ' A' ' 2' ' ' CYS . 49.4 t -141.15 120.16 12.8 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.26 -0.9 . . . . 0.0 110.265 -179.959 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 24.6 mt-30 -118.75 166.15 13.13 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.232 -0.918 . . . . 0.0 110.208 -179.988 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 18.1 m -128.81 148.59 50.89 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.255 -0.903 . . . . 0.0 110.091 -179.904 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.492 ' HB2' ' CE1' ' A' ' 18' ' ' PHE . 8.4 mmm-85 -129.02 168.02 16.65 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.182 -0.949 . . . . 0.0 110.299 179.969 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 15.2 mtm180 -116.29 -177.65 3.22 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.334 -0.854 . . . . 0.0 110.331 -179.987 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' THR . . . . . 0.527 HG23 ' CE2' ' A' ' 18' ' ' PHE . 0.0 OUTLIER -114.92 160.98 18.89 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.334 -0.854 . . . . 0.0 110.202 179.973 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -142.03 -51.82 0.41 Allowed 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.275 -0.891 . . . . 0.0 110.161 -179.961 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.27 0 CA-C-O 117.968 -1.462 . . . . 0.0 109.531 -179.919 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.623 0 CA-C-O 121.221 0.534 . . . . 0.0 110.175 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 16.3 p -100.67 142.21 32.47 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.172 -0.955 . . . . 0.0 110.195 179.927 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 6.2 m120 -100.32 128.05 46.48 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.142 -0.974 . . . . 0.0 110.305 -179.889 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -66.41 -48.56 69.67 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.306 -0.871 . . . . 0.0 110.044 179.909 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 0.766 ' O ' HD12 ' A' ' 9' ' ' LEU . 1.5 ttt85 -62.53 -35.89 80.87 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.295 -0.878 . . . . 0.0 109.723 179.701 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 1.9 t0 -79.53 -20.97 45.83 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.357 -0.839 . . . . 0.0 109.563 179.47 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.423 ' O ' ' HB2' ' A' ' 11' ' ' CYS . 7.5 t -80.34 -45.71 17.33 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.432 -0.793 . . . . 0.0 109.874 179.639 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 8' ' ' SER . . . . . 0.688 ' O ' HD12 ' A' ' 12' ' ' ILE . 0.4 OUTLIER -68.35 -44.28 75.58 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.428 -0.795 . . . . 0.0 110.207 -179.971 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.766 HD12 ' O ' ' A' ' 5' ' ' ARG . 0.2 OUTLIER -53.99 -43.43 69.99 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.272 -0.893 . . . . 0.0 110.023 179.939 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 10' ' ' ASP . . . . . 0.474 ' O ' ' HG3' ' A' ' 14' ' ' LYS . 11.5 t0 -74.02 -43.5 57.75 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.319 -0.863 . . . . 0.0 110.255 179.953 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.423 ' HB2' ' O ' ' A' ' 7' ' ' CYS . 0.0 OUTLIER -66.48 -39.95 89.04 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.166 -0.959 . . . . 0.0 110.433 -179.779 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 12' ' ' ILE . . . . . 0.688 HD12 ' O ' ' A' ' 8' ' ' SER . 14.3 mt -63.4 -47.05 93.65 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.672 0 O-C-N 121.141 -0.975 . . . . 0.0 110.034 179.962 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -64.41 -25.32 67.97 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.156 -0.965 . . . . 0.0 109.83 179.719 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 14' ' ' LYS . . . . . 0.474 ' HG3' ' O ' ' A' ' 10' ' ' ASP . 3.4 mttt -73.29 -36.75 66.36 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.293 -0.879 . . . . 0.0 110.151 179.78 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 147.47 -13.78 1.4 Allowed Glycine 0 N--CA 1.491 2.349 0 N-CA-C 109.666 -1.374 . . . . 0.0 109.666 179.941 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' TYR . . . . . 0.474 ' CE2' ' HD2' ' A' ' 30' ' ' ARG . 85.6 m-85 -74.05 -168.7 0.65 Allowed 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.117 -1.225 . . . . 0.0 110.299 179.997 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 17' ' ' ASN . . . . . 0.573 ' HB3' ' CD2' ' A' ' 18' ' ' PHE . 0.7 OUTLIER -132.12 -53.06 0.97 Allowed 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.193 -0.942 . . . . 0.0 110.339 -179.967 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 18' ' ' PHE . . . . . 0.605 ' CE1' ' HB2' ' A' ' 29' ' ' ARG . 9.4 p90 -141.62 152.82 44.33 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.138 -0.977 . . . . 0.0 110.428 179.928 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -148.72 -152.18 5.65 Favored Glycine 0 N--CA 1.489 2.222 0 N-CA-C 109.565 -1.414 . . . . 0.0 109.565 179.977 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.496 ' O ' ' HA ' ' A' ' 26' ' ' CYS . 0.0 OUTLIER -174.18 149.42 1.42 Allowed 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.267 -1.137 . . . . 0.0 110.096 -179.989 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -90.14 129.04 36.47 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.258 -0.901 . . . . 0.0 110.322 179.977 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.456 ' O ' ' HB2' ' A' ' 23' ' ' ARG . 54.0 t -111.08 94.1 2.91 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.58 0 O-C-N 121.264 -0.898 . . . . 0.0 110.33 -179.955 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 23' ' ' ARG . . . . . 0.456 ' HB2' ' O ' ' A' ' 22' ' ' VAL . 5.4 mtt-85 61.32 -88.67 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.328 -0.858 . . . . 0.0 110.506 179.863 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -119.94 24.21 7.97 Favored Glycine 0 N--CA 1.489 2.197 0 N-CA-C 109.784 -1.327 . . . . 0.0 109.784 -179.703 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' SER . . . . . 0.453 ' O ' ' N ' ' A' ' 22' ' ' VAL . 0.3 OUTLIER -147.98 -174.54 4.59 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.165 -1.197 . . . . 0.0 110.076 179.856 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 26' ' ' CYS . . . . . 0.496 ' HA ' ' O ' ' A' ' 20' ' ' LYS . 9.2 t -149.67 150.7 32.54 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.257 -0.902 . . . . 0.0 110.48 179.942 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.43 ' O ' ' SG ' ' A' ' 28' ' ' CYS . 36.0 mt-30 -113.5 175.25 5.53 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.381 -0.824 . . . . 0.0 109.763 179.64 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 28' ' ' CYS . . . . . 0.43 ' SG ' ' O ' ' A' ' 27' ' ' GLN . 7.5 m -155.66 141.4 18.0 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.214 -0.929 . . . . 0.0 110.339 -179.883 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.605 ' HB2' ' CE1' ' A' ' 18' ' ' PHE . 1.0 OUTLIER -134.1 137.63 44.71 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.31 -0.869 . . . . 0.0 110.109 -179.974 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.474 ' HD2' ' CE2' ' A' ' 16' ' ' TYR . 0.4 OUTLIER -100.22 174.8 5.97 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.299 -0.876 . . . . 0.0 110.415 -179.811 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 22.1 p -97.5 138.47 34.88 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.343 -0.848 . . . . 0.0 110.158 179.972 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 3.2 m -112.26 27.06 9.98 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.212 -0.93 . . . . 0.0 110.24 -179.985 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.267 0 N-CA-C 109.5 -1.44 . . . . 0.0 109.5 179.92 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.577 0 CA-C-O 121.295 0.569 . . . . 0.0 110.194 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' CYS . . . . . 0.445 ' SG ' ' HB2' ' A' ' 26' ' ' CYS . 39.6 t -97.98 116.96 31.25 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.202 -0.937 . . . . 0.0 110.124 179.943 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 10.8 m120 -83.56 115.15 21.98 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.308 -0.87 . . . . 0.0 110.136 179.96 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -58.03 -21.74 46.57 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.267 -0.896 . . . . 0.0 110.147 179.96 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 0.451 ' O ' HD12 ' A' ' 9' ' ' LEU . 0.0 OUTLIER -78.51 -45.62 21.54 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.21 -0.931 . . . . 0.0 110.097 179.975 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 21.0 m-20 -79.03 -18.41 53.6 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.244 -0.91 . . . . 0.0 109.818 179.791 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.477 ' O ' ' HB2' ' A' ' 11' ' ' CYS . 8.1 t -78.37 -54.08 6.58 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.345 -0.847 . . . . 0.0 109.947 179.801 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 8' ' ' SER . . . . . 0.44 ' O ' HG13 ' A' ' 12' ' ' ILE . 0.3 OUTLIER -64.58 -42.03 95.88 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.288 -0.882 . . . . 0.0 110.133 179.932 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.451 HD12 ' O ' ' A' ' 5' ' ' ARG . 0.3 OUTLIER -54.05 -51.85 62.73 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.146 -0.971 . . . . 0.0 110.231 -179.997 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 2.4 t0 -69.36 -38.77 78.24 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.278 -0.889 . . . . 0.0 110.417 -179.923 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.477 ' HB2' ' O ' ' A' ' 7' ' ' CYS . 0.1 OUTLIER -66.58 -39.79 88.62 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.159 -0.963 . . . . 0.0 110.132 -179.957 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 12' ' ' ILE . . . . . 0.44 HG13 ' O ' ' A' ' 8' ' ' SER . 15.5 mt -63.63 -38.72 83.0 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.563 0 O-C-N 121.278 -0.889 . . . . 0.0 109.833 179.87 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 2.6 mmm -69.87 -28.87 66.01 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.271 -0.893 . . . . 0.0 109.999 179.715 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -67.15 -32.06 72.91 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.255 -0.903 . . . . 0.0 110.205 179.836 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 138.25 -7.51 3.44 Favored Glycine 0 N--CA 1.491 2.313 0 N-CA-C 109.581 -1.408 . . . . 0.0 109.581 -179.823 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 97.2 m-85 -80.09 -163.73 0.59 Allowed 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.135 -1.215 . . . . 0.0 110.242 179.914 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' ASN . . . . . 0.589 ' HB3' ' CD2' ' A' ' 18' ' ' PHE . 0.7 OUTLIER -133.11 -63.31 0.77 Allowed 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.297 -0.877 . . . . 0.0 110.203 179.871 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 18' ' ' PHE . . . . . 0.596 ' CE1' ' HB2' ' A' ' 29' ' ' ARG . 5.4 p90 -133.89 145.75 49.92 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.12 -0.988 . . . . 0.0 110.38 179.78 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 19' ' ' GLY . . . . . 0.471 ' CA ' ' HA ' ' A' ' 28' ' ' CYS . . . -140.29 -150.51 5.47 Favored Glycine 0 N--CA 1.489 2.219 0 N-CA-C 109.529 -1.428 . . . . 0.0 109.529 -179.973 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 4.1 tttm -173.61 152.97 2.18 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.179 -1.189 . . . . 0.0 110.265 179.932 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' CYS . . . . . 0.433 ' SG ' ' SG ' ' A' ' 26' ' ' CYS . 22.1 m -91.31 144.27 25.78 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.346 -0.846 . . . . 0.0 110.315 179.969 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.419 ' O ' ' HB2' ' A' ' 23' ' ' ARG . 39.2 t -139.25 115.73 9.92 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.67 0 O-C-N 121.323 -0.86 . . . . 0.0 110.159 179.919 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 23' ' ' ARG . . . . . 0.419 ' HB2' ' O ' ' A' ' 22' ' ' VAL . 0.1 OUTLIER 56.31 -92.85 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.344 -0.848 . . . . 0.0 110.3 179.939 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -131.65 23.62 4.21 Favored Glycine 0 N--CA 1.49 2.238 0 N-CA-C 109.456 -1.457 . . . . 0.0 109.456 -179.955 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 4.0 t -142.34 172.47 12.65 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.226 -1.161 . . . . 0.0 109.931 179.872 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' CYS . . . . . 0.445 ' HB2' ' SG ' ' A' ' 2' ' ' CYS . 1.0 OUTLIER -138.46 145.37 40.8 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.084 -1.01 . . . . 0.0 110.837 -179.749 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.464 ' O ' ' HA3' ' A' ' 19' ' ' GLY . 14.1 mm-40 -119.97 170.18 9.5 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.34 -0.85 . . . . 0.0 109.791 179.572 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 28' ' ' CYS . . . . . 0.471 ' HA ' ' CA ' ' A' ' 19' ' ' GLY . 96.6 m -150.4 157.93 43.59 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.076 -1.015 . . . . 0.0 110.452 -179.949 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.596 ' HB2' ' CE1' ' A' ' 18' ' ' PHE . 9.7 mtp180 -128.96 159.59 35.38 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.207 -0.933 . . . . 0.0 110.395 179.967 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -107.48 154.78 20.86 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.205 -0.935 . . . . 0.0 110.143 179.866 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 31' ' ' THR . . . . . 0.519 ' CG2' ' OD1' ' A' ' 17' ' ' ASN . 44.0 p -79.57 -170.63 2.43 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.203 -0.936 . . . . 0.0 110.106 -179.986 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 2.8 m -104.55 -163.02 0.93 Allowed 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.334 -0.854 . . . . 0.0 110.205 179.936 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.344 0 N-CA-C 109.456 -1.458 . . . . 0.0 109.456 -179.997 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.576 0 CA-C-O 121.245 0.545 . . . . 0.0 110.209 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' CYS . . . . . 0.439 ' O ' ' CB ' ' A' ' 3' ' ' ASN . 16.4 p -93.74 11.8 27.85 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.344 -0.847 . . . . 0.0 110.025 -179.965 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 3' ' ' ASN . . . . . 0.439 ' CB ' ' O ' ' A' ' 2' ' ' CYS . 1.0 OUTLIER 66.16 84.78 0.15 Allowed 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.272 -0.893 . . . . 0.0 109.872 -179.829 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -53.02 -40.42 63.86 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.314 -0.866 . . . . 0.0 110.372 -179.792 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 0.84 ' O ' HD12 ' A' ' 9' ' ' LEU . 8.0 ptm180 -62.35 -36.35 81.95 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.172 -0.955 . . . . 0.0 110.093 -179.916 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 22.7 t0 -81.16 -12.75 59.13 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.232 -0.917 . . . . 0.0 109.915 179.717 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.416 ' O ' ' SG ' ' A' ' 11' ' ' CYS . 0.8 OUTLIER -82.44 -39.76 22.14 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.324 -0.86 . . . . 0.0 110.095 179.923 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 8' ' ' SER . . . . . 0.503 ' O ' HD12 ' A' ' 12' ' ' ILE . 2.2 t -84.52 -35.15 23.09 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.312 -0.867 . . . . 0.0 110.001 179.918 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.84 HD12 ' O ' ' A' ' 5' ' ' ARG . 5.6 mt -65.01 -46.91 79.41 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.353 -0.842 . . . . 0.0 109.992 179.808 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -64.16 -39.78 94.72 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.166 -0.959 . . . . 0.0 110.062 179.767 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.416 ' SG ' ' O ' ' A' ' 7' ' ' CYS . 82.5 m -67.37 -41.28 85.33 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.282 -0.886 . . . . 0.0 110.21 179.807 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 12' ' ' ILE . . . . . 0.503 HD12 ' O ' ' A' ' 8' ' ' SER . 53.6 mt -66.81 -44.0 89.4 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.603 0 O-C-N 121.297 -0.877 . . . . 0.0 110.258 179.981 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -69.1 -20.24 64.07 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.14 -0.975 . . . . 0.0 110.096 -179.962 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.61 -21.48 60.31 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.266 -0.896 . . . . 0.0 110.253 -179.961 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 124.32 -1.0 8.9 Favored Glycine 0 N--CA 1.491 2.328 0 N-CA-C 109.749 -1.341 . . . . 0.0 109.749 179.823 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' TYR . . . . . 0.445 ' N ' ' CD1' ' A' ' 16' ' ' TYR . 30.4 m-85 -89.09 -158.69 0.52 Allowed 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.138 -1.213 . . . . 0.0 110.236 -179.998 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 17' ' ' ASN . . . . . 0.577 ' HB3' ' CD2' ' A' ' 18' ' ' PHE . 5.3 t30 -120.1 -40.7 2.69 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.146 -0.971 . . . . 0.0 110.239 179.978 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 18' ' ' PHE . . . . . 0.577 ' CD2' ' HB3' ' A' ' 17' ' ' ASN . 12.3 p90 -157.1 158.01 35.6 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.127 -0.983 . . . . 0.0 110.404 179.874 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 19' ' ' GLY . . . . . 0.44 ' O ' ' HB3' ' A' ' 20' ' ' LYS . . . -138.88 -165.12 10.15 Favored Glycine 0 N--CA 1.492 2.37 0 N-CA-C 109.427 -1.469 . . . . 0.0 109.427 179.993 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.44 ' HB3' ' O ' ' A' ' 19' ' ' GLY . 0.0 OUTLIER -176.75 163.04 2.25 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.264 -1.139 . . . . 0.0 110.207 179.965 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 21' ' ' CYS . . . . . 0.591 ' O ' HG23 ' A' ' 22' ' ' VAL . 2.8 t -92.03 155.7 17.92 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.331 -0.856 . . . . 0.0 110.375 -179.93 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.591 HG23 ' O ' ' A' ' 21' ' ' CYS . 73.0 t -157.48 103.63 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.567 0 O-C-N 121.319 -0.863 . . . . 0.0 110.027 179.785 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 23' ' ' ARG . . . . . 0.442 ' HB2' ' O ' ' A' ' 22' ' ' VAL . 0.0 OUTLIER 57.87 66.15 1.18 Allowed 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.219 -0.926 . . . . 0.0 110.122 -179.854 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 50.48 44.59 45.93 Favored Glycine 0 N--CA 1.491 2.344 0 N-CA-C 109.499 -1.44 . . . . 0.0 109.499 -179.975 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' SER . . . . . 0.405 ' O ' ' SG ' ' A' ' 21' ' ' CYS . 0.2 OUTLIER -142.26 164.91 28.86 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.203 -1.175 . . . . 0.0 110.209 179.988 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -134.93 111.21 9.65 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.242 -0.911 . . . . 0.0 110.09 179.938 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 10.6 mm-40 -117.77 168.06 10.81 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.368 -0.833 . . . . 0.0 110.273 -179.793 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 23.3 m -124.44 142.71 51.1 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.301 -0.875 . . . . 0.0 110.05 179.84 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.481 ' HB2' ' CE1' ' A' ' 18' ' ' PHE . 3.8 mmp_? -129.72 136.43 49.66 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.194 -0.942 . . . . 0.0 110.25 -179.933 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 10.4 mtp85 -98.69 -172.63 2.35 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.242 -0.911 . . . . 0.0 110.226 -179.941 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -116.17 -26.05 7.37 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.277 -0.889 . . . . 0.0 110.227 179.997 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -106.35 -178.19 3.58 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.254 -0.904 . . . . 0.0 110.3 179.999 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.239 0 N-CA-C 109.569 -1.412 . . . . 0.0 109.569 179.967 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.672 0 CA-C-O 121.16 0.505 . . . . 0.0 110.254 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' CYS . . . . . 0.415 ' C ' ' SG ' ' A' ' 21' ' ' CYS . 7.2 t -83.71 83.08 8.04 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.364 -0.835 . . . . 0.0 110.115 179.93 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 3' ' ' ASN . . . . . 0.489 ' O ' ' HB3' ' A' ' 7' ' ' CYS . 0.8 OUTLIER -126.44 129.61 49.05 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.387 -0.821 . . . . 0.0 110.036 -179.971 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 10.4 m-20 -54.64 -41.9 70.63 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.275 -0.89 . . . . 0.0 110.675 -179.749 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 0.726 ' O ' HD12 ' A' ' 9' ' ' LEU . 3.0 ttt180 -81.88 -35.34 29.35 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.13 -0.981 . . . . 0.0 110.264 -179.808 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 6' ' ' ASP . . . . . 0.449 ' O ' ' HB2' ' A' ' 10' ' ' ASP . 3.0 t70 -79.4 -25.66 42.08 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.357 -0.839 . . . . 0.0 110.167 -179.943 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.489 ' HB3' ' O ' ' A' ' 3' ' ' ASN . 17.0 t -87.25 -42.11 13.19 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.316 -0.865 . . . . 0.0 110.067 179.937 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 8' ' ' SER . . . . . 0.475 ' O ' ' HB ' ' A' ' 12' ' ' ILE . 84.6 p -67.92 -46.49 71.4 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.366 -0.834 . . . . 0.0 110.285 -179.854 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.726 HD12 ' O ' ' A' ' 5' ' ' ARG . 3.0 mt -65.27 -38.3 89.87 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.181 -0.949 . . . . 0.0 110.414 -179.883 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 10' ' ' ASP . . . . . 0.449 ' HB2' ' O ' ' A' ' 6' ' ' ASP . 26.1 m-20 -74.11 -48.82 27.0 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.213 -0.929 . . . . 0.0 110.502 -179.844 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.496 ' SG ' ' CB ' ' A' ' 16' ' ' TYR . 53.0 t -68.71 -39.18 80.57 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.185 -0.947 . . . . 0.0 110.631 -179.764 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 12' ' ' ILE . . . . . 0.475 ' HB ' ' O ' ' A' ' 8' ' ' SER . 46.8 mt -63.48 -39.3 84.8 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.553 0 O-C-N 121.095 -1.003 . . . . 0.0 110.152 179.942 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 13' ' ' MET . . . . . 0.438 ' HB2' ' O ' ' A' ' 9' ' ' LEU . 5.4 ttm -77.85 -19.07 55.51 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.243 -0.91 . . . . 0.0 109.981 179.759 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.11 -24.47 61.49 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.299 -0.876 . . . . 0.0 110.128 179.849 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 132.49 -2.93 5.03 Favored Glycine 0 N--CA 1.49 2.239 0 N-CA-C 109.559 -1.416 . . . . 0.0 109.559 -179.969 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' TYR . . . . . 0.587 ' CD1' ' HB3' ' A' ' 28' ' ' CYS . 82.2 m-85 -82.22 -172.24 3.87 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.287 -1.126 . . . . 0.0 110.183 -179.956 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 17' ' ' ASN . . . . . 0.681 HD21 ' HE1' ' A' ' 18' ' ' PHE . 1.5 t30 -127.18 -32.13 2.52 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.244 -0.91 . . . . 0.0 110.269 -179.935 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 18' ' ' PHE . . . . . 0.681 ' HE1' HD21 ' A' ' 17' ' ' ASN . 2.9 m-85 -123.84 169.47 11.54 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.123 -0.986 . . . . 0.0 110.37 -179.912 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -156.67 129.12 2.34 Favored Glycine 0 N--CA 1.491 2.341 0 N-CA-C 109.439 -1.464 . . . . 0.0 109.439 179.853 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.446 ' O ' ' SG ' ' A' ' 26' ' ' CYS . 32.8 tttp -144.5 140.91 29.17 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.131 -1.217 . . . . 0.0 110.367 -179.843 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 21' ' ' CYS . . . . . 0.461 ' HA ' ' HA ' ' A' ' 26' ' ' CYS . 0.0 OUTLIER -97.58 131.62 44.0 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.185 -0.947 . . . . 0.0 110.206 -179.993 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.478 ' N ' ' O ' ' A' ' 25' ' ' SER . 54.2 t -151.23 127.83 2.01 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.615 0 O-C-N 121.149 -0.969 . . . . 0.0 110.471 179.998 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 23' ' ' ARG . . . . . 0.443 ' CB ' ' O ' ' A' ' 22' ' ' VAL . 14.9 ttp180 64.56 57.51 1.11 Allowed 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.32 -0.863 . . . . 0.0 110.314 179.829 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 50.24 22.19 4.81 Favored Glycine 0 N--CA 1.49 2.285 0 N-CA-C 109.5 -1.44 . . . . 0.0 109.5 -179.973 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' SER . . . . . 0.478 ' O ' ' N ' ' A' ' 22' ' ' VAL . 41.3 m -142.2 177.94 7.89 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.348 -1.089 . . . . 0.0 109.915 -179.986 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 26' ' ' CYS . . . . . 0.461 ' HA ' ' HA ' ' A' ' 21' ' ' CYS . 0.7 OUTLIER -136.8 143.13 43.02 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.145 -0.972 . . . . 0.0 110.392 179.998 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 2.4 mt-30 -115.19 156.3 25.59 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.309 -0.869 . . . . 0.0 109.971 179.821 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' CYS . . . . . 0.587 ' HB3' ' CD1' ' A' ' 16' ' ' TYR . 32.1 m -125.37 171.27 10.57 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.258 -0.901 . . . . 0.0 110.314 -179.861 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -143.19 139.66 30.4 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.376 -0.828 . . . . 0.0 110.033 179.891 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -108.85 117.19 33.55 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.218 -0.926 . . . . 0.0 110.252 -179.998 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 31' ' ' THR . . . . . 0.486 HG22 ' H ' ' A' ' 31' ' ' THR . 3.3 t -77.83 -164.61 0.53 Allowed 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.322 -0.861 . . . . 0.0 110.259 -179.976 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 32' ' ' SER . . . . . 0.425 ' N ' ' OG1' ' A' ' 31' ' ' THR . 37.4 t -125.25 169.14 12.56 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.253 -0.905 . . . . 0.0 110.155 179.924 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.22 0 CA-C-O 117.988 -1.451 . . . . 0.0 109.543 -179.961 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.575 0 CA-C-O 121.239 0.542 . . . . 0.0 110.211 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' CYS . . . . . 0.464 ' O ' ' O ' ' A' ' 3' ' ' ASN . 16.7 p -106.07 -34.94 7.4 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.17 -0.956 . . . . 0.0 110.301 179.984 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 3' ' ' ASN . . . . . 0.503 ' O ' ' HB2' ' A' ' 7' ' ' CYS . 2.1 m-20 58.89 124.53 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.289 -0.882 . . . . 0.0 110.54 179.683 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 4' ' ' ASP . . . . . 0.495 ' HA ' ' HB3' ' A' ' 7' ' ' CYS . 23.7 m-20 -80.14 -24.82 40.19 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.159 -0.963 . . . . 0.0 110.227 179.811 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 5.3 ttt180 -63.81 -60.77 2.86 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.329 -0.857 . . . . 0.0 110.471 -179.831 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 5.6 t70 -79.65 6.31 10.99 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.232 -0.918 . . . . 0.0 110.155 -179.943 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.503 ' HB2' ' O ' ' A' ' 3' ' ' ASN . 4.9 t -99.58 -36.05 9.65 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.347 -0.846 . . . . 0.0 110.073 179.89 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -93.26 -29.3 15.75 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.314 -0.866 . . . . 0.0 110.22 179.923 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 2.7 mt -55.27 -55.65 29.04 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.31 -0.869 . . . . 0.0 110.332 -179.937 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 3.1 t0 -65.62 -35.97 82.37 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.156 -0.965 . . . . 0.0 110.369 -179.877 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -66.67 -49.47 66.07 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.255 -0.903 . . . . 0.0 110.2 179.997 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 61.2 mt -63.65 -24.1 35.0 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.637 0 O-C-N 121.328 -0.858 . . . . 0.0 109.894 179.855 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 2.7 mtt -79.66 -26.55 41.0 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.314 -0.866 . . . . 0.0 110.003 179.801 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.21 -25.79 60.9 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.274 -0.891 . . . . 0.0 110.102 179.907 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 134.51 -9.04 4.65 Favored Glycine 0 N--CA 1.491 2.331 0 N-CA-C 109.62 -1.392 . . . . 0.0 109.62 179.986 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 23.1 m-85 -68.02 -158.45 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.159 -1.201 . . . . 0.0 110.165 -179.98 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' ASN . . . . . 0.59 ' HB3' ' CD2' ' A' ' 18' ' ' PHE . 0.1 OUTLIER -135.71 -53.1 0.76 Allowed 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.343 -0.848 . . . . 0.0 110.118 179.953 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 18' ' ' PHE . . . . . 0.592 ' CE1' ' HB2' ' A' ' 29' ' ' ARG . 6.1 p90 -152.93 157.61 40.88 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.226 -0.921 . . . . 0.0 110.37 179.799 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 19' ' ' GLY . . . . . 0.432 ' HA3' ' HA ' ' A' ' 28' ' ' CYS . . . -154.05 -160.5 9.83 Favored Glycine 0 N--CA 1.49 2.24 0 N-CA-C 109.474 -1.45 . . . . 0.0 109.474 179.883 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -172.75 176.02 3.25 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.097 -1.237 . . . . 0.0 110.335 179.981 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 21' ' ' CYS . . . . . 0.448 ' SG ' ' O ' ' A' ' 25' ' ' SER . 8.4 t -83.99 132.9 34.71 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.29 -0.881 . . . . 0.0 110.317 179.943 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.443 ' O ' ' HB2' ' A' ' 25' ' ' SER . 71.0 t -118.27 92.13 2.04 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.675 0 O-C-N 121.293 -0.879 . . . . 0.0 110.254 -179.947 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 23' ' ' ARG . . . . . 0.458 ' O ' ' OG ' ' A' ' 25' ' ' SER . 4.7 tmm_? 50.81 84.15 0.04 OUTLIER 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.311 -0.868 . . . . 0.0 110.363 179.909 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 51.62 22.71 8.58 Favored Glycine 0 N--CA 1.49 2.24 0 N-CA-C 109.69 -1.364 . . . . 0.0 109.69 179.964 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' SER . . . . . 0.458 ' OG ' ' O ' ' A' ' 23' ' ' ARG . 1.1 m -135.78 -161.66 1.18 Allowed 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.333 -1.098 . . . . 0.0 109.718 179.794 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -167.03 124.62 1.26 Allowed 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.231 -0.918 . . . . 0.0 110.677 179.937 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.446 ' O ' ' SG ' ' A' ' 28' ' ' CYS . 33.8 mm-40 -119.06 -179.86 3.95 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.427 -0.796 . . . . 0.0 109.694 179.639 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 28' ' ' CYS . . . . . 0.446 ' SG ' ' O ' ' A' ' 27' ' ' GLN . 84.3 m -149.49 157.9 43.7 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.114 -0.991 . . . . 0.0 109.914 179.921 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.592 ' HB2' ' CE1' ' A' ' 18' ' ' PHE . 6.2 mmm180 -134.31 156.52 48.32 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.105 -0.997 . . . . 0.0 110.483 -179.642 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -113.21 174.23 6.01 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.292 -0.88 . . . . 0.0 110.122 179.92 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -80.28 -87.12 0.08 Allowed 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.158 -0.964 . . . . 0.0 110.216 179.922 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 10.6 t -132.99 50.18 2.26 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.271 -0.893 . . . . 0.0 110.237 -179.975 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.267 0 N-CA-C 109.554 -1.418 . . . . 0.0 109.554 -179.96 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.639 0 CA-C-O 121.265 0.555 . . . . 0.0 110.415 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' CYS . . . . . 0.425 ' O ' ' CB ' ' A' ' 3' ' ' ASN . 20.6 p -77.86 176.0 9.49 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.268 -0.895 . . . . 0.0 110.269 179.956 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 3' ' ' ASN . . . . . 0.467 ' O ' ' N ' ' A' ' 7' ' ' CYS . 0.8 OUTLIER 173.66 137.76 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.195 -0.941 . . . . 0.0 110.251 -179.969 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 4' ' ' ASP . . . . . 0.4 ' O ' ' HB3' ' A' ' 8' ' ' SER . 0.7 OUTLIER -53.36 -34.96 59.67 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.122 -0.986 . . . . 0.0 110.203 -179.989 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 0.806 ' O ' HD12 ' A' ' 9' ' ' LEU . 0.1 OUTLIER -78.4 -39.69 38.22 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.279 -0.888 . . . . 0.0 110.415 -179.946 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 4.3 t0 -84.8 -19.02 33.18 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.301 -0.875 . . . . 0.0 110.287 -179.889 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.467 ' N ' ' O ' ' A' ' 3' ' ' ASN . 10.1 t -87.64 -27.9 22.2 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.235 -0.916 . . . . 0.0 110.113 179.977 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 8' ' ' SER . . . . . 0.4 ' HB3' ' O ' ' A' ' 4' ' ' ASP . 6.0 t -92.41 -33.04 14.7 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.285 -0.884 . . . . 0.0 110.337 -179.882 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.806 HD12 ' O ' ' A' ' 5' ' ' ARG . 0.8 OUTLIER -57.02 -55.9 28.75 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.173 -0.954 . . . . 0.0 110.284 -179.792 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -67.09 -38.22 85.32 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.15 -0.969 . . . . 0.0 110.179 -179.949 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.418 ' SG ' ' O ' ' A' ' 7' ' ' CYS . 55.0 m -68.11 -44.74 75.47 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.285 -0.885 . . . . 0.0 110.185 -179.975 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 19.8 mt -63.56 -41.13 91.57 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.589 0 O-C-N 121.187 -0.945 . . . . 0.0 109.997 179.882 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -69.08 -34.77 75.65 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.27 -0.894 . . . . 0.0 110.024 179.83 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -65.85 -57.12 8.66 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.294 -0.879 . . . . 0.0 109.945 179.832 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 159.91 36.65 0.02 OUTLIER Glycine 0 N--CA 1.491 2.352 0 N-CA-C 109.663 -1.375 . . . . 0.0 109.663 -179.991 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' TYR . . . . . 0.462 ' CD2' ' HG2' ' A' ' 30' ' ' ARG . 36.8 m-85 -113.09 -173.43 2.25 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.154 -1.203 . . . . 0.0 110.19 -179.996 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 17' ' ' ASN . . . . . 0.537 ' CG ' ' CE2' ' A' ' 18' ' ' PHE . 7.8 p30 -121.81 -34.92 3.29 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.312 -0.867 . . . . 0.0 109.942 179.662 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 18' ' ' PHE . . . . . 0.594 ' CE1' ' HB2' ' A' ' 29' ' ' ARG . 3.3 p90 -164.77 154.25 13.3 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.327 -0.858 . . . . 0.0 110.051 179.804 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 19' ' ' GLY . . . . . 0.443 ' O ' ' HB3' ' A' ' 20' ' ' LYS . . . -155.04 -162.77 11.49 Favored Glycine 0 N--CA 1.491 2.301 0 N-CA-C 109.391 -1.484 . . . . 0.0 109.391 179.997 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.443 ' HB3' ' O ' ' A' ' 19' ' ' GLY . 0.0 OUTLIER 178.45 165.7 0.8 Allowed 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.214 -1.168 . . . . 0.0 110.19 179.974 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 21' ' ' CYS . . . . . 0.488 ' HA ' ' O ' ' A' ' 25' ' ' SER . 39.3 t -83.0 145.67 29.19 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.2 -0.937 . . . . 0.0 109.968 179.839 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.431 ' O ' ' C ' ' A' ' 23' ' ' ARG . 92.5 t -138.47 126.46 29.08 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.597 0 O-C-N 121.197 -0.939 . . . . 0.0 110.393 -179.915 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 23' ' ' ARG . . . . . 0.431 ' C ' ' O ' ' A' ' 22' ' ' VAL . 3.0 ttp180 42.15 39.74 1.48 Allowed 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.259 -0.9 . . . . 0.0 110.149 -179.989 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 79.91 31.55 39.18 Favored Glycine 0 N--CA 1.49 2.281 0 N-CA-C 109.318 -1.513 . . . . 0.0 109.318 -179.879 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' SER . . . . . 0.488 ' O ' ' HA ' ' A' ' 21' ' ' CYS . 44.2 m -128.63 -164.19 1.36 Allowed 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.281 -1.129 . . . . 0.0 110.025 179.967 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 7.3 t -153.11 97.33 2.17 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.274 -0.891 . . . . 0.0 109.979 179.951 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.431 ' O ' ' SG ' ' A' ' 28' ' ' CYS . 14.5 mm-40 -106.67 164.26 12.23 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.294 -0.879 . . . . 0.0 110.522 -179.792 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 28' ' ' CYS . . . . . 0.431 ' SG ' ' O ' ' A' ' 27' ' ' GLN . 81.0 m -149.5 161.58 41.83 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.357 -0.84 . . . . 0.0 109.843 179.891 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.594 ' HB2' ' CE1' ' A' ' 18' ' ' PHE . 14.2 mmm180 -123.28 164.35 18.95 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.156 -0.965 . . . . 0.0 110.328 -179.888 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.472 ' C ' ' ND2' ' A' ' 17' ' ' ASN . 59.4 mtp180 -119.24 160.32 22.4 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.241 -0.912 . . . . 0.0 110.065 179.855 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 31' ' ' THR . . . . . 0.423 ' CG2' ' HB3' ' A' ' 17' ' ' ASN . 49.3 p -76.83 -173.45 2.66 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.184 -0.947 . . . . 0.0 110.217 -179.923 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 16.2 m -93.7 85.81 4.96 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.286 -0.884 . . . . 0.0 110.172 -179.976 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.281 0 CA-C-O 117.972 -1.46 . . . . 0.0 109.532 179.932 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.592 0 CA-C-O 121.277 0.561 . . . . 0.0 110.179 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' CYS . . . . . 0.417 ' O ' ' C ' ' A' ' 3' ' ' ASN . 21.4 p -98.72 48.01 0.98 Allowed 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.167 -0.958 . . . . 0.0 110.296 179.959 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 3' ' ' ASN . . . . . 0.46 ' O ' ' HB2' ' A' ' 7' ' ' CYS . 3.3 m-20 -42.93 149.66 0.19 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.221 -0.924 . . . . 0.0 110.19 -179.927 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 19.7 m-20 -68.55 -33.19 73.67 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.233 -0.917 . . . . 0.0 110.246 179.983 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 0.599 ' O ' HD12 ' A' ' 9' ' ' LEU . 2.1 mtp180 -72.22 -41.57 66.74 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.245 -0.909 . . . . 0.0 110.177 179.97 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -79.92 3.16 20.77 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.239 -0.913 . . . . 0.0 110.196 179.879 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.46 ' HB2' ' O ' ' A' ' 3' ' ' ASN . 7.0 t -107.97 -30.46 8.45 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.182 -0.949 . . . . 0.0 110.227 -179.923 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -93.46 -43.33 8.79 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.216 -0.928 . . . . 0.0 110.186 -179.839 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.599 HD12 ' O ' ' A' ' 5' ' ' ARG . 47.3 mt -56.37 -49.61 73.92 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.214 -0.929 . . . . 0.0 110.298 -179.787 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 56.8 t0 -64.43 -45.94 85.35 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.261 -0.899 . . . . 0.0 110.289 -179.838 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.442 ' HA ' ' HG3' ' A' ' 14' ' ' LYS . 0.5 OUTLIER -66.21 -32.98 74.73 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.315 -0.866 . . . . 0.0 110.184 -179.896 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 24.2 mt -63.41 -39.36 85.02 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.547 0 O-C-N 121.19 -0.944 . . . . 0.0 109.373 179.616 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 4.6 ttm -71.18 -27.62 63.65 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.364 -0.835 . . . . 0.0 109.397 179.274 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' LYS . . . . . 0.442 ' HG3' ' HA ' ' A' ' 11' ' ' CYS . 2.7 mmpt? -63.47 -35.6 80.98 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.411 -0.806 . . . . 0.0 110.094 179.61 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 133.27 2.02 3.81 Favored Glycine 0 N--CA 1.491 2.34 0 N-CA-C 110.141 -1.184 . . . . 0.0 110.141 179.875 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' TYR . . . . . 0.51 ' HA ' ' CG ' ' A' ' 30' ' ' ARG . 17.8 m-85 -85.86 -167.58 1.91 Allowed 'General case' 0 N--CA 1.49 1.563 0 O-C-N 120.915 -1.344 . . . . 0.0 110.145 179.919 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 17' ' ' ASN . . . . . 0.58 ' HB3' ' CD2' ' A' ' 18' ' ' PHE . 0.7 OUTLIER -112.78 -62.52 1.57 Allowed 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.331 -0.856 . . . . 0.0 109.944 179.713 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 18' ' ' PHE . . . . . 0.58 ' CD2' ' HB3' ' A' ' 17' ' ' ASN . 7.5 p90 -143.71 151.66 40.32 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.274 -0.892 . . . . 0.0 110.142 179.597 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 19' ' ' GLY . . . . . 0.509 ' CA ' ' HA ' ' A' ' 28' ' ' CYS . . . -149.52 -164.6 11.79 Favored Glycine 0 N--CA 1.49 2.26 0 N-CA-C 109.501 -1.44 . . . . 0.0 109.501 -179.994 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.4 ' HB3' ' O ' ' A' ' 19' ' ' GLY . 0.0 OUTLIER -178.42 178.56 0.85 Allowed 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.226 -1.161 . . . . 0.0 110.111 179.972 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 21' ' ' CYS . . . . . 0.471 ' HA ' ' O ' ' A' ' 25' ' ' SER . 50.8 t -83.41 152.94 24.77 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.206 -0.934 . . . . 0.0 110.111 179.99 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.538 ' CG2' ' HB2' ' A' ' 27' ' ' GLN . 46.8 t -127.6 69.85 0.38 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.593 0 O-C-N 121.235 -0.916 . . . . 0.0 110.396 -179.994 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 23' ' ' ARG . . . . . 0.429 ' CB ' ' O ' ' A' ' 22' ' ' VAL . 0.4 OUTLIER 66.13 50.14 1.44 Allowed 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.275 -0.89 . . . . 0.0 110.368 179.849 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 94.53 16.95 40.83 Favored Glycine 0 N--CA 1.491 2.301 0 N-CA-C 109.674 -1.37 . . . . 0.0 109.674 179.857 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' SER . . . . . 0.471 ' O ' ' HA ' ' A' ' 21' ' ' CYS . 0.6 OUTLIER -133.49 -166.32 1.76 Allowed 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.1 -1.235 . . . . 0.0 110.154 179.922 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 0.3 OUTLIER -148.36 105.49 3.62 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.154 -0.966 . . . . 0.0 110.27 -179.973 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.538 ' HB2' ' CG2' ' A' ' 22' ' ' VAL . 3.2 mm100 -105.89 179.34 4.3 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.17 -0.956 . . . . 0.0 110.277 179.927 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 28' ' ' CYS . . . . . 0.509 ' HA ' ' CA ' ' A' ' 19' ' ' GLY . 66.4 m -151.9 164.76 36.44 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.348 -0.845 . . . . 0.0 109.929 179.817 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.502 ' HB2' ' CE1' ' A' ' 18' ' ' PHE . 0.0 OUTLIER -142.97 133.04 24.32 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.055 -1.028 . . . . 0.0 110.47 179.975 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.51 ' CG ' ' HA ' ' A' ' 16' ' ' TYR . 9.4 mtm180 -111.49 166.72 10.89 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.357 -0.839 . . . . 0.0 110.253 179.988 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 33.6 p -94.75 147.95 22.8 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.248 -0.907 . . . . 0.0 110.16 179.929 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' SER . . . . . 0.471 ' OG ' ' N ' ' A' ' 33' ' ' GLY . 1.1 p -129.4 -153.45 0.57 Allowed 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.181 -0.949 . . . . 0.0 110.243 179.98 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 33' ' ' GLY . . . . . 0.471 ' N ' ' OG ' ' A' ' 32' ' ' SER . . . . . . . . 0 N--CA 1.491 2.304 0 CA-C-O 117.976 -1.458 . . . . 0.0 109.535 -179.975 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.629 0 CA-C-O 121.469 0.652 . . . . 0.0 110.319 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' CYS . . . . . 0.435 ' O ' ' SG ' ' A' ' 2' ' ' CYS . 32.0 p -90.12 126.5 35.81 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.359 -0.838 . . . . 0.0 110.246 -179.947 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 3' ' ' ASN . . . . . 0.44 ' O ' ' SG ' ' A' ' 7' ' ' CYS . 0.1 OUTLIER -88.11 146.01 25.65 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.242 -0.911 . . . . 0.0 110.161 -179.982 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 2.4 p30 -69.07 -41.52 77.44 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.279 -0.888 . . . . 0.0 110.369 -179.988 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.81 -33.8 66.44 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.079 -1.013 . . . . 0.0 110.184 179.978 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 14.7 t0 -78.54 -11.03 59.94 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.259 -0.901 . . . . 0.0 109.743 179.894 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.44 ' SG ' ' O ' ' A' ' 3' ' ' ASN . 19.3 m -93.5 -42.34 9.29 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.347 -0.846 . . . . 0.0 109.606 179.418 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 8' ' ' SER . . . . . 0.616 ' O ' HD12 ' A' ' 12' ' ' ILE . 6.7 p -67.21 -37.52 83.77 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.346 -0.846 . . . . 0.0 109.912 179.669 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.479 ' O ' ' HB2' ' A' ' 13' ' ' MET . 18.5 mt -66.38 -25.71 66.91 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.296 -0.877 . . . . 0.0 110.235 179.854 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -75.27 -47.01 29.99 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.296 -0.878 . . . . 0.0 110.392 -179.775 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.464 ' O ' ' HB2' ' A' ' 16' ' ' TYR . 30.7 m -67.06 -44.22 80.7 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.286 -0.884 . . . . 0.0 110.472 -179.668 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 12' ' ' ILE . . . . . 0.616 HD12 ' O ' ' A' ' 8' ' ' SER . 31.8 mt -63.36 -38.61 82.61 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.654 0 O-C-N 121.188 -0.945 . . . . 0.0 110.457 -179.721 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 13' ' ' MET . . . . . 0.479 ' HB2' ' O ' ' A' ' 9' ' ' LEU . 1.9 tpp -65.31 -46.64 79.55 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.223 -0.923 . . . . 0.0 110.246 179.956 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 6.4 mtpt -63.01 -31.43 72.56 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.209 -0.932 . . . . 0.0 110.328 -179.889 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 139.67 -7.48 3.03 Favored Glycine 0 N--CA 1.49 2.254 0 N-CA-C 109.804 -1.318 . . . . 0.0 109.804 179.963 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' TYR . . . . . 0.464 ' HB2' ' O ' ' A' ' 11' ' ' CYS . 99.1 m-85 -76.73 -171.42 1.89 Allowed 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.209 -1.171 . . . . 0.0 110.092 179.999 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 17' ' ' ASN . . . . . 0.448 ' HB3' ' CD2' ' A' ' 18' ' ' PHE . 0.1 OUTLIER -118.24 -42.56 2.78 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.082 -1.012 . . . . 0.0 110.521 -179.749 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 18' ' ' PHE . . . . . 0.448 ' CD2' ' HB3' ' A' ' 17' ' ' ASN . 2.9 p90 -159.81 158.53 31.23 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.091 -1.006 . . . . 0.0 110.549 -179.885 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 19' ' ' GLY . . . . . 0.479 ' HA3' ' O ' ' A' ' 27' ' ' GLN . . . -144.47 -148.66 4.9 Favored Glycine 0 N--CA 1.491 2.339 0 N-CA-C 109.42 -1.472 . . . . 0.0 109.42 179.948 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.486 ' O ' ' HA ' ' A' ' 26' ' ' CYS . 0.3 OUTLIER -176.12 168.93 2.87 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.231 -1.158 . . . . 0.0 110.253 179.97 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 21' ' ' CYS . . . . . 0.446 ' SG ' ' SG ' ' A' ' 26' ' ' CYS . 1.2 m -87.62 142.19 28.04 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.351 -0.843 . . . . 0.0 110.166 -179.92 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 22.1 t -131.98 76.57 0.48 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.7 0 O-C-N 121.35 -0.843 . . . . 0.0 110.145 179.897 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 2.3 mtm-85 60.26 77.22 0.33 Allowed 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.335 -0.853 . . . . 0.0 110.243 179.98 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 62.8 11.81 38.62 Favored Glycine 0 N--CA 1.49 2.278 0 N-CA-C 109.578 -1.409 . . . . 0.0 109.578 179.979 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' SER . . . . . 0.42 ' O ' ' HA ' ' A' ' 21' ' ' CYS . 0.1 OUTLIER -130.33 176.34 8.21 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.221 -1.164 . . . . 0.0 109.926 179.877 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 26' ' ' CYS . . . . . 0.486 ' HA ' ' O ' ' A' ' 20' ' ' LYS . 0.5 OUTLIER -154.08 132.26 11.84 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.172 -0.955 . . . . 0.0 110.204 -179.972 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.479 ' O ' ' HA3' ' A' ' 19' ' ' GLY . 2.5 mm100 -120.13 174.81 6.26 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.289 -0.882 . . . . 0.0 110.409 -179.885 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 28' ' ' CYS . . . . . 0.445 ' HB3' ' HB3' ' A' ' 11' ' ' CYS . 56.5 m -126.96 144.31 51.04 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.367 -0.833 . . . . 0.0 110.163 179.919 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 17.1 mmt180 -122.6 148.49 45.17 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.251 -0.905 . . . . 0.0 110.258 -179.925 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -98.09 178.58 5.05 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.323 -0.861 . . . . 0.0 110.222 179.996 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -115.63 -19.84 10.39 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.281 -0.887 . . . . 0.0 110.219 179.963 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 7.1 t -105.22 144.4 32.06 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.267 -0.896 . . . . 0.0 110.201 179.953 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.273 0 CA-C-O 117.925 -1.486 . . . . 0.0 109.535 179.967 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.563 0 CA-C-O 121.231 0.539 . . . . 0.0 110.209 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 17.9 p -86.08 153.75 21.88 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.273 -0.892 . . . . 0.0 110.254 -179.895 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 35.0 m120 -117.55 133.58 55.8 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.231 -0.918 . . . . 0.0 110.122 179.978 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' ASP . . . . . 0.459 ' N ' ' OD1' ' A' ' 4' ' ' ASP . 0.9 OUTLIER -61.85 -30.41 70.83 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.262 -0.899 . . . . 0.0 110.224 179.95 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.08 -29.55 64.23 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.255 -0.903 . . . . 0.0 110.089 179.904 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -79.47 -14.36 58.96 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.297 -0.877 . . . . 0.0 110.126 179.869 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -96.97 -25.15 15.49 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.291 -0.881 . . . . 0.0 109.888 179.863 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 8' ' ' SER . . . . . 0.42 ' OG ' ' O ' ' A' ' 4' ' ' ASP . 0.1 OUTLIER -82.82 -43.78 16.26 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.339 -0.85 . . . . 0.0 110.083 179.846 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -62.37 -49.61 74.86 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.267 -0.896 . . . . 0.0 110.087 179.818 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -62.47 -27.08 68.88 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.26 -0.9 . . . . 0.0 109.638 179.681 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.54 ' O ' ' N ' ' A' ' 16' ' ' TYR . 0.1 OUTLIER -66.77 -46.12 76.34 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.395 -0.816 . . . . 0.0 109.641 179.428 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 89.4 mt -75.49 -33.34 27.02 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.502 0 O-C-N 121.339 -0.85 . . . . 0.0 110.2 179.971 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 1.7 ttt -69.0 -52.92 23.78 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.121 -0.987 . . . . 0.0 110.226 -179.989 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 4.1 mttt -60.8 -30.51 70.11 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.321 -0.862 . . . . 0.0 110.344 -179.977 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 122.68 14.55 4.26 Favored Glycine 0 N--CA 1.491 2.365 0 N-CA-C 109.756 -1.337 . . . . 0.0 109.756 179.944 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' TYR . . . . . 0.54 ' N ' ' O ' ' A' ' 11' ' ' CYS . 48.2 m-85 -92.53 -179.98 5.34 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.246 -1.15 . . . . 0.0 110.08 179.879 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 17' ' ' ASN . . . . . 0.75 ' CB ' HG23 ' A' ' 31' ' ' THR . 6.7 m120 -101.56 -52.1 3.3 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.094 -1.004 . . . . 0.0 110.486 -179.792 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 18' ' ' PHE . . . . . 0.541 ' CE2' ' HB2' ' A' ' 29' ' ' ARG . 33.2 p90 -146.91 163.19 36.92 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.103 -0.998 . . . . 0.0 110.567 -179.872 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -138.38 -170.45 11.86 Favored Glycine 0 N--CA 1.491 2.316 0 N-CA-C 109.375 -1.49 . . . . 0.0 109.375 179.944 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -170.52 164.61 8.49 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.216 -1.167 . . . . 0.0 110.2 179.916 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 21' ' ' CYS . . . . . 0.49 ' HA ' ' O ' ' A' ' 25' ' ' SER . 0.8 OUTLIER -90.99 137.72 32.15 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.219 -0.926 . . . . 0.0 110.113 179.943 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.53 ' HB ' ' CB ' ' A' ' 25' ' ' SER . 57.3 t -110.07 76.26 0.42 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.641 0 O-C-N 121.234 -0.916 . . . . 0.0 110.173 -179.98 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 13.6 mtm180 54.37 54.16 9.82 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.229 -0.92 . . . . 0.0 110.208 179.894 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 93.9 15.41 49.09 Favored Glycine 0 N--CA 1.49 2.3 0 N-CA-C 109.753 -1.339 . . . . 0.0 109.753 179.957 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' SER . . . . . 0.53 ' CB ' ' HB ' ' A' ' 22' ' ' VAL . 0.5 OUTLIER -127.36 -176.15 3.65 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.226 -1.161 . . . . 0.0 110.213 -179.946 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 8.1 t -143.56 114.17 7.57 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.207 -0.933 . . . . 0.0 110.175 -179.988 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 21.4 mm100 -117.45 157.6 25.94 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.269 -0.894 . . . . 0.0 110.132 179.961 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -124.32 133.23 53.52 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.325 -0.86 . . . . 0.0 110.084 -179.982 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.541 ' HB2' ' CE2' ' A' ' 18' ' ' PHE . 3.4 mtm180 -123.37 163.6 20.48 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.162 -0.961 . . . . 0.0 110.383 -179.941 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.511 ' HA ' ' HB2' ' A' ' 17' ' ' ASN . 0.0 OUTLIER -115.34 -178.49 3.39 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.327 -0.858 . . . . 0.0 110.118 179.955 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 31' ' ' THR . . . . . 0.75 HG23 ' CB ' ' A' ' 17' ' ' ASN . 43.4 p -115.72 132.85 56.51 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.227 -0.921 . . . . 0.0 110.224 -179.872 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 32' ' ' SER . . . . . 0.404 ' OG ' ' N ' ' A' ' 33' ' ' GLY . 1.4 t -133.66 -84.25 0.45 Allowed 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.216 -0.927 . . . . 0.0 110.189 179.891 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 33' ' ' GLY . . . . . 0.404 ' N ' ' OG ' ' A' ' 32' ' ' SER . . . . . . . . 0 N--CA 1.491 2.311 0 CA-C-O 118.0 -1.445 . . . . 0.0 109.589 179.967 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.647 0 CA-C-O 121.199 0.524 . . . . 0.0 110.185 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' CYS . . . . . 0.443 ' O ' ' CB ' ' A' ' 3' ' ' ASN . 18.3 p -79.65 1.91 24.52 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.252 -0.905 . . . . 0.0 110.244 179.976 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 3' ' ' ASN . . . . . 0.455 ' O ' ' CB ' ' A' ' 7' ' ' CYS . 17.3 t-20 64.9 93.42 0.06 Allowed 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.24 -0.913 . . . . 0.0 110.158 -179.801 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 93.0 m-20 -57.35 -35.78 70.37 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.26 -0.9 . . . . 0.0 110.359 -179.908 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 0.454 ' O ' ' HB2' ' A' ' 9' ' ' LEU . 1.3 ttm-85 -62.6 -57.26 11.72 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.081 -1.012 . . . . 0.0 110.161 -179.935 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -79.89 6.63 10.63 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.279 -0.888 . . . . 0.0 110.211 179.916 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.455 ' CB ' ' O ' ' A' ' 3' ' ' ASN . 39.5 t -107.22 -34.0 7.25 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.268 -0.895 . . . . 0.0 110.232 -179.946 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 8' ' ' SER . . . . . 0.454 ' O ' HG13 ' A' ' 12' ' ' ILE . 19.4 m -93.96 -42.2 9.18 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.293 -0.879 . . . . 0.0 110.434 -179.777 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.454 ' HB2' ' O ' ' A' ' 5' ' ' ARG . 0.2 OUTLIER -53.32 -49.24 67.48 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.187 -0.946 . . . . 0.0 110.362 -179.71 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -62.87 -46.73 86.49 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.152 -0.967 . . . . 0.0 110.158 179.914 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -66.64 -38.96 87.96 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.197 -0.939 . . . . 0.0 110.179 -179.885 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 12' ' ' ILE . . . . . 0.454 HG13 ' O ' ' A' ' 8' ' ' SER . 14.2 mt -64.65 -33.58 64.13 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.611 0 O-C-N 121.232 -0.918 . . . . 0.0 110.149 179.907 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 7.3 ttm -73.85 -30.17 62.52 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.265 -0.897 . . . . 0.0 110.098 179.906 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 3.9 mtpp -59.64 -30.44 68.72 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.298 -0.876 . . . . 0.0 110.307 -179.978 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 138.98 -6.32 3.13 Favored Glycine 0 N--CA 1.49 2.298 0 N-CA-C 109.829 -1.308 . . . . 0.0 109.829 179.978 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 94.9 m-85 -77.15 177.37 7.89 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.174 -1.192 . . . . 0.0 110.202 179.988 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' ASN . . . . . 0.46 ' HB3' ' CD2' ' A' ' 18' ' ' PHE . 34.2 t-20 -102.81 -59.52 1.69 Allowed 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.207 -0.933 . . . . 0.0 110.367 179.994 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 18' ' ' PHE . . . . . 0.507 ' CE1' ' CB ' ' A' ' 29' ' ' ARG . 17.1 p90 -140.82 161.81 36.93 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.232 -0.918 . . . . 0.0 110.309 179.974 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 19' ' ' GLY . . . . . 0.506 ' HA2' ' HA ' ' A' ' 28' ' ' CYS . . . -148.04 -160.6 9.06 Favored Glycine 0 N--CA 1.49 2.285 0 N-CA-C 109.5 -1.44 . . . . 0.0 109.5 -179.927 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -177.63 170.64 1.98 Allowed 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.226 -1.161 . . . . 0.0 110.178 179.935 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 21' ' ' CYS . . . . . 0.475 ' C ' HG23 ' A' ' 22' ' ' VAL . 4.0 t -93.49 155.11 17.52 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.284 -0.885 . . . . 0.0 110.217 -179.936 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.475 HG23 ' C ' ' A' ' 21' ' ' CYS . 98.0 t -149.79 94.49 0.18 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.64 0 O-C-N 121.29 -0.881 . . . . 0.0 110.115 179.933 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER 50.62 65.79 1.35 Allowed 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.26 -0.9 . . . . 0.0 110.239 179.999 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 61.33 37.71 94.51 Favored Glycine 0 N--CA 1.491 2.32 0 N-CA-C 109.603 -1.399 . . . . 0.0 109.603 179.986 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' SER . . . . . 0.441 ' HB3' ' HB ' ' A' ' 22' ' ' VAL . 2.4 t -134.94 170.8 15.33 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.322 -1.104 . . . . 0.0 110.189 179.97 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 1.3 m -134.61 102.57 5.34 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.282 -0.886 . . . . 0.0 110.07 179.888 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 10.4 mm100 -105.24 164.82 11.55 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.399 -0.813 . . . . 0.0 110.318 -179.718 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' CYS . . . . . 0.506 ' HA ' ' HA2' ' A' ' 19' ' ' GLY . 59.4 m -145.79 158.03 43.88 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.301 -0.875 . . . . 0.0 110.294 -179.88 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.507 ' CB ' ' CE1' ' A' ' 18' ' ' PHE . 0.0 OUTLIER -138.37 149.13 45.26 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.306 -0.871 . . . . 0.0 110.159 179.927 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -109.21 -149.33 0.44 Allowed 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.315 -0.865 . . . . 0.0 110.266 179.977 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 18.1 p -108.15 -174.22 2.47 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.296 -0.877 . . . . 0.0 110.232 -179.967 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 18.9 p -121.19 57.9 0.99 Allowed 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.227 -0.921 . . . . 0.0 110.174 -179.982 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.177 0 CA-C-O 117.99 -1.45 . . . . 0.0 109.594 179.966 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.607 0 CA-C-O 121.18 0.514 . . . . 0.0 110.267 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' CYS . . . . . 0.449 ' O ' ' O ' ' A' ' 3' ' ' ASN . 19.4 p -80.9 -29.06 35.66 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.431 -0.793 . . . . 0.0 110.2 179.971 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 3' ' ' ASN . . . . . 0.449 ' O ' ' O ' ' A' ' 2' ' ' CYS . 2.1 t-20 59.92 124.02 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.256 -0.903 . . . . 0.0 110.208 -179.99 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 4' ' ' ASP . . . . . 0.452 ' OD1' ' HB2' ' A' ' 21' ' ' CYS . 0.3 OUTLIER -66.26 -28.63 68.86 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.276 -0.89 . . . . 0.0 110.239 -179.914 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 62.1 ttt180 -68.16 -44.96 74.83 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.26 -0.9 . . . . 0.0 110.149 -179.903 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 74.6 m-20 -79.4 -17.16 54.94 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.223 -0.923 . . . . 0.0 110.079 179.974 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.415 ' SG ' ' O ' ' A' ' 20' ' ' LYS . 14.7 t -82.73 -33.31 27.56 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.376 -0.827 . . . . 0.0 110.083 179.846 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 8' ' ' SER . . . . . 0.748 ' O ' HD12 ' A' ' 12' ' ' ILE . 34.8 p -80.94 -50.11 10.14 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.359 -0.838 . . . . 0.0 110.286 -179.909 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -56.01 -22.53 27.59 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.165 -0.96 . . . . 0.0 110.064 179.928 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -73.96 -47.02 40.39 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.309 -0.87 . . . . 0.0 110.125 179.934 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.457 ' O ' ' HB2' ' A' ' 16' ' ' TYR . 21.0 m -67.22 -44.73 78.8 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.184 -0.948 . . . . 0.0 109.989 179.918 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 12' ' ' ILE . . . . . 0.748 HD12 ' O ' ' A' ' 8' ' ' SER . 2.5 mt -63.74 -30.48 50.03 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.601 0 O-C-N 121.239 -0.913 . . . . 0.0 110.069 179.844 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -74.98 -28.25 60.48 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.223 -0.923 . . . . 0.0 110.126 179.82 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 3.2 mtpp -82.73 -18.07 42.09 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.327 -0.858 . . . . 0.0 110.339 179.973 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 117.65 8.87 10.6 Favored Glycine 0 N--CA 1.491 2.362 0 N-CA-C 109.635 -1.386 . . . . 0.0 109.635 179.836 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' TYR . . . . . 0.457 ' HB2' ' O ' ' A' ' 11' ' ' CYS . 40.4 m-85 -83.77 -172.5 4.19 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.18 -1.188 . . . . 0.0 110.139 179.965 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 17' ' ' ASN . . . . . 0.586 ' HB3' ' CE1' ' A' ' 18' ' ' PHE . 0.4 OUTLIER -133.05 0.49 3.45 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.219 -0.925 . . . . 0.0 110.475 -179.819 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 18' ' ' PHE . . . . . 0.586 ' CE1' ' HB3' ' A' ' 17' ' ' ASN . 5.9 m-85 -141.37 162.49 35.36 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.137 -0.977 . . . . 0.0 110.414 -179.948 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 19' ' ' GLY . . . . . 0.443 ' HA3' ' HA ' ' A' ' 8' ' ' SER . . . -156.85 121.4 1.07 Allowed Glycine 0 N--CA 1.49 2.239 0 N-CA-C 109.355 -1.498 . . . . 0.0 109.355 179.904 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.415 ' O ' ' SG ' ' A' ' 7' ' ' CYS . 23.1 ttpt -134.64 149.74 50.59 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.155 -1.203 . . . . 0.0 110.424 -179.787 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 21' ' ' CYS . . . . . 0.452 ' HB2' ' OD1' ' A' ' 4' ' ' ASP . 0.1 OUTLIER -105.57 126.54 52.25 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.357 -0.84 . . . . 0.0 110.042 179.829 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.42 HG23 ' C ' ' A' ' 21' ' ' CYS . 59.0 t -145.59 139.14 21.48 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.637 0 O-C-N 121.291 -0.881 . . . . 0.0 110.26 -179.897 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 42.2 mtm180 47.67 53.73 10.83 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.27 -0.893 . . . . 0.0 110.261 179.87 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 51.7 29.49 25.71 Favored Glycine 0 N--CA 1.49 2.259 0 N-CA-C 109.652 -1.379 . . . . 0.0 109.652 179.912 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 8.4 t -131.09 -170.61 2.4 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.227 -1.161 . . . . 0.0 110.235 -179.952 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 53.3 t -143.31 140.73 30.72 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.292 -0.88 . . . . 0.0 110.096 -179.976 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 30.3 mt-30 -120.28 141.78 49.68 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.127 -0.983 . . . . 0.0 110.619 -179.813 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 43.4 m -124.22 150.57 45.11 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.355 -0.841 . . . . 0.0 109.886 179.602 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.476 ' HB3' ' CD1' ' A' ' 18' ' ' PHE . 0.0 OUTLIER -136.38 161.12 36.68 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.131 -0.981 . . . . 0.0 110.227 -179.91 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.425 ' HG2' ' HA ' ' A' ' 16' ' ' TYR . 0.2 OUTLIER -119.49 173.08 7.2 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.187 -0.945 . . . . 0.0 110.002 179.927 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 2.1 p -78.46 140.82 38.6 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.207 -0.933 . . . . 0.0 110.22 179.929 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 12.0 m -154.71 -38.83 0.09 Allowed 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.323 -0.861 . . . . 0.0 110.169 -179.96 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.341 0 CA-C-O 118.015 -1.436 . . . . 0.0 109.563 -179.991 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.581 0 CA-C-O 121.283 0.564 . . . . 0.0 110.208 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' CYS . . . . . 0.453 ' O ' ' SG ' ' A' ' 2' ' ' CYS . 10.6 t -99.95 73.66 1.76 Allowed 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.22 -0.925 . . . . 0.0 110.088 179.973 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -79.11 134.08 36.74 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.235 -0.916 . . . . 0.0 110.228 179.988 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 4' ' ' ASP . . . . . 0.508 ' OD1' ' N ' ' A' ' 4' ' ' ASP . 8.6 p-10 -57.01 -41.3 78.24 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.235 -0.916 . . . . 0.0 110.208 179.9 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 7.0 tpt180 -62.25 -42.46 99.35 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.24 -0.912 . . . . 0.0 109.925 179.942 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -79.34 -17.04 55.34 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.365 -0.834 . . . . 0.0 109.741 179.608 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.454 ' O ' ' SG ' ' A' ' 11' ' ' CYS . 0.9 OUTLIER -78.0 -33.02 51.48 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.43 -0.794 . . . . 0.0 109.874 179.618 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 8' ' ' SER . . . . . 0.452 ' O ' HG13 ' A' ' 12' ' ' ILE . 0.3 OUTLIER -82.04 -43.99 17.21 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.393 -0.817 . . . . 0.0 110.152 179.734 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.4 mt -55.32 -46.94 76.31 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.262 -0.899 . . . . 0.0 110.193 179.943 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 19.9 t0 -63.77 -37.37 87.1 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.274 -0.891 . . . . 0.0 110.168 179.977 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.454 ' SG ' ' O ' ' A' ' 7' ' ' CYS . 82.4 m -66.32 -41.07 90.19 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.26 -0.9 . . . . 0.0 109.849 179.86 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 12' ' ' ILE . . . . . 0.452 HG13 ' O ' ' A' ' 8' ' ' SER . 81.4 mt -63.83 -35.65 73.92 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.587 0 O-C-N 121.322 -0.861 . . . . 0.0 109.901 179.822 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -70.72 -28.66 64.89 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.275 -0.891 . . . . 0.0 109.83 179.769 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.29 -23.93 46.94 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.313 -0.867 . . . . 0.0 110.132 179.889 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 124.52 -3.15 8.8 Favored Glycine 0 N--CA 1.491 2.348 0 N-CA-C 109.592 -1.403 . . . . 0.0 109.592 179.957 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' TYR . . . . . 0.417 ' CD2' ' CB ' ' A' ' 28' ' ' CYS . 48.1 m-85 -86.96 -175.71 5.46 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.126 -1.22 . . . . 0.0 110.334 -179.955 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 28.1 m-80 -109.18 -55.01 2.47 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.265 -0.897 . . . . 0.0 110.223 -179.979 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' PHE . . . . . 0.605 ' CE2' ' HB2' ' A' ' 29' ' ' ARG . 8.2 p90 -129.62 170.15 14.14 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.154 -0.967 . . . . 0.0 110.408 179.958 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -140.15 -178.38 16.86 Favored Glycine 0 N--CA 1.49 2.297 0 N-CA-C 109.405 -1.478 . . . . 0.0 109.405 179.952 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -164.62 160.9 20.58 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.227 -1.161 . . . . 0.0 110.323 179.96 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 21' ' ' CYS . . . . . 0.466 ' HA ' ' O ' ' A' ' 25' ' ' SER . 1.8 t -92.94 141.14 28.74 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.235 -0.916 . . . . 0.0 110.351 -179.851 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.442 ' O ' ' HB2' ' A' ' 25' ' ' SER . 72.8 t -147.42 123.85 2.91 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.614 0 O-C-N 121.301 -0.874 . . . . 0.0 110.058 179.894 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 23' ' ' ARG . . . . . 0.436 ' HB2' ' O ' ' A' ' 22' ' ' VAL . 3.7 mmm-85 55.43 35.79 25.77 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.275 -0.89 . . . . 0.0 110.13 -179.904 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 73.17 29.19 64.88 Favored Glycine 0 N--CA 1.489 2.218 0 N-CA-C 109.5 -1.44 . . . . 0.0 109.5 -179.925 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 25' ' ' SER . . . . . 0.466 ' O ' ' HA ' ' A' ' 21' ' ' CYS . 69.7 m -129.3 -171.59 2.53 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.283 -1.128 . . . . 0.0 110.307 179.999 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 47.3 t -141.53 121.41 13.59 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.346 -0.846 . . . . 0.0 110.181 179.956 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 4.8 mm-40 -120.21 174.74 6.31 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.171 -0.956 . . . . 0.0 110.458 -179.915 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 28' ' ' CYS . . . . . 0.417 ' CB ' ' CD2' ' A' ' 16' ' ' TYR . 73.1 m -125.05 149.58 47.65 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.323 -0.861 . . . . 0.0 110.085 179.886 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.605 ' HB2' ' CE2' ' A' ' 18' ' ' PHE . 0.7 OUTLIER -136.42 146.03 45.94 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.216 -0.928 . . . . 0.0 110.258 -179.916 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -96.29 166.6 11.65 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.259 -0.901 . . . . 0.0 110.241 -179.98 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 36.7 p -80.13 168.99 18.44 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.206 -0.934 . . . . 0.0 110.218 179.978 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 75.6 p -132.54 132.54 42.71 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.271 -0.893 . . . . 0.0 110.288 179.962 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.358 0 CA-C-O 117.939 -1.479 . . . . 0.0 109.613 -179.95 . . . . . . . . 0 0 . 1 . 021 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.593 0 CA-C-O 121.272 0.558 . . . . 0.0 110.199 . . . . . . . . . 0 0 . 1 . 021 nuclear build full ' A' A ' 2' ' ' CYS . . . . . 0.434 ' O ' ' SG ' ' A' ' 2' ' ' CYS . 15.8 p -93.52 133.41 36.86 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.263 -0.898 . . . . 0.0 110.236 -179.984 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 3' ' ' ASN . . . . . 0.467 ' O ' ' HB2' ' A' ' 7' ' ' CYS . 20.4 t-20 -100.54 125.14 46.86 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.3 -0.875 . . . . 0.0 110.253 -179.945 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 4' ' ' ASP . . . . . 0.472 ' HA ' ' HB3' ' A' ' 7' ' ' CYS . 3.6 m-20 -66.58 -34.37 77.74 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.197 -0.939 . . . . 0.0 110.38 179.976 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 0.454 ' O ' ' HB2' ' A' ' 9' ' ' LEU . 1.8 mmm-85 -62.15 -54.47 40.69 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.159 -0.963 . . . . 0.0 110.125 179.951 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -79.5 2.22 22.85 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.239 -0.913 . . . . 0.0 110.045 179.758 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.472 ' HB3' ' HA ' ' A' ' 4' ' ' ASP . 14.8 t -95.3 -40.44 9.54 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.254 -0.904 . . . . 0.0 109.997 179.97 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 26.8 t -86.42 -35.39 19.75 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.376 -0.828 . . . . 0.0 110.045 179.875 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.454 ' HB2' ' O ' ' A' ' 5' ' ' ARG . 0.6 OUTLIER -55.22 -47.53 75.18 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.208 -0.932 . . . . 0.0 110.008 179.944 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -65.13 -35.02 79.79 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.321 -0.862 . . . . 0.0 110.122 179.912 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 1.5 t -70.45 -39.37 74.36 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.214 -0.929 . . . . 0.0 110.131 179.968 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 39.8 mt -63.55 -35.44 72.64 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.579 0 O-C-N 121.2 -0.938 . . . . 0.0 109.809 179.703 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -77.77 -27.57 50.31 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.382 -0.824 . . . . 0.0 109.754 179.39 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.51 -27.82 65.51 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.354 -0.841 . . . . 0.0 109.958 179.743 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 121.89 10.82 6.15 Favored Glycine 0 N--CA 1.489 2.192 0 N-CA-C 109.669 -1.373 . . . . 0.0 109.669 179.983 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 60.6 m-85 -93.44 -161.73 0.87 Allowed 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.301 -1.117 . . . . 0.0 110.327 -179.958 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 17' ' ' ASN . . . . . 0.693 ' OD1' HG23 ' A' ' 31' ' ' THR . 1.8 t-20 -119.76 -51.44 2.26 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.264 -0.898 . . . . 0.0 110.36 -179.882 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 18' ' ' PHE . . . . . 0.588 ' CE1' ' HB2' ' A' ' 29' ' ' ARG . 6.5 p90 -161.84 156.66 22.93 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.277 -0.889 . . . . 0.0 110.154 -179.817 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 19' ' ' GLY . . . . . 0.514 ' HA2' ' HA ' ' A' ' 28' ' ' CYS . . . -127.88 -149.69 7.15 Favored Glycine 0 N--CA 1.491 2.363 0 N-CA-C 109.684 -1.366 . . . . 0.0 109.684 179.946 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.507 ' O ' ' HA ' ' A' ' 26' ' ' CYS . 9.7 tttp -175.26 152.98 1.48 Allowed 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.233 -1.157 . . . . 0.0 110.177 179.962 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 0.3 OUTLIER -90.84 129.58 36.88 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.274 -0.891 . . . . 0.0 110.312 179.957 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.446 ' O ' ' N ' ' A' ' 24' ' ' GLY . 84.5 t -109.72 98.35 6.92 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.613 0 O-C-N 121.242 -0.911 . . . . 0.0 110.07 -179.974 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 59.37 -84.81 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.174 -0.954 . . . . 0.0 110.13 -179.844 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 24' ' ' GLY . . . . . 0.446 ' N ' ' O ' ' A' ' 22' ' ' VAL . . . -126.05 15.71 6.9 Favored Glycine 0 N--CA 1.49 2.297 0 N-CA-C 109.527 -1.429 . . . . 0.0 109.527 179.887 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -130.87 -163.71 1.35 Allowed 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.264 -1.139 . . . . 0.0 110.076 179.88 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 26' ' ' CYS . . . . . 0.507 ' HA ' ' O ' ' A' ' 20' ' ' LYS . 0.5 OUTLIER -158.24 132.97 8.33 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.167 -0.958 . . . . 0.0 110.33 179.83 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 10.0 mm100 -108.89 -174.14 2.44 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.353 -0.842 . . . . 0.0 110.301 -179.935 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 28' ' ' CYS . . . . . 0.514 ' HA ' ' HA2' ' A' ' 19' ' ' GLY . 1.1 m -140.46 153.21 46.18 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.327 -0.858 . . . . 0.0 110.207 -179.994 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.588 ' HB2' ' CE1' ' A' ' 18' ' ' PHE . 4.5 mmt180 -144.04 137.95 28.0 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.309 -0.869 . . . . 0.0 110.286 -179.957 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -96.3 -156.68 0.54 Allowed 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.23 -0.919 . . . . 0.0 110.147 179.913 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 31' ' ' THR . . . . . 0.693 HG23 ' OD1' ' A' ' 17' ' ' ASN . 0.1 OUTLIER -113.61 156.84 22.95 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.257 -0.902 . . . . 0.0 110.113 179.914 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 46.9 t -85.83 77.19 9.79 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.248 -0.907 . . . . 0.0 110.225 -179.962 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.317 0 N-CA-C 109.557 -1.417 . . . . 0.0 109.557 179.954 . . . . . . . . 0 0 . 1 . 022 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.651 0 CA-C-O 121.113 0.483 . . . . 0.0 110.088 . . . . . . . . . 0 0 . 1 . 022 nuclear build full ' A' A ' 2' ' ' CYS . . . . . 0.447 ' SG ' ' O ' ' A' ' 25' ' ' SER . 12.0 p -99.02 137.72 37.14 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.225 -0.922 . . . . 0.0 110.174 -179.943 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 2.8 m-20 -111.9 133.53 54.04 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.279 -0.888 . . . . 0.0 110.143 -179.937 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -50.75 -34.57 27.72 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.211 -0.931 . . . . 0.0 110.101 179.961 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -65.76 -49.89 66.73 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.254 -0.904 . . . . 0.0 110.084 179.812 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -79.68 0.86 28.62 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.243 -0.911 . . . . 0.0 110.098 179.846 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 11.6 t -100.23 -36.75 9.18 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.184 -0.947 . . . . 0.0 110.169 179.908 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 8' ' ' SER . . . . . 0.441 ' OG ' ' HA3' ' A' ' 19' ' ' GLY . 0.1 OUTLIER -86.57 -35.26 19.58 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.296 -0.878 . . . . 0.0 110.091 179.909 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.478 ' HA ' HD12 ' A' ' 12' ' ' ILE . 2.2 mt -55.52 -55.36 32.83 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.258 -0.901 . . . . 0.0 110.136 179.924 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -62.78 -30.59 71.57 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.321 -0.862 . . . . 0.0 110.016 179.819 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 1.2 m -74.81 -39.48 61.66 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.316 -0.865 . . . . 0.0 110.098 179.856 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 12' ' ' ILE . . . . . 0.478 HD12 ' HA ' ' A' ' 9' ' ' LEU . 36.0 mt -63.64 -32.02 55.24 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.581 0 O-C-N 121.337 -0.852 . . . . 0.0 110.006 179.881 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -86.76 -20.24 27.93 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.33 -0.856 . . . . 0.0 110.016 179.826 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.62 -22.08 51.33 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.394 -0.816 . . . . 0.0 110.155 179.928 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 126.04 5.42 6.25 Favored Glycine 0 N--CA 1.49 2.271 0 N-CA-C 109.642 -1.383 . . . . 0.0 109.642 -179.999 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 78.0 m-85 -94.41 -172.58 2.82 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.199 -1.177 . . . . 0.0 110.129 179.976 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 17' ' ' ASN . . . . . 0.479 ' HB3' ' CE2' ' A' ' 18' ' ' PHE . 44.1 t30 -139.08 7.05 2.42 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.135 -0.978 . . . . 0.0 110.2 179.907 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 18' ' ' PHE . . . . . 0.479 ' CE2' ' HB3' ' A' ' 17' ' ' ASN . 49.1 m-85 -143.62 168.97 18.62 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.252 -0.905 . . . . 0.0 110.155 179.946 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 19' ' ' GLY . . . . . 0.441 ' HA3' ' OG ' ' A' ' 8' ' ' SER . . . -155.73 100.17 0.19 Allowed Glycine 0 N--CA 1.49 2.283 0 N-CA-C 109.434 -1.466 . . . . 0.0 109.434 179.953 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -120.39 137.97 54.01 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.205 -1.174 . . . . 0.0 110.247 -179.806 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -87.32 153.35 21.54 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.214 -0.929 . . . . 0.0 110.191 -179.981 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.502 HG21 ' HG3' ' A' ' 27' ' ' GLN . 35.8 t -126.57 61.44 0.29 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.56 0 O-C-N 121.247 -0.908 . . . . 0.0 110.167 179.893 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 3.3 mpp_? 60.26 63.86 1.33 Allowed 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.364 -0.835 . . . . 0.0 110.141 -179.808 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 92.15 13.09 58.02 Favored Glycine 0 N--CA 1.49 2.29 0 N-CA-C 109.493 -1.443 . . . . 0.0 109.493 -179.885 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 25' ' ' SER . . . . . 0.487 ' CB ' ' HB ' ' A' ' 22' ' ' VAL . 0.6 OUTLIER -133.28 -175.93 3.97 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.257 -1.143 . . . . 0.0 110.164 179.971 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 12.2 t -150.26 114.87 5.24 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.237 -0.914 . . . . 0.0 110.386 -179.977 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.502 ' HG3' HG21 ' A' ' 22' ' ' VAL . 2.7 mm100 -114.79 161.5 18.1 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.188 -0.945 . . . . 0.0 110.123 179.844 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 28' ' ' CYS . . . . . 0.451 ' SG ' ' O ' ' A' ' 27' ' ' GLN . 86.4 m -150.0 -178.45 6.49 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.223 -0.923 . . . . 0.0 110.333 -179.952 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -146.98 163.1 37.3 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.272 -0.892 . . . . 0.0 110.195 -179.986 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -119.95 148.38 43.6 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.235 -0.915 . . . . 0.0 110.183 179.927 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 77.7 p -93.07 151.31 19.95 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.305 -0.872 . . . . 0.0 110.164 -179.984 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 6.2 m -112.78 -28.1 7.89 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.216 -0.927 . . . . 0.0 110.259 -179.974 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.31 0 CA-C-O 118.035 -1.425 . . . . 0.0 109.542 -179.996 . . . . . . . . 0 0 . 1 . 023 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.638 0 CA-C-O 121.246 0.546 . . . . 0.0 110.189 . . . . . . . . . 0 0 . 1 . 023 nuclear build full ' A' A ' 2' ' ' CYS . . . . . 0.473 ' O ' ' HB3' ' A' ' 3' ' ' ASN . 26.6 p -106.14 -25.66 11.92 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.365 -0.834 . . . . 0.0 110.253 -179.911 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 3' ' ' ASN . . . . . 0.473 ' HB3' ' O ' ' A' ' 2' ' ' CYS . 8.9 t-20 62.71 126.24 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.228 -0.92 . . . . 0.0 110.104 -179.743 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -76.11 -18.78 59.02 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.237 -0.914 . . . . 0.0 110.412 -179.776 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -67.85 -55.78 11.64 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.256 -0.903 . . . . 0.0 110.288 -179.814 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 42.9 m-20 -79.33 -6.64 57.19 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.244 -0.91 . . . . 0.0 110.314 -179.799 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 53.1 t -90.28 -42.32 11.05 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.225 -0.922 . . . . 0.0 110.082 179.854 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 3.1 m -78.2 -43.18 29.2 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.266 -0.896 . . . . 0.0 110.174 -179.996 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 40.2 mt -54.61 -47.95 72.79 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.307 -0.871 . . . . 0.0 110.215 -179.893 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 10' ' ' ASP . . . . . 0.468 ' O ' ' HG3' ' A' ' 14' ' ' LYS . 0.2 OUTLIER -66.6 -33.35 75.46 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.276 -0.89 . . . . 0.0 110.361 179.978 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 7.4 m -68.26 -45.73 72.36 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.24 -0.913 . . . . 0.0 110.369 179.998 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 68.2 mt -68.13 -33.19 59.5 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.645 0 O-C-N 121.228 -0.92 . . . . 0.0 110.351 -179.866 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -67.04 -37.65 84.45 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.193 -0.942 . . . . 0.0 110.427 -179.878 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 14' ' ' LYS . . . . . 0.468 ' HG3' ' O ' ' A' ' 10' ' ' ASP . 8.3 mttm -63.02 -27.49 69.45 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.243 -0.91 . . . . 0.0 110.325 -179.834 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 133.23 -2.62 4.7 Favored Glycine 0 N--CA 1.491 2.31 0 N-CA-C 109.745 -1.342 . . . . 0.0 109.745 179.958 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 16' ' ' TYR . . . . . 0.426 ' HA ' ' HG2' ' A' ' 30' ' ' ARG . 96.8 m-85 -83.79 179.35 7.6 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.149 -1.207 . . . . 0.0 110.354 -179.859 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 17' ' ' ASN . . . . . 0.583 ' HB3' ' CD2' ' A' ' 18' ' ' PHE . 1.5 t-20 -103.46 -46.61 4.52 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.347 -0.846 . . . . 0.0 109.875 179.688 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 18' ' ' PHE . . . . . 0.592 ' CE1' ' HB3' ' A' ' 29' ' ' ARG . 32.6 p90 -154.18 140.09 18.21 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.34 -0.85 . . . . 0.0 110.013 179.643 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 19' ' ' GLY . . . . . 0.512 ' CA ' ' HA ' ' A' ' 28' ' ' CYS . . . -119.89 -152.03 8.92 Favored Glycine 0 N--CA 1.49 2.242 0 N-CA-C 109.575 -1.41 . . . . 0.0 109.575 -179.97 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -178.36 166.44 1.86 Allowed 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.27 -1.135 . . . . 0.0 110.184 -179.945 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 21' ' ' CYS . . . . . 0.462 ' HA ' ' O ' ' A' ' 25' ' ' SER . 12.3 t -84.98 142.76 29.39 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.228 -0.92 . . . . 0.0 110.297 -179.938 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.589 ' O ' HG12 ' A' ' 22' ' ' VAL . 19.3 t -130.15 88.05 1.07 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.499 0 O-C-N 121.218 -0.926 . . . . 0.0 110.011 179.838 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 23' ' ' ARG . . . . . 0.412 ' HB2' ' O ' ' A' ' 22' ' ' VAL . 42.5 mtt180 54.23 74.69 0.32 Allowed 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.327 -0.858 . . . . 0.0 110.114 -179.926 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 59.37 28.55 64.79 Favored Glycine 0 N--CA 1.49 2.292 0 N-CA-C 109.521 -1.432 . . . . 0.0 109.521 -179.967 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 25' ' ' SER . . . . . 0.462 ' O ' ' HA ' ' A' ' 21' ' ' CYS . 2.1 m -136.96 176.38 8.77 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.27 -1.135 . . . . 0.0 110.172 -179.979 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 45.9 t -137.23 121.78 18.43 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.222 -0.924 . . . . 0.0 110.312 179.946 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.439 ' O ' ' HA3' ' A' ' 19' ' ' GLY . 1.7 mm-40 -120.03 161.21 21.34 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.278 -0.889 . . . . 0.0 110.14 179.849 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 28' ' ' CYS . . . . . 0.512 ' HA ' ' CA ' ' A' ' 19' ' ' GLY . 17.9 m -119.79 139.39 52.39 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.341 -0.85 . . . . 0.0 110.03 179.905 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.592 ' HB3' ' CE1' ' A' ' 18' ' ' PHE . 1.1 mtm180 -120.16 143.08 48.4 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.167 -0.958 . . . . 0.0 110.29 -179.989 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.426 ' HG2' ' HA ' ' A' ' 16' ' ' TYR . 0.0 OUTLIER -105.15 163.76 12.33 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.28 -0.888 . . . . 0.0 110.161 179.975 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -84.03 -163.32 0.76 Allowed 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.25 -0.907 . . . . 0.0 110.107 -179.917 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -98.75 82.97 2.88 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.273 -0.892 . . . . 0.0 110.248 179.976 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.343 0 CA-C-O 118.02 -1.433 . . . . 0.0 109.52 179.972 . . . . . . . . 0 0 . 1 . 024 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.613 0 CA-C-O 121.203 0.525 . . . . 0.0 110.112 . . . . . . . . . 0 0 . 1 . 024 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 13.2 p -83.48 145.18 29.08 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.157 -0.964 . . . . 0.0 110.161 -179.991 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -116.1 156.42 26.43 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.143 -0.973 . . . . 0.0 110.278 -179.884 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 33.1 m-20 -61.93 -34.64 76.46 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.225 -0.922 . . . . 0.0 109.933 179.732 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 0.413 ' O ' HD12 ' A' ' 9' ' ' LEU . 38.2 ttt180 -79.46 -38.18 35.18 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.289 -0.882 . . . . 0.0 109.855 179.737 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 24.9 t0 -79.52 -12.44 59.86 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.346 -0.846 . . . . 0.0 110.088 179.852 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 28.4 t -96.18 -35.32 11.34 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.313 -0.867 . . . . 0.0 110.172 179.982 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 11.5 p -78.02 -36.02 49.12 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.288 -0.882 . . . . 0.0 110.252 -179.89 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.413 HD12 ' O ' ' A' ' 5' ' ' ARG . 8.4 mt -53.49 -44.56 69.14 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.226 -0.921 . . . . 0.0 110.303 -179.999 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 10' ' ' ASP . . . . . 0.453 ' O ' ' HG3' ' A' ' 14' ' ' LYS . 19.8 t0 -72.24 -31.92 66.25 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.144 -0.972 . . . . 0.0 110.107 179.817 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.446 ' O ' ' HB2' ' A' ' 16' ' ' TYR . 55.7 m -66.76 -38.19 86.1 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.29 -0.881 . . . . 0.0 110.222 179.987 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 16.0 mt -71.54 -45.32 68.44 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.569 0 O-C-N 121.199 -0.938 . . . . 0.0 110.102 -179.99 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 1.4 ttt -63.79 -29.15 70.39 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.228 -0.92 . . . . 0.0 110.111 179.916 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 14' ' ' LYS . . . . . 0.453 ' HG3' ' O ' ' A' ' 10' ' ' ASP . 22.6 mttt -68.4 -20.25 64.66 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.359 -0.838 . . . . 0.0 110.153 179.842 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 119.82 -5.14 12.76 Favored Glycine 0 N--CA 1.491 2.323 0 N-CA-C 109.624 -1.39 . . . . 0.0 109.624 179.958 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 16' ' ' TYR . . . . . 0.446 ' HB2' ' O ' ' A' ' 11' ' ' CYS . 58.5 m-85 -86.73 -155.73 0.28 Allowed 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.238 -1.154 . . . . 0.0 110.083 179.96 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -129.2 -65.02 0.88 Allowed 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.117 -0.99 . . . . 0.0 110.259 -179.995 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 18' ' ' PHE . . . . . 0.558 ' CE1' ' HB3' ' A' ' 29' ' ' ARG . 39.7 p90 -129.11 139.83 51.81 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.272 -0.892 . . . . 0.0 110.301 -179.958 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 19' ' ' GLY . . . . . 0.481 ' HA3' ' O ' ' A' ' 27' ' ' GLN . . . -121.68 -162.88 11.77 Favored Glycine 0 N--CA 1.49 2.285 0 N-CA-C 109.571 -1.412 . . . . 0.0 109.571 179.997 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -162.31 151.76 15.84 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.35 -1.089 . . . . 0.0 110.198 -179.949 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 21' ' ' CYS . . . . . 0.465 ' HA ' ' O ' ' A' ' 25' ' ' SER . 0.8 OUTLIER -86.11 140.87 29.83 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.242 -0.911 . . . . 0.0 110.125 179.844 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.51 HG21 ' OE1' ' A' ' 27' ' ' GLN . 15.6 t -136.27 96.41 1.5 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.604 0 O-C-N 121.143 -0.973 . . . . 0.0 110.128 -179.998 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 23' ' ' ARG . . . . . 0.419 ' O ' ' C ' ' A' ' 24' ' ' GLY . 16.7 mtt180 52.16 85.43 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.192 -0.942 . . . . 0.0 110.144 -179.908 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 24' ' ' GLY . . . . . 0.419 ' C ' ' O ' ' A' ' 23' ' ' ARG . . . 44.88 33.34 3.51 Favored Glycine 0 N--CA 1.491 2.3 0 N-CA-C 109.362 -1.495 . . . . 0.0 109.362 -179.791 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 25' ' ' SER . . . . . 0.5 ' CB ' ' O ' ' A' ' 22' ' ' VAL . 0.8 OUTLIER -138.03 165.14 27.33 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.237 -1.155 . . . . 0.0 110.15 -179.913 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 24.6 t -134.84 127.62 31.13 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.185 -0.947 . . . . 0.0 110.312 -179.979 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.51 ' OE1' HG21 ' A' ' 22' ' ' VAL . 27.5 mt-30 -118.85 159.6 23.46 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.339 -0.851 . . . . 0.0 109.978 179.82 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 61.9 m -120.67 136.0 54.96 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.196 -0.94 . . . . 0.0 110.26 -179.866 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.558 ' HB3' ' CE1' ' A' ' 18' ' ' PHE . 5.8 mmt180 -124.3 136.46 54.14 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.312 -0.867 . . . . 0.0 110.285 -179.968 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.427 ' HG3' ' HA ' ' A' ' 16' ' ' TYR . 0.9 OUTLIER -106.12 177.36 4.88 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.383 -0.823 . . . . 0.0 110.182 179.901 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -79.68 131.65 36.01 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.241 -0.912 . . . . 0.0 110.177 -179.906 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -122.36 -24.38 5.03 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.254 -0.904 . . . . 0.0 110.135 -179.965 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.329 0 CA-C-O 117.997 -1.446 . . . . 0.0 109.528 -179.909 . . . . . . . . 0 0 . 1 . 025 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.658 0 CA-C-O 121.205 0.526 . . . . 0.0 110.195 . . . . . . . . . 0 0 . 1 . 025 nuclear build full ' A' A ' 2' ' ' CYS . . . . . 0.428 ' O ' ' HB2' ' A' ' 3' ' ' ASN . 28.5 p -101.2 -8.66 22.0 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.29 -0.881 . . . . 0.0 110.307 -179.999 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 3' ' ' ASN . . . . . 0.428 ' HB2' ' O ' ' A' ' 2' ' ' CYS . 29.5 m-20 57.97 98.2 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.283 -0.885 . . . . 0.0 110.163 -179.919 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -69.47 -38.2 77.62 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.21 -0.931 . . . . 0.0 110.307 -179.928 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.85 -39.85 95.19 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.262 -0.899 . . . . 0.0 110.308 -179.98 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -79.68 -21.94 44.07 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.283 -0.886 . . . . 0.0 110.332 -179.9 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 8.6 t -78.41 -34.4 48.08 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.233 -0.917 . . . . 0.0 110.05 179.863 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 22.8 m -81.31 -34.72 31.71 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.241 -0.912 . . . . 0.0 110.118 179.909 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 8.6 mt -61.86 -51.95 66.1 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.217 -0.927 . . . . 0.0 110.205 179.855 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -62.64 -29.41 70.6 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.183 -0.948 . . . . 0.0 109.942 179.776 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 1.3 m -72.59 -47.86 44.53 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.289 -0.882 . . . . 0.0 110.143 179.816 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 40.9 mt -63.38 -22.45 30.84 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.599 0 O-C-N 121.306 -0.871 . . . . 0.0 109.88 179.828 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -77.86 -40.89 38.69 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.374 -0.829 . . . . 0.0 110.039 179.779 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -59.66 -48.35 82.02 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.277 -0.889 . . . . 0.0 110.089 179.936 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 144.65 36.71 0.07 OUTLIER Glycine 0 N--CA 1.492 2.388 0 N-CA-C 109.934 -1.266 . . . . 0.0 109.934 179.752 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 16' ' ' TYR . . . . . 0.541 ' CD1' ' HG3' ' A' ' 30' ' ' ARG . 64.8 m-85 -108.64 -164.38 0.95 Allowed 'General case' 0 N--CA 1.487 1.394 0 O-C-N 121.119 -1.224 . . . . 0.0 110.042 179.744 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 17' ' ' ASN . . . . . 0.557 ' HB3' ' CD1' ' A' ' 18' ' ' PHE . 51.9 t-20 -128.84 -54.41 1.22 Allowed 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.123 -0.985 . . . . 0.0 110.486 -179.941 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 18' ' ' PHE . . . . . 0.599 ' N ' ' CD1' ' A' ' 18' ' ' PHE . 5.8 p90 -131.73 150.4 52.16 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.129 -0.982 . . . . 0.0 110.177 179.95 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 19' ' ' GLY . . . . . 0.481 ' HA2' ' HA ' ' A' ' 28' ' ' CYS . . . -155.82 -176.64 28.2 Favored Glycine 0 N--CA 1.49 2.272 0 N-CA-C 109.812 -1.315 . . . . 0.0 109.812 -179.868 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -174.66 171.89 3.15 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.279 -1.13 . . . . 0.0 110.112 -179.974 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 21' ' ' CYS . . . . . 0.437 ' HA ' ' O ' ' A' ' 25' ' ' SER . 52.1 t -90.35 135.92 33.38 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.223 -0.923 . . . . 0.0 110.136 179.921 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.487 ' HB ' ' HB3' ' A' ' 25' ' ' SER . 5.2 t -113.98 85.45 0.82 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.625 0 O-C-N 121.146 -0.971 . . . . 0.0 110.196 -179.995 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 54.01 72.34 0.45 Allowed 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.264 -0.898 . . . . 0.0 110.223 179.917 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 65.0 34.76 90.74 Favored Glycine 0 N--CA 1.49 2.282 0 N-CA-C 109.624 -1.39 . . . . 0.0 109.624 179.853 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 25' ' ' SER . . . . . 0.487 ' HB3' ' HB ' ' A' ' 22' ' ' VAL . 8.7 t -140.26 175.59 9.47 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.237 -1.155 . . . . 0.0 110.263 -179.993 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 52.8 t -135.27 97.72 3.78 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.265 -0.897 . . . . 0.0 110.136 179.909 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.46 ' HB2' ' CG2' ' A' ' 22' ' ' VAL . 28.1 mt-30 -113.42 151.23 31.63 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.269 -0.894 . . . . 0.0 110.251 -179.877 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 28' ' ' CYS . . . . . 0.481 ' HA ' ' HA2' ' A' ' 19' ' ' GLY . 91.2 m -144.77 168.96 18.97 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.297 -0.877 . . . . 0.0 110.16 179.857 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.59 ' HB2' ' CE2' ' A' ' 18' ' ' PHE . 1.8 mpt_? -136.21 167.63 20.92 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.308 -0.87 . . . . 0.0 110.283 -179.752 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 30' ' ' ARG . . . . . 0.541 ' HG3' ' CD1' ' A' ' 16' ' ' TYR . 0.0 OUTLIER -118.24 -155.87 0.62 Allowed 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.275 -0.89 . . . . 0.0 110.17 -179.987 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 69.7 p -113.01 127.78 56.32 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.277 -0.889 . . . . 0.0 110.207 179.96 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 3.6 t -93.91 133.03 37.76 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.175 -0.953 . . . . 0.0 110.236 179.931 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.376 0 N-CA-C 109.508 -1.437 . . . . 0.0 109.508 -179.9 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . 0.458 ' O ' ' SG ' ' A' ' 7' ' ' CYS . 11.4 t . . . . . 0 N--CA 1.49 1.546 0 CA-C-O 121.25 0.548 . . . . 0.0 110.206 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 3' ' ' ASN . . . . . 0.464 ' O ' ' HB2' ' A' ' 7' ' ' CYS . 15.7 m120 48.0 84.22 0.03 OUTLIER 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.211 -0.931 . . . . 0.0 110.107 -179.96 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -52.02 -25.77 9.24 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.296 -0.877 . . . . 0.0 110.688 -179.824 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . 0.466 ' O ' ' HB2' ' A' ' 9' ' ' LEU . 0.0 OUTLIER -79.39 -45.24 19.91 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.073 -1.017 . . . . 0.0 110.481 -179.694 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -79.6 -18.4 51.7 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.193 -0.942 . . . . 0.0 110.218 -179.887 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.468 ' O ' ' HB2' ' A' ' 11' ' ' CYS . 0.5 OUTLIER -83.53 -43.36 15.81 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.301 -0.874 . . . . 0.0 110.08 179.849 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . 0.435 ' O ' HG13 ' A' ' 12' ' ' ILE . 86.0 p -72.17 -39.64 68.53 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.266 -0.896 . . . . 0.0 110.335 -179.92 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.466 ' HB2' ' O ' ' A' ' 5' ' ' ARG . 0.2 OUTLIER -63.14 -51.4 66.65 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.248 -0.907 . . . . 0.0 110.343 -179.84 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -62.85 -35.95 81.64 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.261 -0.899 . . . . 0.0 110.457 -179.793 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.468 ' HB2' ' O ' ' A' ' 7' ' ' CYS . 0.5 OUTLIER -73.39 -43.83 59.74 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.109 -0.995 . . . . 0.0 110.425 -179.942 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . 0.435 HG13 ' O ' ' A' ' 8' ' ' SER . 47.6 mt -63.42 -23.18 32.65 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.614 0 O-C-N 121.185 -0.947 . . . . 0.0 109.885 179.906 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 1.9 ttt -80.22 -39.52 28.92 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.318 -0.864 . . . . 0.0 109.859 179.62 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 40.4 mtmt -54.03 -29.61 44.4 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.251 -0.905 . . . . 0.0 110.076 179.752 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 128.44 5.82 4.93 Favored Glycine 0 N--CA 1.491 2.321 0 N-CA-C 109.839 -1.304 . . . . 0.0 109.839 179.852 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 25.7 m-85 -80.37 -177.97 6.42 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.149 -1.206 . . . . 0.0 110.143 -179.975 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . 0.468 ' HB3' ' CD2' ' A' ' 18' ' ' PHE . 3.5 t-20 -108.31 -51.39 2.9 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.189 -0.945 . . . . 0.0 110.174 -179.915 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . 0.564 ' CE1' ' CB ' ' A' ' 29' ' ' ARG . 8.9 p90 -151.42 159.07 44.4 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.283 -0.886 . . . . 0.0 110.372 -179.917 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . 0.518 ' CA ' ' HA ' ' A' ' 28' ' ' CYS . . . -153.42 -162.05 10.77 Favored Glycine 0 N--CA 1.49 2.279 0 N-CA-C 109.372 -1.491 . . . . 0.0 109.372 179.938 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.439 ' HB3' ' O ' ' A' ' 19' ' ' GLY . 1.6 pttt 176.79 160.94 0.39 Allowed 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.288 -1.125 . . . . 0.0 110.275 179.891 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 74.1 m -82.92 137.81 34.08 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.153 -0.967 . . . . 0.0 110.086 179.899 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.489 ' O ' ' N ' ' A' ' 25' ' ' SER . 41.7 t -131.85 131.11 61.96 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.568 0 O-C-N 121.271 -0.893 . . . . 0.0 110.208 179.951 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . 0.426 ' C ' ' O ' ' A' ' 22' ' ' VAL . 0.8 OUTLIER 42.88 40.97 2.36 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.287 -0.883 . . . . 0.0 110.288 179.955 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 72.47 27.17 70.11 Favored Glycine 0 N--CA 1.491 2.35 0 N-CA-C 109.728 -1.349 . . . . 0.0 109.728 179.964 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . 0.489 ' N ' ' O ' ' A' ' 22' ' ' VAL . 13.3 m -121.06 -173.37 2.59 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.217 -1.167 . . . . 0.0 110.112 179.927 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 16.9 t -134.68 101.16 4.84 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.284 -0.885 . . . . 0.0 110.312 -179.959 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 12.3 mm100 -118.61 154.37 32.76 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.253 -0.904 . . . . 0.0 110.154 179.954 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . 0.518 ' HA ' ' CA ' ' A' ' 19' ' ' GLY . 64.0 m -139.24 168.22 20.32 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.235 -0.916 . . . . 0.0 110.095 -179.944 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.564 ' CB ' ' CE1' ' A' ' 18' ' ' PHE . 0.2 OUTLIER -128.81 154.65 46.21 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.131 -0.981 . . . . 0.0 110.419 -179.8 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.491 1.612 0 O-C-N 121.374 -0.828 . . . . 0.0 110.091 179.915 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 18.3 p . . . . . 0 N--CA 1.491 1.578 0 CA-C-O 121.244 0.545 . . . . 0.0 110.071 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 90.4 m-20 -114.6 146.26 41.02 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.185 -0.947 . . . . 0.0 110.319 -179.753 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 28.8 m-20 -64.96 -24.44 67.52 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.23 -0.919 . . . . 0.0 109.954 179.802 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.05 -54.07 12.46 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.352 -0.843 . . . . 0.0 110.274 -179.973 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 8.6 t0 -78.58 -4.66 49.93 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.356 -0.84 . . . . 0.0 109.783 179.822 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 5.1 t -95.15 -50.77 4.92 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.422 -0.799 . . . . 0.0 109.548 179.454 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 7.1 m -65.78 -39.8 91.34 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.365 -0.834 . . . . 0.0 109.906 179.633 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.409 HD23 ' HA ' ' A' ' 9' ' ' LEU . 6.5 mt -54.32 -39.24 66.85 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.193 -0.942 . . . . 0.0 110.015 179.828 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -72.25 -35.24 68.75 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.294 -0.878 . . . . 0.0 110.106 179.911 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.444 ' O ' ' HB2' ' A' ' 16' ' ' TYR . 92.0 m -66.57 -42.29 87.24 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.325 -0.859 . . . . 0.0 109.942 179.891 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 23.7 mt -67.43 -35.47 73.56 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.588 0 O-C-N 121.265 -0.897 . . . . 0.0 110.217 179.965 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 3.6 ttt -63.79 -46.33 85.69 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.232 -0.918 . . . . 0.0 110.186 179.996 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -59.19 -21.17 59.04 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.244 -0.91 . . . . 0.0 110.279 -179.941 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 115.63 7.86 15.1 Favored Glycine 0 N--CA 1.49 2.275 0 N-CA-C 109.606 -1.398 . . . . 0.0 109.606 179.849 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' TYR . . . . . 0.444 ' HB2' ' O ' ' A' ' 11' ' ' CYS . 24.7 m-85 -91.02 -159.33 0.62 Allowed 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.134 -1.215 . . . . 0.0 110.3 -179.986 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . 0.476 ' HB3' ' CD2' ' A' ' 18' ' ' PHE . 4.8 m-80 -116.88 -70.98 0.76 Allowed 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.209 -0.932 . . . . 0.0 110.372 -179.939 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . 0.527 ' CE1' ' HB2' ' A' ' 29' ' ' ARG . 14.8 p90 -128.42 -177.67 4.26 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.21 -0.931 . . . . 0.0 110.274 -179.862 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -151.53 -164.84 12.46 Favored Glycine 0 N--CA 1.49 2.258 0 N-CA-C 109.332 -1.507 . . . . 0.0 109.332 179.975 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.494 ' O ' ' HA ' ' A' ' 26' ' ' CYS . 0.3 OUTLIER -162.16 147.54 12.89 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.15 -1.206 . . . . 0.0 110.3 179.989 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . 0.515 ' C ' HG23 ' A' ' 22' ' ' VAL . 0.8 OUTLIER -82.3 139.08 34.37 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.353 -0.842 . . . . 0.0 110.385 -179.99 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.575 HG12 ' HG3' ' A' ' 23' ' ' ARG . 15.1 t -151.57 112.25 0.46 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.607 0 O-C-N 121.303 -0.873 . . . . 0.0 110.255 -179.987 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . 0.575 ' HG3' HG12 ' A' ' 22' ' ' VAL . 83.7 mtt180 61.02 73.38 0.48 Allowed 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.253 -0.904 . . . . 0.0 110.347 179.974 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . 0.419 ' C ' ' O ' ' A' ' 23' ' ' ARG . . . 42.65 28.12 0.6 Allowed Glycine 0 N--CA 1.492 2.386 0 N-CA-C 109.611 -1.396 . . . . 0.0 109.611 179.893 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . 0.407 ' N ' ' O ' ' A' ' 23' ' ' ARG . 0.5 OUTLIER -141.22 -163.74 1.61 Allowed 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.276 -1.132 . . . . 0.0 110.041 179.971 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . 0.494 ' HA ' ' O ' ' A' ' 20' ' ' LYS . 0.5 OUTLIER -167.07 142.86 4.24 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.234 -0.916 . . . . 0.0 110.171 179.917 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 6.3 mm-40 -119.84 176.18 5.53 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.387 -0.821 . . . . 0.0 110.302 -179.92 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 85.4 m -120.47 135.46 55.05 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.346 -0.846 . . . . 0.0 109.956 179.885 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.527 ' HB2' ' CE1' ' A' ' 18' ' ' PHE . 0.4 OUTLIER -120.53 150.35 40.99 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.26 -0.9 . . . . 0.0 110.395 -179.815 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 5.4 ttt180 . . . . . 0 N--CA 1.492 1.628 0 O-C-N 121.313 -0.867 . . . . 0.0 109.964 179.994 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . 0.456 ' SG ' ' O ' ' A' ' 25' ' ' SER . 45.8 t . . . . . 0 N--CA 1.491 1.605 0 CA-C-O 121.179 0.514 . . . . 0.0 110.246 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 66.5 m-80 -116.62 140.79 49.0 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.337 -0.852 . . . . 0.0 110.113 -179.98 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' ASP . . . . . 0.407 ' O ' ' OG ' ' A' ' 8' ' ' SER . 2.8 m-20 -63.05 -13.4 35.39 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.249 -0.907 . . . . 0.0 110.096 179.994 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . 0.859 ' O ' HD12 ' A' ' 9' ' ' LEU . 0.0 OUTLIER -80.89 -40.05 25.32 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.373 -0.83 . . . . 0.0 110.2 179.994 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . 0.415 ' O ' ' CB ' ' A' ' 10' ' ' ASP . 1.0 OUTLIER -79.62 -29.29 41.02 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.175 -0.953 . . . . 0.0 110.146 -179.958 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -76.38 -47.2 24.1 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.183 -0.948 . . . . 0.0 110.039 179.873 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . 0.407 ' OG ' ' O ' ' A' ' 4' ' ' ASP . 7.3 m -65.85 -39.81 91.12 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.192 -0.942 . . . . 0.0 109.994 179.884 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.859 HD12 ' O ' ' A' ' 5' ' ' ARG . 4.0 mt -73.77 -36.57 65.09 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.32 -0.862 . . . . 0.0 110.164 179.775 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . 0.415 ' CB ' ' O ' ' A' ' 6' ' ' ASP . 36.9 t0 -76.43 -42.32 44.43 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.239 -0.913 . . . . 0.0 110.126 179.909 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.447 ' O ' ' HB2' ' A' ' 16' ' ' TYR . 93.9 m -67.28 -40.81 86.19 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.244 -0.91 . . . . 0.0 110.174 179.992 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 44.7 mt -66.23 -40.0 85.77 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.616 0 O-C-N 121.307 -0.871 . . . . 0.0 110.267 179.932 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . 0.42 ' HB2' ' O ' ' A' ' 9' ' ' LEU . 2.3 ttp -68.29 -34.58 76.41 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.255 -0.903 . . . . 0.0 110.205 -179.994 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -64.05 -19.1 64.97 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.321 -0.862 . . . . 0.0 110.178 -179.991 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . 0.445 ' O ' ' NH1' ' A' ' 30' ' ' ARG . . . 109.91 16.42 10.7 Favored Glycine 0 N--CA 1.49 2.263 0 N-CA-C 109.662 -1.375 . . . . 0.0 109.662 -179.985 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' TYR . . . . . 0.459 ' HA ' ' NH1' ' A' ' 30' ' ' ARG . 31.5 m-85 -97.36 -160.92 0.83 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.311 -1.111 . . . . 0.0 110.178 -179.873 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . 0.421 ' OD1' ' CD2' ' A' ' 18' ' ' PHE . 2.9 t-20 -119.4 -64.47 1.27 Allowed 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.237 -0.915 . . . . 0.0 110.272 -179.881 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . 0.594 ' CE1' ' HB3' ' A' ' 29' ' ' ARG . 6.6 p90 -143.77 145.28 32.26 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.184 -0.947 . . . . 0.0 110.289 -179.897 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . 0.459 ' HA3' ' HA ' ' A' ' 28' ' ' CYS . . . -132.99 -150.1 6.31 Favored Glycine 0 N--CA 1.491 2.331 0 N-CA-C 109.736 -1.345 . . . . 0.0 109.736 -179.965 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -170.66 173.52 5.36 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.185 -1.186 . . . . 0.0 110.229 -179.949 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 9.7 m -104.42 125.64 50.81 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.255 -0.903 . . . . 0.0 110.13 179.852 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.47 ' HB ' ' HB2' ' A' ' 25' ' ' SER . 9.9 t -86.81 43.12 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.633 0 O-C-N 121.2 -0.938 . . . . 0.0 110.037 179.858 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 3.4 mtm180 54.13 33.8 18.66 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.324 -0.86 . . . . 0.0 110.362 179.731 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 158.13 -19.36 0.34 Allowed Glycine 0 N--CA 1.491 2.319 0 C-N-CA 119.767 -1.206 . . . . 0.0 110.086 179.802 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . 0.47 ' HB2' ' HB ' ' A' ' 22' ' ' VAL . 22.6 m -127.66 -176.55 3.79 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 120.993 -1.298 . . . . 0.0 110.681 -179.824 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . 0.45 ' SG ' ' SG ' ' A' ' 2' ' ' CYS . 0.1 OUTLIER -134.58 120.14 19.27 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.442 -0.787 . . . . 0.0 109.887 -179.863 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 1.8 mm-40 -118.68 167.2 11.88 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.202 -0.936 . . . . 0.0 110.494 -179.754 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . 0.459 ' HA ' ' HA3' ' A' ' 19' ' ' GLY . 17.7 m -136.52 152.05 50.1 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.206 -0.934 . . . . 0.0 109.97 179.849 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.594 ' HB3' ' CE1' ' A' ' 18' ' ' PHE . 0.0 OUTLIER -132.5 152.03 51.69 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.155 -0.966 . . . . 0.0 110.398 -179.868 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.459 ' NH1' ' HA ' ' A' ' 16' ' ' TYR . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.665 0 O-C-N 121.303 -0.873 . . . . 0.0 110.036 179.889 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . 0.439 ' HB2' ' SG ' ' A' ' 26' ' ' CYS . 23.3 p . . . . . 0 N--CA 1.491 1.611 0 CA-C-O 121.281 0.562 . . . . 0.0 110.342 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 3' ' ' ASN . . . . . 0.455 ' O ' ' SG ' ' A' ' 7' ' ' CYS . 0.1 OUTLIER -112.6 110.22 20.25 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.159 -0.963 . . . . 0.0 110.226 179.955 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' ASP . . . . . 0.507 ' OD1' ' N ' ' A' ' 4' ' ' ASP . 0.8 OUTLIER -50.9 -35.46 33.11 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.291 -0.881 . . . . 0.0 110.32 -179.901 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . 0.777 ' O ' HD12 ' A' ' 9' ' ' LEU . 0.1 OUTLIER -62.31 -49.04 77.19 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.201 -0.937 . . . . 0.0 110.195 -179.945 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . 0.466 ' O ' ' HB2' ' A' ' 10' ' ' ASP . 0.3 OUTLIER -79.2 -6.65 57.09 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.314 -0.866 . . . . 0.0 110.0 179.873 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.455 ' SG ' ' O ' ' A' ' 3' ' ' ASN . 87.4 m -89.81 -40.29 12.55 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.227 -0.921 . . . . 0.0 109.915 179.634 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 8.5 t -77.49 -39.24 47.07 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.297 -0.877 . . . . 0.0 110.082 179.693 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.777 HD12 ' O ' ' A' ' 5' ' ' ARG . 12.7 mt -72.54 -38.78 67.89 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.309 -0.869 . . . . 0.0 110.063 179.875 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . 0.474 ' O ' ' HG2' ' A' ' 14' ' ' LYS . 12.1 t70 -69.41 -43.21 73.87 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.293 -0.88 . . . . 0.0 109.999 179.821 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.401 ' O ' ' HB2' ' A' ' 16' ' ' TYR . 53.4 m -65.95 -40.36 91.27 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.289 -0.882 . . . . 0.0 109.733 179.82 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 27.1 mt -63.73 -32.1 55.63 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.509 0 O-C-N 121.286 -0.884 . . . . 0.0 109.494 179.411 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -65.27 -45.06 85.99 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.367 -0.833 . . . . 0.0 109.694 179.506 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . 0.474 ' HG2' ' O ' ' A' ' 10' ' ' ASP . 11.8 mmmm -57.61 -17.57 15.14 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.34 -0.85 . . . . 0.0 109.855 179.621 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 107.02 40.07 1.89 Allowed Glycine 0 N--CA 1.491 2.328 0 N-CA-C 109.222 -1.551 . . . . 0.0 109.222 -179.712 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' TYR . . . . . 0.401 ' HB2' ' O ' ' A' ' 11' ' ' CYS . 12.3 m-85 -121.88 -165.54 1.27 Allowed 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.346 -1.091 . . . . 0.0 110.418 -179.74 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . 0.589 ' HB3' ' CD2' ' A' ' 18' ' ' PHE . 9.5 m-80 -98.11 -53.54 3.34 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.33 -0.856 . . . . 0.0 110.154 179.904 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . 0.589 ' CD2' ' HB3' ' A' ' 17' ' ' ASN . 11.0 p90 -161.27 -171.11 2.89 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.194 -0.941 . . . . 0.0 110.268 179.848 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -140.64 -179.23 17.95 Favored Glycine 0 N--CA 1.491 2.34 0 N-CA-C 109.639 -1.384 . . . . 0.0 109.639 179.985 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.43 ' O ' ' HA ' ' A' ' 26' ' ' CYS . 0.2 OUTLIER -149.41 151.17 33.59 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.254 -1.145 . . . . 0.0 110.387 179.978 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . 0.434 ' SG ' ' SG ' ' A' ' 26' ' ' CYS . 0.8 OUTLIER -89.88 132.49 35.26 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.228 -0.92 . . . . 0.0 110.245 -179.971 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.522 ' O ' ' CB ' ' A' ' 25' ' ' SER . 99.1 t -136.31 100.93 2.43 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.594 0 O-C-N 121.271 -0.893 . . . . 0.0 110.317 -179.941 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 50.92 80.3 0.08 Allowed 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.266 -0.896 . . . . 0.0 110.431 179.843 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 47.78 23.71 2.55 Favored Glycine 0 N--CA 1.49 2.278 0 N-CA-C 109.696 -1.362 . . . . 0.0 109.696 179.866 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . 0.522 ' CB ' ' O ' ' A' ' 22' ' ' VAL . 1.2 t -127.16 173.67 9.53 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.217 -1.167 . . . . 0.0 110.137 179.968 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . 0.439 ' SG ' ' HB2' ' A' ' 2' ' ' CYS . 0.0 OUTLIER -158.47 123.57 4.32 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.227 -0.921 . . . . 0.0 110.318 179.919 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 25.1 mm-40 -120.28 -175.06 2.92 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.223 -0.923 . . . . 0.0 110.34 179.878 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 56.8 m -119.99 145.66 46.59 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.214 -0.929 . . . . 0.0 110.123 179.931 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.565 ' CB ' ' CE1' ' A' ' 18' ' ' PHE . 0.4 OUTLIER -126.99 165.04 20.17 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.167 -0.958 . . . . 0.0 110.141 -179.905 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.493 1.678 0 O-C-N 121.25 -0.906 . . . . 0.0 110.23 -179.979 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . 0.439 ' SG ' ' O ' ' A' ' 25' ' ' SER . 6.5 t . . . . . 0 N--CA 1.49 1.57 0 CA-C-O 121.18 0.514 . . . . 0.0 110.171 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 2.8 m-80 -110.13 140.21 44.46 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.296 -0.878 . . . . 0.0 110.195 179.962 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -51.13 -43.44 61.17 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.203 -0.936 . . . . 0.0 110.182 -179.945 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 21.6 mtp180 -72.74 -42.81 63.69 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.253 -0.904 . . . . 0.0 110.203 179.998 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 1.3 t0 -79.92 3.93 18.36 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.36 -0.838 . . . . 0.0 110.154 179.964 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 8.6 t -107.21 -31.85 8.05 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.214 -0.929 . . . . 0.0 110.222 -179.966 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . 0.447 ' O ' HG13 ' A' ' 12' ' ' ILE . 36.7 t -93.12 -31.19 14.9 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.267 -0.895 . . . . 0.0 110.218 179.941 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.402 HD23 ' HA ' ' A' ' 9' ' ' LEU . 34.5 mt -57.2 -57.83 10.88 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.176 -0.953 . . . . 0.0 110.139 -179.992 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -62.7 -38.54 90.82 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.33 -0.856 . . . . 0.0 110.237 -179.997 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -66.21 -38.32 87.68 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.246 -0.909 . . . . 0.0 110.02 -179.984 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . 0.447 HG13 ' O ' ' A' ' 8' ' ' SER . 11.0 mt -63.94 -34.3 67.51 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.549 0 O-C-N 121.292 -0.88 . . . . 0.0 109.669 179.587 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 36.9 mtt -67.9 -38.86 83.49 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.411 -0.806 . . . . 0.0 110.068 179.68 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 33.8 mtmt -55.07 -33.28 62.62 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.303 -0.873 . . . . 0.0 110.378 -179.882 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 130.69 2.07 4.92 Favored Glycine 0 N--CA 1.491 2.31 0 N-CA-C 109.871 -1.291 . . . . 0.0 109.871 179.948 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 81.2 m-85 -79.41 -178.02 6.05 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.063 -1.257 . . . . 0.0 110.214 -179.96 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . 0.484 ' HB3' ' CD2' ' A' ' 18' ' ' PHE . 1.5 t-20 -103.73 -66.09 0.97 Allowed 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.287 -0.883 . . . . 0.0 110.272 -179.976 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . 0.53 ' CE1' ' HB2' ' A' ' 29' ' ' ARG . 7.2 p90 -138.58 159.07 43.0 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.164 -0.96 . . . . 0.0 110.387 -179.958 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . 0.523 ' CA ' ' HA ' ' A' ' 28' ' ' CYS . . . -156.64 172.35 34.33 Favored Glycine 0 N--CA 1.489 2.22 0 N-CA-C 109.816 -1.314 . . . . 0.0 109.816 179.992 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -143.2 166.8 23.71 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.333 -1.098 . . . . 0.0 110.14 179.923 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . 0.505 ' HA ' ' O ' ' A' ' 25' ' ' SER . 47.0 t -98.94 116.04 30.27 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.222 -0.924 . . . . 0.0 110.079 179.863 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.595 ' O ' HG12 ' A' ' 22' ' ' VAL . 41.1 t -80.22 82.86 1.25 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.676 0 O-C-N 121.155 -0.965 . . . . 0.0 110.085 -179.933 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 61.73 -77.03 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.298 -0.876 . . . . 0.0 109.895 -179.927 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . 0.519 ' N ' ' O ' ' A' ' 22' ' ' VAL . . . -127.24 39.32 1.97 Allowed Glycine 0 N--CA 1.489 2.183 0 N-CA-C 109.285 -1.526 . . . . 0.0 109.285 179.711 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . 0.505 ' O ' ' HA ' ' A' ' 21' ' ' CYS . 0.3 OUTLIER -147.01 172.97 12.9 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.326 -1.102 . . . . 0.0 110.039 -179.951 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 49.3 t -134.85 98.31 3.99 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.201 -0.937 . . . . 0.0 110.248 -179.884 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.408 ' C ' ' SG ' ' A' ' 28' ' ' CYS . 4.6 mm-40 -105.43 157.99 16.97 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.292 -0.88 . . . . 0.0 109.915 179.943 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . 0.523 ' HA ' ' CA ' ' A' ' 19' ' ' GLY . 34.3 m -142.65 170.72 15.17 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.079 -1.013 . . . . 0.0 110.541 -179.803 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.53 ' HB2' ' CE1' ' A' ' 18' ' ' PHE . 27.9 mmt180 -142.1 164.72 29.41 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.388 -0.82 . . . . 0.0 110.304 -179.75 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 54.3 mtp180 . . . . . 0 N--CA 1.491 1.6 0 O-C-N 121.282 -0.886 . . . . 0.0 110.139 179.973 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . 0.471 ' HA ' ' HB2' ' A' ' 26' ' ' CYS . 12.1 t . . . . . 0 N--CA 1.491 1.611 0 CA-C-O 121.293 0.568 . . . . 0.0 110.288 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 3' ' ' ASN . . . . . 0.41 ' O ' ' N ' ' A' ' 7' ' ' CYS . 1.4 m-20 -145.92 131.57 18.89 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.215 -0.928 . . . . 0.0 110.11 179.861 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' ASP . . . . . 0.425 ' O ' ' OG ' ' A' ' 8' ' ' SER . 65.6 m-20 -50.87 -37.25 42.31 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.219 -0.926 . . . . 0.0 110.259 179.997 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . 0.461 ' O ' ' HB2' ' A' ' 9' ' ' LEU . 0.0 OUTLIER -73.44 -41.54 63.1 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.307 -0.871 . . . . 0.0 110.147 179.999 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 33.8 m-20 -80.0 -22.75 42.11 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.227 -0.921 . . . . 0.0 110.308 -179.944 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.41 ' N ' ' O ' ' A' ' 3' ' ' ASN . 41.4 m -76.36 -36.24 58.28 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.395 -0.816 . . . . 0.0 110.091 -179.914 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . 0.427 ' O ' HG13 ' A' ' 12' ' ' ILE . 0.7 OUTLIER -85.02 -33.69 22.48 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.242 -0.912 . . . . 0.0 110.517 -179.703 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.461 ' HB2' ' O ' ' A' ' 5' ' ' ARG . 0.7 OUTLIER -71.59 -52.95 15.43 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.173 -0.954 . . . . 0.0 110.322 -179.838 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . 0.401 ' O ' ' HG3' ' A' ' 14' ' ' LYS . 2.3 t0 -62.69 -24.71 67.79 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.193 -0.942 . . . . 0.0 110.147 179.899 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.402 ' SG ' ' O ' ' A' ' 7' ' ' CYS . 3.6 m -78.96 -45.65 19.94 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.185 -0.947 . . . . 0.0 110.287 -179.986 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . 0.427 HG13 ' O ' ' A' ' 8' ' ' SER . 64.2 mt -63.57 -30.25 49.36 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.626 0 O-C-N 121.123 -0.985 . . . . 0.0 110.222 179.991 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . 0.451 ' HG3' ' O ' ' A' ' 9' ' ' LEU . 11.9 mtp -84.24 -27.35 28.0 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.272 -0.893 . . . . 0.0 110.178 179.832 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . 0.401 ' HG3' ' O ' ' A' ' 10' ' ' ASP . 0.1 OUTLIER -78.93 -27.17 43.68 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.254 -0.904 . . . . 0.0 110.29 179.942 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 121.88 17.69 3.73 Favored Glycine 0 N--CA 1.492 2.415 0 N-CA-C 109.634 -1.387 . . . . 0.0 109.634 179.87 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' TYR . . . . . 0.473 ' HB3' ' SG ' ' A' ' 28' ' ' CYS . 45.0 m-85 -100.22 -170.45 1.87 Allowed 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.242 -1.152 . . . . 0.0 110.263 -179.99 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . 0.568 ' HB3' ' CD2' ' A' ' 18' ' ' PHE . 2.4 m120 -122.54 -56.92 1.77 Allowed 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.274 -0.891 . . . . 0.0 110.241 179.929 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . 0.58 ' CE1' ' HB3' ' A' ' 29' ' ' ARG . 11.6 p90 -147.33 153.88 40.23 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.188 -0.945 . . . . 0.0 110.186 -179.922 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . 0.539 ' CA ' ' HA ' ' A' ' 28' ' ' CYS . . . -136.74 -146.86 5.24 Favored Glycine 0 N--CA 1.492 2.367 0 N-CA-C 109.745 -1.342 . . . . 0.0 109.745 -179.924 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 175.04 141.99 0.05 Allowed 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.27 -1.135 . . . . 0.0 110.209 -179.957 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . 0.489 ' HA ' ' O ' ' A' ' 25' ' ' SER . 0.1 OUTLIER -97.04 125.61 41.61 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.203 -0.935 . . . . 0.0 110.456 -179.868 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.642 ' O ' HG12 ' A' ' 22' ' ' VAL . 60.7 t -94.39 45.47 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.564 0 O-C-N 121.348 -0.845 . . . . 0.0 109.964 179.812 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 61.32 84.85 0.13 Allowed 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.321 -0.862 . . . . 0.0 110.384 -179.96 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 103.63 -20.17 42.59 Favored Glycine 0 N--CA 1.491 2.34 0 N-CA-C 109.782 -1.327 . . . . 0.0 109.782 179.756 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . 0.489 ' O ' ' HA ' ' A' ' 21' ' ' CYS . 3.0 t -132.2 162.21 31.5 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.122 -1.222 . . . . 0.0 110.33 -179.875 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . 0.471 ' HB2' ' HA ' ' A' ' 2' ' ' CYS . 18.2 t -138.7 123.34 18.58 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.288 -0.883 . . . . 0.0 110.426 -179.926 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 76.9 mt-30 -108.74 175.2 5.55 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.344 -0.847 . . . . 0.0 110.085 179.872 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . 0.539 ' HA ' ' CA ' ' A' ' 19' ' ' GLY . 6.9 t -148.68 156.4 42.33 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.298 -0.876 . . . . 0.0 110.431 -179.856 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.58 ' HB3' ' CE1' ' A' ' 18' ' ' PHE . 6.2 mmm-85 -144.53 137.14 26.62 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.244 -0.91 . . . . 0.0 110.215 179.903 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.458 ' HG3' ' CD2' ' A' ' 16' ' ' TYR . 1.7 mpp_? . . . . . 0 N--CA 1.491 1.598 0 O-C-N 121.302 -0.874 . . . . 0.0 110.177 -179.958 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . 0.478 ' O ' ' HB2' ' A' ' 21' ' ' CYS . 17.7 p . . . . . 0 N--CA 1.492 1.63 0 CA-C-O 121.271 0.558 . . . . 0.0 110.182 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 3' ' ' ASN . . . . . 0.417 ' OD1' ' O ' ' A' ' 3' ' ' ASN . 53.2 p-10 -51.98 154.89 2.0 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.178 -0.951 . . . . 0.0 110.132 179.994 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' ASP . . . . . 0.484 ' OD2' ' HG2' ' A' ' 20' ' ' LYS . 0.6 OUTLIER -65.23 -15.93 62.99 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.358 -0.839 . . . . 0.0 110.385 -179.798 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . 0.405 ' HB3' ' ND2' ' A' ' 3' ' ' ASN . 0.0 OUTLIER -75.33 -54.45 7.06 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.271 -0.893 . . . . 0.0 110.522 -179.788 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 2.1 t0 -79.77 -25.85 40.85 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.255 -0.903 . . . . 0.0 110.674 -179.683 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.4 ' O ' ' SG ' ' A' ' 11' ' ' CYS . 30.9 t -76.76 -33.83 58.06 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.204 -0.935 . . . . 0.0 110.25 -179.868 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . 0.451 ' HB3' ' O ' ' A' ' 4' ' ' ASP . 22.7 p -79.58 -43.19 23.43 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.182 -0.949 . . . . 0.0 110.317 179.939 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -53.49 -42.04 66.87 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.258 -0.901 . . . . 0.0 110.203 -179.982 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 3.3 t70 -63.45 -27.19 69.11 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.298 -0.876 . . . . 0.0 110.097 179.733 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.4 ' SG ' ' O ' ' A' ' 7' ' ' CYS . 79.4 m -71.51 -41.4 69.3 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.271 -0.893 . . . . 0.0 110.107 -179.983 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 36.1 mt -63.65 -45.62 96.98 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.576 0 O-C-N 121.316 -0.865 . . . . 0.0 110.034 179.851 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 1.2 ttp -64.28 -31.42 72.62 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.243 -0.911 . . . . 0.0 109.98 179.767 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.47 -32.16 66.01 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.34 -0.85 . . . . 0.0 110.152 -179.945 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 137.3 -7.41 3.71 Favored Glycine 0 N--CA 1.491 2.323 0 N-CA-C 109.509 -1.436 . . . . 0.0 109.509 -179.904 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 26.2 m-85 -87.89 -170.12 2.86 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.321 -1.105 . . . . 0.0 110.15 -179.888 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 35.2 t-20 -120.61 -40.81 2.63 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.333 -0.854 . . . . 0.0 110.237 179.864 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . 0.605 ' CE2' ' CB ' ' A' ' 29' ' ' ARG . 38.4 p90 -146.58 146.96 30.64 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.342 -0.849 . . . . 0.0 110.193 179.829 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . 0.435 ' CA ' ' HA ' ' A' ' 28' ' ' CYS . . . -137.34 -173.01 12.73 Favored Glycine 0 N--CA 1.491 2.302 0 N-CA-C 109.524 -1.43 . . . . 0.0 109.524 -179.937 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.484 ' HG2' ' OD2' ' A' ' 4' ' ' ASP . 0.0 OUTLIER -161.96 159.25 26.32 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.191 -1.182 . . . . 0.0 110.258 179.963 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . 0.488 ' HA ' ' O ' ' A' ' 25' ' ' SER . 40.7 t -87.43 139.47 30.52 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.29 -0.881 . . . . 0.0 110.018 -179.977 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.49 ' HB ' ' HB2' ' A' ' 25' ' ' SER . 43.0 t -117.89 92.49 2.15 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.684 0 O-C-N 121.154 -0.966 . . . . 0.0 110.679 -179.8 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER 50.66 53.87 12.2 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.477 -0.764 . . . . 0.0 111.108 179.328 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 89.97 15.98 56.86 Favored Glycine 0 N--CA 1.491 2.345 0 C-N-CA 119.886 -1.15 . . . . 0.0 110.312 179.205 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . 0.49 ' HB2' ' HB ' ' A' ' 22' ' ' VAL . 1.1 m -122.04 178.99 4.67 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.006 -1.29 . . . . 0.0 110.134 179.719 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 46.0 t -145.75 95.03 2.58 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.258 -0.901 . . . . 0.0 110.32 -179.911 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -105.64 178.42 4.57 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.333 -0.855 . . . . 0.0 110.195 179.83 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . 0.435 ' HA ' ' CA ' ' A' ' 19' ' ' GLY . 82.0 m -134.69 150.33 50.6 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.259 -0.901 . . . . 0.0 110.284 -179.962 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.605 ' CB ' ' CE2' ' A' ' 18' ' ' PHE . 10.1 mtt180 -122.59 146.37 47.49 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.259 -0.901 . . . . 0.0 110.1 -179.972 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.444 ' O ' ' CZ ' ' A' ' 18' ' ' PHE . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.581 0 O-C-N 121.217 -0.927 . . . . 0.0 110.19 179.985 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . 0.446 ' HB3' ' HB3' ' A' ' 21' ' ' CYS . 48.9 t . . . . . 0 N--CA 1.491 1.608 0 CA-C-O 121.241 0.544 . . . . 0.0 110.257 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -82.41 139.34 34.08 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.197 -0.939 . . . . 0.0 110.24 179.941 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 46.7 m-20 -66.85 -30.92 71.22 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.195 -0.941 . . . . 0.0 110.118 179.912 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . 0.525 ' O ' HD12 ' A' ' 9' ' ' LEU . 6.5 mtp180 -75.98 -41.84 50.12 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.277 -0.89 . . . . 0.0 110.098 179.868 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -79.64 -23.04 42.84 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.253 -0.904 . . . . 0.0 110.323 179.967 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 46.7 t -78.75 -38.06 39.71 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.21 -0.931 . . . . 0.0 110.145 179.877 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 38.1 t -75.06 -42.05 57.72 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.245 -0.909 . . . . 0.0 110.079 179.879 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.525 HD12 ' O ' ' A' ' 5' ' ' ARG . 61.5 mt -53.86 -47.02 71.42 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.306 -0.871 . . . . 0.0 110.292 -179.963 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . 0.487 ' O ' ' HG3' ' A' ' 14' ' ' LYS . 5.5 m-20 -62.66 -38.82 91.83 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.272 -0.893 . . . . 0.0 110.108 179.959 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.449 ' O ' ' HB2' ' A' ' 16' ' ' TYR . 87.5 m -66.69 -39.13 87.97 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.285 -0.885 . . . . 0.0 110.042 179.94 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . 0.414 HG21 HD13 ' A' ' 12' ' ' ILE . 17.1 mt -63.67 -33.23 60.43 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.633 0 O-C-N 121.356 -0.84 . . . . 0.0 110.187 -179.865 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . 0.446 ' HA ' ' CE ' ' A' ' 13' ' ' MET . 0.3 OUTLIER -71.28 -39.94 71.21 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.321 -0.862 . . . . 0.0 110.198 -179.977 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . 0.487 ' HG3' ' O ' ' A' ' 10' ' ' ASP . 1.1 mtmm -59.42 -14.58 12.72 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.126 -0.984 . . . . 0.0 110.218 -179.852 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 108.2 11.86 23.05 Favored Glycine 0 N--CA 1.49 2.262 0 N-CA-C 109.452 -1.459 . . . . 0.0 109.452 -179.931 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' TYR . . . . . 0.449 ' HB2' ' O ' ' A' ' 11' ' ' CYS . 5.8 m-85 -93.69 -165.08 1.26 Allowed 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.209 -1.171 . . . . 0.0 110.202 179.953 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -113.56 -62.12 1.64 Allowed 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.32 -0.863 . . . . 0.0 109.907 179.888 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . 0.492 ' CE1' ' HB2' ' A' ' 29' ' ' ARG . 1.0 OUTLIER -133.09 159.97 38.54 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.36 -0.837 . . . . 0.0 110.017 179.777 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -137.46 173.61 22.19 Favored Glycine 0 N--CA 1.491 2.306 0 N-CA-C 109.638 -1.385 . . . . 0.0 109.638 -179.799 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 19.3 ttpt -153.35 144.92 23.31 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.278 -1.13 . . . . 0.0 110.0 -179.919 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . 0.496 ' C ' HG23 ' A' ' 22' ' ' VAL . 83.5 m -84.1 153.75 23.57 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.248 -0.907 . . . . 0.0 110.323 -179.93 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.538 ' O ' ' CG ' ' A' ' 23' ' ' ARG . 58.1 t -150.16 145.52 17.14 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.557 0 O-C-N 121.279 -0.888 . . . . 0.0 110.155 179.947 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . 0.538 ' CG ' ' O ' ' A' ' 22' ' ' VAL . 16.1 ptt180 38.22 33.46 0.06 Allowed 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.632 -0.667 . . . . 0.0 110.697 179.998 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . 0.408 ' N ' ' O ' ' A' ' 22' ' ' VAL . . . 79.91 37.55 22.13 Favored Glycine 0 N--CA 1.489 2.231 0 N-CA-C 109.523 -1.431 . . . . 0.0 109.523 -179.938 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . 0.485 ' N ' ' O ' ' A' ' 22' ' ' VAL . 7.7 t -138.05 -168.85 2.44 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.268 -1.136 . . . . 0.0 110.173 179.999 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . 0.442 ' HB2' ' SG ' ' A' ' 2' ' ' CYS . 49.4 t -141.15 120.16 12.8 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.26 -0.9 . . . . 0.0 110.265 -179.959 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 24.6 mt-30 -118.75 166.15 13.13 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.232 -0.918 . . . . 0.0 110.208 -179.988 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 18.1 m -128.81 148.59 50.89 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.255 -0.903 . . . . 0.0 110.091 -179.904 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.492 ' HB2' ' CE1' ' A' ' 18' ' ' PHE . 8.4 mmm-85 -129.02 168.02 16.65 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.182 -0.949 . . . . 0.0 110.299 179.969 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 15.2 mtm180 . . . . . 0 N--CA 1.491 1.58 0 O-C-N 121.334 -0.854 . . . . 0.0 110.331 -179.987 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 16.3 p . . . . . 0 N--CA 1.49 1.567 0 CA-C-O 121.268 0.556 . . . . 0.0 110.195 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 6.2 m120 -100.32 128.05 46.48 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.142 -0.974 . . . . 0.0 110.305 -179.889 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -66.41 -48.56 69.67 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.306 -0.871 . . . . 0.0 110.044 179.909 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . 0.766 ' O ' HD12 ' A' ' 9' ' ' LEU . 1.5 ttt85 -62.53 -35.89 80.87 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.295 -0.878 . . . . 0.0 109.723 179.701 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 1.9 t0 -79.53 -20.97 45.83 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.357 -0.839 . . . . 0.0 109.563 179.47 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.423 ' O ' ' HB2' ' A' ' 11' ' ' CYS . 7.5 t -80.34 -45.71 17.33 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.432 -0.793 . . . . 0.0 109.874 179.639 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . 0.688 ' O ' HD12 ' A' ' 12' ' ' ILE . 0.4 OUTLIER -68.35 -44.28 75.58 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.428 -0.795 . . . . 0.0 110.207 -179.971 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.766 HD12 ' O ' ' A' ' 5' ' ' ARG . 0.2 OUTLIER -53.99 -43.43 69.99 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.272 -0.893 . . . . 0.0 110.023 179.939 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . 0.474 ' O ' ' HG3' ' A' ' 14' ' ' LYS . 11.5 t0 -74.02 -43.5 57.75 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.319 -0.863 . . . . 0.0 110.255 179.953 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.423 ' HB2' ' O ' ' A' ' 7' ' ' CYS . 0.0 OUTLIER -66.48 -39.95 89.04 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.166 -0.959 . . . . 0.0 110.433 -179.779 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . 0.688 HD12 ' O ' ' A' ' 8' ' ' SER . 14.3 mt -63.4 -47.05 93.65 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.672 0 O-C-N 121.141 -0.975 . . . . 0.0 110.034 179.962 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -64.41 -25.32 67.97 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.156 -0.965 . . . . 0.0 109.83 179.719 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . 0.474 ' HG3' ' O ' ' A' ' 10' ' ' ASP . 3.4 mttt -73.29 -36.75 66.36 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.293 -0.879 . . . . 0.0 110.151 179.78 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 147.47 -13.78 1.4 Allowed Glycine 0 N--CA 1.491 2.349 0 N-CA-C 109.666 -1.374 . . . . 0.0 109.666 179.941 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' TYR . . . . . 0.474 ' CE2' ' HD2' ' A' ' 30' ' ' ARG . 85.6 m-85 -74.05 -168.7 0.65 Allowed 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.117 -1.225 . . . . 0.0 110.299 179.997 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . 0.573 ' HB3' ' CD2' ' A' ' 18' ' ' PHE . 0.7 OUTLIER -132.12 -53.06 0.97 Allowed 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.193 -0.942 . . . . 0.0 110.339 -179.967 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . 0.605 ' CE1' ' HB2' ' A' ' 29' ' ' ARG . 9.4 p90 -141.62 152.82 44.33 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.138 -0.977 . . . . 0.0 110.428 179.928 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -148.72 -152.18 5.65 Favored Glycine 0 N--CA 1.489 2.222 0 N-CA-C 109.565 -1.414 . . . . 0.0 109.565 179.977 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.496 ' O ' ' HA ' ' A' ' 26' ' ' CYS . 0.0 OUTLIER -174.18 149.42 1.42 Allowed 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.267 -1.137 . . . . 0.0 110.096 -179.989 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -90.14 129.04 36.47 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.258 -0.901 . . . . 0.0 110.322 179.977 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.456 ' O ' ' HB2' ' A' ' 23' ' ' ARG . 54.0 t -111.08 94.1 2.91 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.58 0 O-C-N 121.264 -0.898 . . . . 0.0 110.33 -179.955 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . 0.456 ' HB2' ' O ' ' A' ' 22' ' ' VAL . 5.4 mtt-85 61.32 -88.67 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.328 -0.858 . . . . 0.0 110.506 179.863 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -119.94 24.21 7.97 Favored Glycine 0 N--CA 1.489 2.197 0 N-CA-C 109.784 -1.327 . . . . 0.0 109.784 -179.703 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . 0.453 ' O ' ' N ' ' A' ' 22' ' ' VAL . 0.3 OUTLIER -147.98 -174.54 4.59 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.165 -1.197 . . . . 0.0 110.076 179.856 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . 0.496 ' HA ' ' O ' ' A' ' 20' ' ' LYS . 9.2 t -149.67 150.7 32.54 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.257 -0.902 . . . . 0.0 110.48 179.942 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.43 ' O ' ' SG ' ' A' ' 28' ' ' CYS . 12.5 mt-30 -113.5 175.25 5.53 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.381 -0.824 . . . . 0.0 109.763 179.64 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . 0.43 ' SG ' ' O ' ' A' ' 27' ' ' GLN . 7.5 m -155.66 141.4 18.0 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.214 -0.929 . . . . 0.0 110.339 -179.883 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.605 ' HB2' ' CE1' ' A' ' 18' ' ' PHE . 1.0 OUTLIER -134.1 137.63 44.71 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.31 -0.869 . . . . 0.0 110.109 -179.974 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.474 ' HD2' ' CE2' ' A' ' 16' ' ' TYR . 0.4 OUTLIER . . . . . 0 N--CA 1.492 1.662 0 O-C-N 121.299 -0.876 . . . . 0.0 110.415 -179.811 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . 0.445 ' SG ' ' HB2' ' A' ' 26' ' ' CYS . 39.6 t . . . . . 0 N--CA 1.492 1.642 0 CA-C-O 121.199 0.523 . . . . 0.0 110.124 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 10.8 m120 -83.56 115.15 21.98 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.308 -0.87 . . . . 0.0 110.136 179.96 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -58.03 -21.74 46.57 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.267 -0.896 . . . . 0.0 110.147 179.96 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . 0.451 ' O ' HD12 ' A' ' 9' ' ' LEU . 0.0 OUTLIER -78.51 -45.62 21.54 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.21 -0.931 . . . . 0.0 110.097 179.975 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 21.0 m-20 -79.03 -18.41 53.6 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.244 -0.91 . . . . 0.0 109.818 179.791 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.477 ' O ' ' HB2' ' A' ' 11' ' ' CYS . 8.1 t -78.37 -54.08 6.58 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.345 -0.847 . . . . 0.0 109.947 179.801 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . 0.44 ' O ' HG13 ' A' ' 12' ' ' ILE . 0.3 OUTLIER -64.58 -42.03 95.88 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.288 -0.882 . . . . 0.0 110.133 179.932 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.451 HD12 ' O ' ' A' ' 5' ' ' ARG . 0.3 OUTLIER -54.05 -51.85 62.73 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.146 -0.971 . . . . 0.0 110.231 -179.997 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 2.4 t0 -69.36 -38.77 78.24 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.278 -0.889 . . . . 0.0 110.417 -179.923 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.477 ' HB2' ' O ' ' A' ' 7' ' ' CYS . 0.1 OUTLIER -66.58 -39.79 88.62 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.159 -0.963 . . . . 0.0 110.132 -179.957 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . 0.44 HG13 ' O ' ' A' ' 8' ' ' SER . 15.5 mt -63.63 -38.72 83.0 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.563 0 O-C-N 121.278 -0.889 . . . . 0.0 109.833 179.87 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 2.6 mmm -69.87 -28.87 66.01 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.271 -0.893 . . . . 0.0 109.999 179.715 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -67.15 -32.06 72.91 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.255 -0.903 . . . . 0.0 110.205 179.836 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 138.25 -7.51 3.44 Favored Glycine 0 N--CA 1.491 2.313 0 N-CA-C 109.581 -1.408 . . . . 0.0 109.581 -179.823 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 97.2 m-85 -80.09 -163.73 0.59 Allowed 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.135 -1.215 . . . . 0.0 110.242 179.914 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . 0.589 ' HB3' ' CD2' ' A' ' 18' ' ' PHE . 0.7 OUTLIER -133.11 -63.31 0.77 Allowed 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.297 -0.877 . . . . 0.0 110.203 179.871 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . 0.596 ' CE1' ' HB2' ' A' ' 29' ' ' ARG . 5.4 p90 -133.89 145.75 49.92 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.12 -0.988 . . . . 0.0 110.38 179.78 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . 0.471 ' CA ' ' HA ' ' A' ' 28' ' ' CYS . . . -140.29 -150.51 5.47 Favored Glycine 0 N--CA 1.489 2.219 0 N-CA-C 109.529 -1.428 . . . . 0.0 109.529 -179.973 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 4.1 tttm -173.61 152.97 2.18 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.179 -1.189 . . . . 0.0 110.265 179.932 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . 0.433 ' SG ' ' SG ' ' A' ' 26' ' ' CYS . 22.1 m -91.31 144.27 25.78 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.346 -0.846 . . . . 0.0 110.315 179.969 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.419 ' O ' ' HB2' ' A' ' 23' ' ' ARG . 39.2 t -139.25 115.73 9.92 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.67 0 O-C-N 121.323 -0.86 . . . . 0.0 110.159 179.919 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . 0.419 ' HB2' ' O ' ' A' ' 22' ' ' VAL . 0.1 OUTLIER 56.31 -92.85 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.344 -0.848 . . . . 0.0 110.3 179.939 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -131.65 23.62 4.21 Favored Glycine 0 N--CA 1.49 2.238 0 N-CA-C 109.456 -1.457 . . . . 0.0 109.456 -179.955 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 4.0 t -142.34 172.47 12.65 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.226 -1.161 . . . . 0.0 109.931 179.872 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . 0.445 ' HB2' ' SG ' ' A' ' 2' ' ' CYS . 1.0 OUTLIER -138.46 145.37 40.8 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.084 -1.01 . . . . 0.0 110.837 -179.749 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.464 ' O ' ' HA3' ' A' ' 19' ' ' GLY . 14.1 mm-40 -119.97 170.18 9.5 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.34 -0.85 . . . . 0.0 109.791 179.572 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . 0.471 ' HA ' ' CA ' ' A' ' 19' ' ' GLY . 96.6 m -150.4 157.93 43.59 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.076 -1.015 . . . . 0.0 110.452 -179.949 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.596 ' HB2' ' CE1' ' A' ' 18' ' ' PHE . 9.7 mtp180 -128.96 159.59 35.38 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.207 -0.933 . . . . 0.0 110.395 179.967 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.583 0 O-C-N 121.205 -0.935 . . . . 0.0 110.143 179.866 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . 0.439 ' O ' ' CB ' ' A' ' 3' ' ' ASN . 16.4 p . . . . . 0 N--CA 1.491 1.576 0 CA-C-O 121.233 0.539 . . . . 0.0 110.025 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 3' ' ' ASN . . . . . 0.439 ' CB ' ' O ' ' A' ' 2' ' ' CYS . 1.0 OUTLIER 66.16 84.78 0.15 Allowed 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.272 -0.893 . . . . 0.0 109.872 -179.829 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -53.02 -40.42 63.86 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.314 -0.866 . . . . 0.0 110.372 -179.792 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . 0.84 ' O ' HD12 ' A' ' 9' ' ' LEU . 8.0 ptm180 -62.35 -36.35 81.95 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.172 -0.955 . . . . 0.0 110.093 -179.916 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 22.7 t0 -81.16 -12.75 59.13 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.232 -0.917 . . . . 0.0 109.915 179.717 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.416 ' O ' ' SG ' ' A' ' 11' ' ' CYS . 0.8 OUTLIER -82.44 -39.76 22.14 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.324 -0.86 . . . . 0.0 110.095 179.923 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . 0.503 ' O ' HD12 ' A' ' 12' ' ' ILE . 2.2 t -84.52 -35.15 23.09 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.312 -0.867 . . . . 0.0 110.001 179.918 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.84 HD12 ' O ' ' A' ' 5' ' ' ARG . 5.6 mt -65.01 -46.91 79.41 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.353 -0.842 . . . . 0.0 109.992 179.808 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -64.16 -39.78 94.72 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.166 -0.959 . . . . 0.0 110.062 179.767 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.416 ' SG ' ' O ' ' A' ' 7' ' ' CYS . 82.5 m -67.37 -41.28 85.33 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.282 -0.886 . . . . 0.0 110.21 179.807 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . 0.503 HD12 ' O ' ' A' ' 8' ' ' SER . 53.6 mt -66.81 -44.0 89.4 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.603 0 O-C-N 121.297 -0.877 . . . . 0.0 110.258 179.981 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -69.1 -20.24 64.07 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.14 -0.975 . . . . 0.0 110.096 -179.962 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.61 -21.48 60.31 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.266 -0.896 . . . . 0.0 110.253 -179.961 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 124.32 -1.0 8.9 Favored Glycine 0 N--CA 1.491 2.328 0 N-CA-C 109.749 -1.341 . . . . 0.0 109.749 179.823 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' TYR . . . . . 0.445 ' N ' ' CD1' ' A' ' 16' ' ' TYR . 30.4 m-85 -89.09 -158.69 0.52 Allowed 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.138 -1.213 . . . . 0.0 110.236 -179.998 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . 0.577 ' HB3' ' CD2' ' A' ' 18' ' ' PHE . 5.3 t30 -120.1 -40.7 2.69 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.146 -0.971 . . . . 0.0 110.239 179.978 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . 0.577 ' CD2' ' HB3' ' A' ' 17' ' ' ASN . 12.3 p90 -157.1 158.01 35.6 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.127 -0.983 . . . . 0.0 110.404 179.874 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . 0.44 ' O ' ' HB3' ' A' ' 20' ' ' LYS . . . -138.88 -165.12 10.15 Favored Glycine 0 N--CA 1.492 2.37 0 N-CA-C 109.427 -1.469 . . . . 0.0 109.427 179.993 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.44 ' HB3' ' O ' ' A' ' 19' ' ' GLY . 0.0 OUTLIER -176.75 163.04 2.25 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.264 -1.139 . . . . 0.0 110.207 179.965 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . 0.591 ' O ' HG23 ' A' ' 22' ' ' VAL . 2.8 t -92.03 155.7 17.92 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.331 -0.856 . . . . 0.0 110.375 -179.93 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.591 HG23 ' O ' ' A' ' 21' ' ' CYS . 73.0 t -157.48 103.63 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.567 0 O-C-N 121.319 -0.863 . . . . 0.0 110.027 179.785 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . 0.442 ' HB2' ' O ' ' A' ' 22' ' ' VAL . 0.0 OUTLIER 57.87 66.15 1.18 Allowed 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.219 -0.926 . . . . 0.0 110.122 -179.854 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 50.48 44.59 45.93 Favored Glycine 0 N--CA 1.491 2.344 0 N-CA-C 109.499 -1.44 . . . . 0.0 109.499 -179.975 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . 0.405 ' O ' ' SG ' ' A' ' 21' ' ' CYS . 0.2 OUTLIER -142.26 164.91 28.86 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.203 -1.175 . . . . 0.0 110.209 179.988 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -134.93 111.21 9.65 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.242 -0.911 . . . . 0.0 110.09 179.938 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -117.77 168.06 10.81 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.368 -0.833 . . . . 0.0 110.273 -179.793 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 23.3 m -124.44 142.71 51.1 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.301 -0.875 . . . . 0.0 110.05 179.84 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.481 ' HB2' ' CE1' ' A' ' 18' ' ' PHE . 3.8 mmp_? -129.72 136.43 49.66 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.194 -0.942 . . . . 0.0 110.25 -179.933 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 10.4 mtp85 . . . . . 0 N--CA 1.492 1.649 0 O-C-N 121.242 -0.911 . . . . 0.0 110.226 -179.941 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . 0.415 ' C ' ' SG ' ' A' ' 21' ' ' CYS . 7.2 t . . . . . 0 N--CA 1.492 1.652 0 CA-C-O 121.317 0.58 . . . . 0.0 110.115 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 3' ' ' ASN . . . . . 0.489 ' O ' ' HB3' ' A' ' 7' ' ' CYS . 0.8 OUTLIER -126.44 129.61 49.05 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.387 -0.821 . . . . 0.0 110.036 -179.971 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 10.4 m-20 -54.64 -41.9 70.63 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.275 -0.89 . . . . 0.0 110.675 -179.749 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . 0.726 ' O ' HD12 ' A' ' 9' ' ' LEU . 3.0 ttt180 -81.88 -35.34 29.35 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.13 -0.981 . . . . 0.0 110.264 -179.808 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . 0.449 ' O ' ' HB2' ' A' ' 10' ' ' ASP . 3.0 t70 -79.4 -25.66 42.08 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.357 -0.839 . . . . 0.0 110.167 -179.943 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.489 ' HB3' ' O ' ' A' ' 3' ' ' ASN . 17.0 t -87.25 -42.11 13.19 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.316 -0.865 . . . . 0.0 110.067 179.937 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . 0.475 ' O ' ' HB ' ' A' ' 12' ' ' ILE . 84.6 p -67.92 -46.49 71.4 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.366 -0.834 . . . . 0.0 110.285 -179.854 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.726 HD12 ' O ' ' A' ' 5' ' ' ARG . 3.0 mt -65.27 -38.3 89.87 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.181 -0.949 . . . . 0.0 110.414 -179.883 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . 0.449 ' HB2' ' O ' ' A' ' 6' ' ' ASP . 26.1 m-20 -74.11 -48.82 27.0 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.213 -0.929 . . . . 0.0 110.502 -179.844 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.496 ' SG ' ' CB ' ' A' ' 16' ' ' TYR . 53.0 t -68.71 -39.18 80.57 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.185 -0.947 . . . . 0.0 110.631 -179.764 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . 0.475 ' HB ' ' O ' ' A' ' 8' ' ' SER . 46.8 mt -63.48 -39.3 84.8 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.553 0 O-C-N 121.095 -1.003 . . . . 0.0 110.152 179.942 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . 0.438 ' HB2' ' O ' ' A' ' 9' ' ' LEU . 5.4 ttm -77.85 -19.07 55.51 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.243 -0.91 . . . . 0.0 109.981 179.759 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.11 -24.47 61.49 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.299 -0.876 . . . . 0.0 110.128 179.849 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 132.49 -2.93 5.03 Favored Glycine 0 N--CA 1.49 2.239 0 N-CA-C 109.559 -1.416 . . . . 0.0 109.559 -179.969 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' TYR . . . . . 0.587 ' CD1' ' HB3' ' A' ' 28' ' ' CYS . 82.2 m-85 -82.22 -172.24 3.87 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.287 -1.126 . . . . 0.0 110.183 -179.956 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . 0.52 ' C ' ' CD1' ' A' ' 18' ' ' PHE . 1.8 t-20 -127.18 -32.13 2.52 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.244 -0.91 . . . . 0.0 110.269 -179.935 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . 0.52 ' CD1' ' C ' ' A' ' 17' ' ' ASN . 2.9 m-85 -123.84 169.47 11.54 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.123 -0.986 . . . . 0.0 110.37 -179.912 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -156.67 129.12 2.34 Favored Glycine 0 N--CA 1.491 2.341 0 N-CA-C 109.439 -1.464 . . . . 0.0 109.439 179.853 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.446 ' O ' ' SG ' ' A' ' 26' ' ' CYS . 32.8 tttp -144.5 140.91 29.17 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.131 -1.217 . . . . 0.0 110.367 -179.843 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . 0.461 ' HA ' ' HA ' ' A' ' 26' ' ' CYS . 0.0 OUTLIER -97.58 131.62 44.0 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.185 -0.947 . . . . 0.0 110.206 -179.993 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.478 ' N ' ' O ' ' A' ' 25' ' ' SER . 54.2 t -151.23 127.83 2.01 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.615 0 O-C-N 121.149 -0.969 . . . . 0.0 110.471 179.998 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . 0.443 ' CB ' ' O ' ' A' ' 22' ' ' VAL . 14.9 ttp180 64.56 57.51 1.11 Allowed 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.32 -0.863 . . . . 0.0 110.314 179.829 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 50.24 22.19 4.81 Favored Glycine 0 N--CA 1.49 2.285 0 N-CA-C 109.5 -1.44 . . . . 0.0 109.5 -179.973 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . 0.478 ' O ' ' N ' ' A' ' 22' ' ' VAL . 41.3 m -142.2 177.94 7.89 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.348 -1.089 . . . . 0.0 109.915 -179.986 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . 0.461 ' HA ' ' HA ' ' A' ' 21' ' ' CYS . 0.7 OUTLIER -136.8 143.13 43.02 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.145 -0.972 . . . . 0.0 110.392 179.998 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 2.4 mt-30 -115.19 156.3 25.59 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.309 -0.869 . . . . 0.0 109.971 179.821 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . 0.587 ' HB3' ' CD1' ' A' ' 16' ' ' TYR . 32.1 m -125.37 171.27 10.57 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.258 -0.901 . . . . 0.0 110.314 -179.861 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -143.19 139.66 30.4 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.376 -0.828 . . . . 0.0 110.033 179.891 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.489 1.518 0 O-C-N 121.218 -0.926 . . . . 0.0 110.252 -179.998 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . 0.464 ' O ' ' O ' ' A' ' 3' ' ' ASN . 16.7 p . . . . . 0 N--CA 1.491 1.575 0 CA-C-O 121.263 0.554 . . . . 0.0 110.301 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 3' ' ' ASN . . . . . 0.503 ' O ' ' HB2' ' A' ' 7' ' ' CYS . 2.1 m-20 58.89 124.53 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.289 -0.882 . . . . 0.0 110.54 179.683 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' ASP . . . . . 0.495 ' HA ' ' HB3' ' A' ' 7' ' ' CYS . 23.7 m-20 -80.14 -24.82 40.19 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.159 -0.963 . . . . 0.0 110.227 179.811 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 5.3 ttt180 -63.81 -60.77 2.86 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.329 -0.857 . . . . 0.0 110.471 -179.831 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 5.6 t70 -79.65 6.31 10.99 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.232 -0.918 . . . . 0.0 110.155 -179.943 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.503 ' HB2' ' O ' ' A' ' 3' ' ' ASN . 4.9 t -99.58 -36.05 9.65 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.347 -0.846 . . . . 0.0 110.073 179.89 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -93.26 -29.3 15.75 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.314 -0.866 . . . . 0.0 110.22 179.923 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 2.7 mt -55.27 -55.65 29.04 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.31 -0.869 . . . . 0.0 110.332 -179.937 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 3.1 t0 -65.62 -35.97 82.37 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.156 -0.965 . . . . 0.0 110.369 -179.877 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -66.67 -49.47 66.07 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.255 -0.903 . . . . 0.0 110.2 179.997 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 61.2 mt -63.65 -24.1 35.0 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.637 0 O-C-N 121.328 -0.858 . . . . 0.0 109.894 179.855 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 2.7 mtt -79.66 -26.55 41.0 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.314 -0.866 . . . . 0.0 110.003 179.801 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.21 -25.79 60.9 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.274 -0.891 . . . . 0.0 110.102 179.907 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 134.51 -9.04 4.65 Favored Glycine 0 N--CA 1.491 2.331 0 N-CA-C 109.62 -1.392 . . . . 0.0 109.62 179.986 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 23.1 m-85 -68.02 -158.45 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.159 -1.201 . . . . 0.0 110.165 -179.98 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . 0.59 ' HB3' ' CD2' ' A' ' 18' ' ' PHE . 0.1 OUTLIER -135.71 -53.1 0.76 Allowed 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.343 -0.848 . . . . 0.0 110.118 179.953 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . 0.592 ' CE1' ' HB2' ' A' ' 29' ' ' ARG . 6.1 p90 -152.93 157.61 40.88 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.226 -0.921 . . . . 0.0 110.37 179.799 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . 0.432 ' HA3' ' HA ' ' A' ' 28' ' ' CYS . . . -154.05 -160.5 9.83 Favored Glycine 0 N--CA 1.49 2.24 0 N-CA-C 109.474 -1.45 . . . . 0.0 109.474 179.883 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -172.75 176.02 3.25 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.097 -1.237 . . . . 0.0 110.335 179.981 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . 0.448 ' SG ' ' O ' ' A' ' 25' ' ' SER . 8.4 t -83.99 132.9 34.71 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.29 -0.881 . . . . 0.0 110.317 179.943 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.443 ' O ' ' HB2' ' A' ' 25' ' ' SER . 71.0 t -118.27 92.13 2.04 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.675 0 O-C-N 121.293 -0.879 . . . . 0.0 110.254 -179.947 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . 0.458 ' O ' ' OG ' ' A' ' 25' ' ' SER . 4.7 tmm_? 50.81 84.15 0.04 OUTLIER 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.311 -0.868 . . . . 0.0 110.363 179.909 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 51.62 22.71 8.58 Favored Glycine 0 N--CA 1.49 2.24 0 N-CA-C 109.69 -1.364 . . . . 0.0 109.69 179.964 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . 0.458 ' OG ' ' O ' ' A' ' 23' ' ' ARG . 1.1 m -135.78 -161.66 1.18 Allowed 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.333 -1.098 . . . . 0.0 109.718 179.794 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -167.03 124.62 1.26 Allowed 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.231 -0.918 . . . . 0.0 110.677 179.937 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.446 ' O ' ' SG ' ' A' ' 28' ' ' CYS . 33.8 mm-40 -119.06 -179.86 3.95 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.427 -0.796 . . . . 0.0 109.694 179.639 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . 0.446 ' SG ' ' O ' ' A' ' 27' ' ' GLN . 84.3 m -149.49 157.9 43.7 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.114 -0.991 . . . . 0.0 109.914 179.921 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.592 ' HB2' ' CE1' ' A' ' 18' ' ' PHE . 6.2 mmm180 -134.31 156.52 48.32 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.105 -0.997 . . . . 0.0 110.483 -179.642 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.601 0 O-C-N 121.292 -0.88 . . . . 0.0 110.122 179.92 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . 0.425 ' O ' ' CB ' ' A' ' 3' ' ' ASN . 20.6 p . . . . . 0 N--CA 1.492 1.639 0 CA-C-O 121.24 0.543 . . . . 0.0 110.269 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 3' ' ' ASN . . . . . 0.467 ' O ' ' N ' ' A' ' 7' ' ' CYS . 0.8 OUTLIER 173.66 137.76 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.195 -0.941 . . . . 0.0 110.251 -179.969 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' ASP . . . . . 0.4 ' O ' ' HB3' ' A' ' 8' ' ' SER . 0.7 OUTLIER -53.36 -34.96 59.67 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.122 -0.986 . . . . 0.0 110.203 -179.989 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . 0.806 ' O ' HD12 ' A' ' 9' ' ' LEU . 0.1 OUTLIER -78.4 -39.69 38.22 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.279 -0.888 . . . . 0.0 110.415 -179.946 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 4.3 t0 -84.8 -19.02 33.18 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.301 -0.875 . . . . 0.0 110.287 -179.889 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.467 ' N ' ' O ' ' A' ' 3' ' ' ASN . 10.1 t -87.64 -27.9 22.2 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.235 -0.916 . . . . 0.0 110.113 179.977 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . 0.4 ' HB3' ' O ' ' A' ' 4' ' ' ASP . 6.0 t -92.41 -33.04 14.7 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.285 -0.884 . . . . 0.0 110.337 -179.882 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.806 HD12 ' O ' ' A' ' 5' ' ' ARG . 0.8 OUTLIER -57.02 -55.9 28.75 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.173 -0.954 . . . . 0.0 110.284 -179.792 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -67.09 -38.22 85.32 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.15 -0.969 . . . . 0.0 110.179 -179.949 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.418 ' SG ' ' O ' ' A' ' 7' ' ' CYS . 55.0 m -68.11 -44.74 75.47 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.285 -0.885 . . . . 0.0 110.185 -179.975 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 19.8 mt -63.56 -41.13 91.57 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.589 0 O-C-N 121.187 -0.945 . . . . 0.0 109.997 179.882 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -69.08 -34.77 75.65 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.27 -0.894 . . . . 0.0 110.024 179.83 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -65.85 -57.12 8.66 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.294 -0.879 . . . . 0.0 109.945 179.832 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 159.91 36.65 0.02 OUTLIER Glycine 0 N--CA 1.491 2.352 0 N-CA-C 109.663 -1.375 . . . . 0.0 109.663 -179.991 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' TYR . . . . . 0.462 ' CD2' ' HG2' ' A' ' 30' ' ' ARG . 36.8 m-85 -113.09 -173.43 2.25 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.154 -1.203 . . . . 0.0 110.19 -179.996 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . 0.537 ' CG ' ' CE2' ' A' ' 18' ' ' PHE . 7.8 p30 -121.81 -34.92 3.29 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.312 -0.867 . . . . 0.0 109.942 179.662 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . 0.594 ' CE1' ' HB2' ' A' ' 29' ' ' ARG . 3.3 p90 -164.77 154.25 13.3 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.327 -0.858 . . . . 0.0 110.051 179.804 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . 0.443 ' O ' ' HB3' ' A' ' 20' ' ' LYS . . . -155.04 -162.77 11.49 Favored Glycine 0 N--CA 1.491 2.301 0 N-CA-C 109.391 -1.484 . . . . 0.0 109.391 179.997 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.443 ' HB3' ' O ' ' A' ' 19' ' ' GLY . 0.0 OUTLIER 178.45 165.7 0.8 Allowed 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.214 -1.168 . . . . 0.0 110.19 179.974 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . 0.488 ' HA ' ' O ' ' A' ' 25' ' ' SER . 39.3 t -83.0 145.67 29.19 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.2 -0.937 . . . . 0.0 109.968 179.839 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.431 ' O ' ' C ' ' A' ' 23' ' ' ARG . 92.5 t -138.47 126.46 29.08 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.597 0 O-C-N 121.197 -0.939 . . . . 0.0 110.393 -179.915 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . 0.431 ' C ' ' O ' ' A' ' 22' ' ' VAL . 3.0 ttp180 42.15 39.74 1.48 Allowed 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.259 -0.9 . . . . 0.0 110.149 -179.989 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 79.91 31.55 39.18 Favored Glycine 0 N--CA 1.49 2.281 0 N-CA-C 109.318 -1.513 . . . . 0.0 109.318 -179.879 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . 0.488 ' O ' ' HA ' ' A' ' 21' ' ' CYS . 44.2 m -128.63 -164.19 1.36 Allowed 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.281 -1.129 . . . . 0.0 110.025 179.967 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 7.3 t -153.11 97.33 2.17 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.274 -0.891 . . . . 0.0 109.979 179.951 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.431 ' O ' ' SG ' ' A' ' 28' ' ' CYS . 14.5 mm-40 -106.67 164.26 12.23 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.294 -0.879 . . . . 0.0 110.522 -179.792 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . 0.431 ' SG ' ' O ' ' A' ' 27' ' ' GLN . 81.0 m -149.5 161.58 41.83 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.357 -0.84 . . . . 0.0 109.843 179.891 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.594 ' HB2' ' CE1' ' A' ' 18' ' ' PHE . 14.2 mmm180 -123.28 164.35 18.95 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.156 -0.965 . . . . 0.0 110.328 -179.888 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.472 ' C ' ' ND2' ' A' ' 17' ' ' ASN . 59.4 mtp180 . . . . . 0 N--CA 1.492 1.631 0 O-C-N 121.241 -0.912 . . . . 0.0 110.065 179.855 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . 0.417 ' O ' ' C ' ' A' ' 3' ' ' ASN . 21.4 p . . . . . 0 N--CA 1.491 1.575 0 CA-C-O 121.195 0.521 . . . . 0.0 110.296 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 3' ' ' ASN . . . . . 0.46 ' O ' ' HB2' ' A' ' 7' ' ' CYS . 3.3 m-20 -42.93 149.66 0.19 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.221 -0.924 . . . . 0.0 110.19 -179.927 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 19.7 m-20 -68.55 -33.19 73.67 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.233 -0.917 . . . . 0.0 110.246 179.983 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . 0.599 ' O ' HD12 ' A' ' 9' ' ' LEU . 2.1 mtp180 -72.22 -41.57 66.74 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.245 -0.909 . . . . 0.0 110.177 179.97 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -79.92 3.16 20.77 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.239 -0.913 . . . . 0.0 110.196 179.879 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.46 ' HB2' ' O ' ' A' ' 3' ' ' ASN . 7.0 t -107.97 -30.46 8.45 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.182 -0.949 . . . . 0.0 110.227 -179.923 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -93.46 -43.33 8.79 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.216 -0.928 . . . . 0.0 110.186 -179.839 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.599 HD12 ' O ' ' A' ' 5' ' ' ARG . 47.3 mt -56.37 -49.61 73.92 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.214 -0.929 . . . . 0.0 110.298 -179.787 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 56.8 t0 -64.43 -45.94 85.35 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.261 -0.899 . . . . 0.0 110.289 -179.838 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.442 ' HA ' ' HG3' ' A' ' 14' ' ' LYS . 0.5 OUTLIER -66.21 -32.98 74.73 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.315 -0.866 . . . . 0.0 110.184 -179.896 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 24.2 mt -63.41 -39.36 85.02 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.547 0 O-C-N 121.19 -0.944 . . . . 0.0 109.373 179.616 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 4.6 ttm -71.18 -27.62 63.65 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.364 -0.835 . . . . 0.0 109.397 179.274 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . 0.442 ' HG3' ' HA ' ' A' ' 11' ' ' CYS . 2.7 mmpt? -63.47 -35.6 80.98 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.411 -0.806 . . . . 0.0 110.094 179.61 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 133.27 2.02 3.81 Favored Glycine 0 N--CA 1.491 2.34 0 N-CA-C 110.141 -1.184 . . . . 0.0 110.141 179.875 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' TYR . . . . . 0.51 ' HA ' ' CG ' ' A' ' 30' ' ' ARG . 17.8 m-85 -85.86 -167.58 1.91 Allowed 'General case' 0 N--CA 1.49 1.563 0 O-C-N 120.915 -1.344 . . . . 0.0 110.145 179.919 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . 0.58 ' HB3' ' CD2' ' A' ' 18' ' ' PHE . 0.7 OUTLIER -112.78 -62.52 1.57 Allowed 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.331 -0.856 . . . . 0.0 109.944 179.713 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . 0.58 ' CD2' ' HB3' ' A' ' 17' ' ' ASN . 7.5 p90 -143.71 151.66 40.32 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.274 -0.892 . . . . 0.0 110.142 179.597 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . 0.509 ' CA ' ' HA ' ' A' ' 28' ' ' CYS . . . -149.52 -164.6 11.79 Favored Glycine 0 N--CA 1.49 2.26 0 N-CA-C 109.501 -1.44 . . . . 0.0 109.501 -179.994 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.4 ' HB3' ' O ' ' A' ' 19' ' ' GLY . 0.0 OUTLIER -178.42 178.56 0.85 Allowed 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.226 -1.161 . . . . 0.0 110.111 179.972 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . 0.471 ' HA ' ' O ' ' A' ' 25' ' ' SER . 50.8 t -83.41 152.94 24.77 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.206 -0.934 . . . . 0.0 110.111 179.99 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.538 ' CG2' ' HB2' ' A' ' 27' ' ' GLN . 46.8 t -127.6 69.85 0.38 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.593 0 O-C-N 121.235 -0.916 . . . . 0.0 110.396 -179.994 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . 0.429 ' CB ' ' O ' ' A' ' 22' ' ' VAL . 0.4 OUTLIER 66.13 50.14 1.44 Allowed 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.275 -0.89 . . . . 0.0 110.368 179.849 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 94.53 16.95 40.83 Favored Glycine 0 N--CA 1.491 2.301 0 N-CA-C 109.674 -1.37 . . . . 0.0 109.674 179.857 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . 0.471 ' O ' ' HA ' ' A' ' 21' ' ' CYS . 0.6 OUTLIER -133.49 -166.32 1.76 Allowed 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.1 -1.235 . . . . 0.0 110.154 179.922 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 0.3 OUTLIER -148.36 105.49 3.62 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.154 -0.966 . . . . 0.0 110.27 -179.973 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.538 ' HB2' ' CG2' ' A' ' 22' ' ' VAL . 3.2 mm100 -105.89 179.34 4.3 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.17 -0.956 . . . . 0.0 110.277 179.927 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . 0.509 ' HA ' ' CA ' ' A' ' 19' ' ' GLY . 66.4 m -151.9 164.76 36.44 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.348 -0.845 . . . . 0.0 109.929 179.817 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.502 ' HB2' ' CE1' ' A' ' 18' ' ' PHE . 0.0 OUTLIER -142.97 133.04 24.32 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.055 -1.028 . . . . 0.0 110.47 179.975 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.51 ' CG ' ' HA ' ' A' ' 16' ' ' TYR . 9.4 mtm180 . . . . . 0 N--CA 1.49 1.547 0 O-C-N 121.357 -0.839 . . . . 0.0 110.253 179.988 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . 0.435 ' O ' ' SG ' ' A' ' 2' ' ' CYS . 32.0 p . . . . . 0 N--CA 1.491 1.588 0 CA-C-O 121.226 0.536 . . . . 0.0 110.246 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 3' ' ' ASN . . . . . 0.44 ' O ' ' SG ' ' A' ' 7' ' ' CYS . 0.1 OUTLIER -88.11 146.01 25.65 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.242 -0.911 . . . . 0.0 110.161 -179.982 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 2.4 p30 -69.07 -41.52 77.44 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.279 -0.888 . . . . 0.0 110.369 -179.988 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.81 -33.8 66.44 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.079 -1.013 . . . . 0.0 110.184 179.978 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 14.7 t0 -78.54 -11.03 59.94 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.259 -0.901 . . . . 0.0 109.743 179.894 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.44 ' SG ' ' O ' ' A' ' 3' ' ' ASN . 19.3 m -93.5 -42.34 9.29 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.347 -0.846 . . . . 0.0 109.606 179.418 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . 0.616 ' O ' HD12 ' A' ' 12' ' ' ILE . 6.7 p -67.21 -37.52 83.77 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.346 -0.846 . . . . 0.0 109.912 179.669 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.479 ' O ' ' HB2' ' A' ' 13' ' ' MET . 18.5 mt -66.38 -25.71 66.91 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.296 -0.877 . . . . 0.0 110.235 179.854 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -75.27 -47.01 29.99 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.296 -0.878 . . . . 0.0 110.392 -179.775 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.464 ' O ' ' HB2' ' A' ' 16' ' ' TYR . 30.7 m -67.06 -44.22 80.7 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.286 -0.884 . . . . 0.0 110.472 -179.668 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . 0.616 HD12 ' O ' ' A' ' 8' ' ' SER . 31.8 mt -63.36 -38.61 82.61 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.654 0 O-C-N 121.188 -0.945 . . . . 0.0 110.457 -179.721 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . 0.479 ' HB2' ' O ' ' A' ' 9' ' ' LEU . 1.9 tpp -65.31 -46.64 79.55 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.223 -0.923 . . . . 0.0 110.246 179.956 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 6.4 mtpt -63.01 -31.43 72.56 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.209 -0.932 . . . . 0.0 110.328 -179.889 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 139.67 -7.48 3.03 Favored Glycine 0 N--CA 1.49 2.254 0 N-CA-C 109.804 -1.318 . . . . 0.0 109.804 179.963 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' TYR . . . . . 0.464 ' HB2' ' O ' ' A' ' 11' ' ' CYS . 99.1 m-85 -76.73 -171.42 1.89 Allowed 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.209 -1.171 . . . . 0.0 110.092 179.999 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . 0.448 ' HB3' ' CD2' ' A' ' 18' ' ' PHE . 0.1 OUTLIER -118.24 -42.56 2.78 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.082 -1.012 . . . . 0.0 110.521 -179.749 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . 0.448 ' CD2' ' HB3' ' A' ' 17' ' ' ASN . 2.9 p90 -159.81 158.53 31.23 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.091 -1.006 . . . . 0.0 110.549 -179.885 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . 0.479 ' HA3' ' O ' ' A' ' 27' ' ' GLN . . . -144.47 -148.66 4.9 Favored Glycine 0 N--CA 1.491 2.339 0 N-CA-C 109.42 -1.472 . . . . 0.0 109.42 179.948 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.486 ' O ' ' HA ' ' A' ' 26' ' ' CYS . 0.3 OUTLIER -176.12 168.93 2.87 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.231 -1.158 . . . . 0.0 110.253 179.97 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . 0.446 ' SG ' ' SG ' ' A' ' 26' ' ' CYS . 1.2 m -87.62 142.19 28.04 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.351 -0.843 . . . . 0.0 110.166 -179.92 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 22.1 t -131.98 76.57 0.48 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.7 0 O-C-N 121.35 -0.843 . . . . 0.0 110.145 179.897 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 2.3 mtm-85 60.26 77.22 0.33 Allowed 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.335 -0.853 . . . . 0.0 110.243 179.98 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 62.8 11.81 38.62 Favored Glycine 0 N--CA 1.49 2.278 0 N-CA-C 109.578 -1.409 . . . . 0.0 109.578 179.979 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . 0.42 ' O ' ' HA ' ' A' ' 21' ' ' CYS . 0.1 OUTLIER -130.33 176.34 8.21 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.221 -1.164 . . . . 0.0 109.926 179.877 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . 0.486 ' HA ' ' O ' ' A' ' 20' ' ' LYS . 0.5 OUTLIER -154.08 132.26 11.84 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.172 -0.955 . . . . 0.0 110.204 -179.972 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.479 ' O ' ' HA3' ' A' ' 19' ' ' GLY . 2.5 mm100 -120.13 174.81 6.26 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.289 -0.882 . . . . 0.0 110.409 -179.885 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . 0.445 ' HB3' ' HB3' ' A' ' 11' ' ' CYS . 56.5 m -126.96 144.31 51.04 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.367 -0.833 . . . . 0.0 110.163 179.919 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 17.1 mmt180 -122.6 148.49 45.17 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.251 -0.905 . . . . 0.0 110.258 -179.925 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.659 0 O-C-N 121.323 -0.861 . . . . 0.0 110.222 179.996 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 17.9 p . . . . . 0 N--CA 1.492 1.636 0 CA-C-O 121.291 0.567 . . . . 0.0 110.254 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 35.0 m120 -117.55 133.58 55.8 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.231 -0.918 . . . . 0.0 110.122 179.978 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 4' ' ' ASP . . . . . 0.459 ' N ' ' OD1' ' A' ' 4' ' ' ASP . 0.9 OUTLIER -61.85 -30.41 70.83 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.262 -0.899 . . . . 0.0 110.224 179.95 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.08 -29.55 64.23 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.255 -0.903 . . . . 0.0 110.089 179.904 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -79.47 -14.36 58.96 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.297 -0.877 . . . . 0.0 110.126 179.869 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -96.97 -25.15 15.49 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.291 -0.881 . . . . 0.0 109.888 179.863 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . 0.42 ' OG ' ' O ' ' A' ' 4' ' ' ASP . 0.1 OUTLIER -82.82 -43.78 16.26 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.339 -0.85 . . . . 0.0 110.083 179.846 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -62.37 -49.61 74.86 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.267 -0.896 . . . . 0.0 110.087 179.818 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -62.47 -27.08 68.88 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.26 -0.9 . . . . 0.0 109.638 179.681 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.54 ' O ' ' N ' ' A' ' 16' ' ' TYR . 0.1 OUTLIER -66.77 -46.12 76.34 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.395 -0.816 . . . . 0.0 109.641 179.428 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 89.4 mt -75.49 -33.34 27.02 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.502 0 O-C-N 121.339 -0.85 . . . . 0.0 110.2 179.971 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 1.7 ttt -69.0 -52.92 23.78 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.121 -0.987 . . . . 0.0 110.226 -179.989 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 4.1 mttt -60.8 -30.51 70.11 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.321 -0.862 . . . . 0.0 110.344 -179.977 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 122.68 14.55 4.26 Favored Glycine 0 N--CA 1.491 2.365 0 N-CA-C 109.756 -1.337 . . . . 0.0 109.756 179.944 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' TYR . . . . . 0.54 ' N ' ' O ' ' A' ' 11' ' ' CYS . 48.2 m-85 -92.53 -179.98 5.34 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.246 -1.15 . . . . 0.0 110.08 179.879 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . 0.511 ' HB2' ' HA ' ' A' ' 30' ' ' ARG . 6.7 m120 -101.56 -52.1 3.3 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.094 -1.004 . . . . 0.0 110.486 -179.792 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . 0.541 ' CE2' ' HB2' ' A' ' 29' ' ' ARG . 33.2 p90 -146.91 163.19 36.92 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.103 -0.998 . . . . 0.0 110.567 -179.872 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -138.38 -170.45 11.86 Favored Glycine 0 N--CA 1.491 2.316 0 N-CA-C 109.375 -1.49 . . . . 0.0 109.375 179.944 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -170.52 164.61 8.49 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.216 -1.167 . . . . 0.0 110.2 179.916 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . 0.49 ' HA ' ' O ' ' A' ' 25' ' ' SER . 0.8 OUTLIER -90.99 137.72 32.15 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.219 -0.926 . . . . 0.0 110.113 179.943 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.53 ' HB ' ' CB ' ' A' ' 25' ' ' SER . 57.3 t -110.07 76.26 0.42 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.641 0 O-C-N 121.234 -0.916 . . . . 0.0 110.173 -179.98 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 13.6 mtm180 54.37 54.16 9.82 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.229 -0.92 . . . . 0.0 110.208 179.894 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 93.9 15.41 49.09 Favored Glycine 0 N--CA 1.49 2.3 0 N-CA-C 109.753 -1.339 . . . . 0.0 109.753 179.957 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . 0.53 ' CB ' ' HB ' ' A' ' 22' ' ' VAL . 0.5 OUTLIER -127.36 -176.15 3.65 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.226 -1.161 . . . . 0.0 110.213 -179.946 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 8.1 t -143.56 114.17 7.57 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.207 -0.933 . . . . 0.0 110.175 -179.988 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 21.4 mm100 -117.45 157.6 25.94 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.269 -0.894 . . . . 0.0 110.132 179.961 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -124.32 133.23 53.52 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.325 -0.86 . . . . 0.0 110.084 -179.982 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.541 ' HB2' ' CE2' ' A' ' 18' ' ' PHE . 3.4 mtm180 -123.37 163.6 20.48 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.162 -0.961 . . . . 0.0 110.383 -179.941 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.511 ' HA ' ' HB2' ' A' ' 17' ' ' ASN . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.618 0 O-C-N 121.327 -0.858 . . . . 0.0 110.118 179.955 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . 0.443 ' O ' ' CB ' ' A' ' 3' ' ' ASN . 18.3 p . . . . . 0 N--CA 1.49 1.542 0 CA-C-O 121.262 0.553 . . . . 0.0 110.244 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 3' ' ' ASN . . . . . 0.455 ' O ' ' CB ' ' A' ' 7' ' ' CYS . 17.3 t-20 64.9 93.42 0.06 Allowed 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.24 -0.913 . . . . 0.0 110.158 -179.801 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 93.0 m-20 -57.35 -35.78 70.37 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.26 -0.9 . . . . 0.0 110.359 -179.908 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . 0.454 ' O ' ' HB2' ' A' ' 9' ' ' LEU . 1.3 ttm-85 -62.6 -57.26 11.72 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.081 -1.012 . . . . 0.0 110.161 -179.935 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -79.89 6.63 10.63 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.279 -0.888 . . . . 0.0 110.211 179.916 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.455 ' CB ' ' O ' ' A' ' 3' ' ' ASN . 39.5 t -107.22 -34.0 7.25 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.268 -0.895 . . . . 0.0 110.232 -179.946 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . 0.454 ' O ' HG13 ' A' ' 12' ' ' ILE . 19.4 m -93.96 -42.2 9.18 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.293 -0.879 . . . . 0.0 110.434 -179.777 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.454 ' HB2' ' O ' ' A' ' 5' ' ' ARG . 0.2 OUTLIER -53.32 -49.24 67.48 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.187 -0.946 . . . . 0.0 110.362 -179.71 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -62.87 -46.73 86.49 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.152 -0.967 . . . . 0.0 110.158 179.914 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -66.64 -38.96 87.96 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.197 -0.939 . . . . 0.0 110.179 -179.885 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . 0.454 HG13 ' O ' ' A' ' 8' ' ' SER . 14.2 mt -64.65 -33.58 64.13 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.611 0 O-C-N 121.232 -0.918 . . . . 0.0 110.149 179.907 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 7.3 ttm -73.85 -30.17 62.52 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.265 -0.897 . . . . 0.0 110.098 179.906 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 3.9 mtpp -59.64 -30.44 68.72 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.298 -0.876 . . . . 0.0 110.307 -179.978 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 138.98 -6.32 3.13 Favored Glycine 0 N--CA 1.49 2.298 0 N-CA-C 109.829 -1.308 . . . . 0.0 109.829 179.978 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 94.9 m-85 -77.15 177.37 7.89 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.174 -1.192 . . . . 0.0 110.202 179.988 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . 0.46 ' HB3' ' CD2' ' A' ' 18' ' ' PHE . 34.2 t-20 -102.81 -59.52 1.69 Allowed 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.207 -0.933 . . . . 0.0 110.367 179.994 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . 0.507 ' CE1' ' CB ' ' A' ' 29' ' ' ARG . 17.1 p90 -140.82 161.81 36.93 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.232 -0.918 . . . . 0.0 110.309 179.974 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . 0.506 ' HA2' ' HA ' ' A' ' 28' ' ' CYS . . . -148.04 -160.6 9.06 Favored Glycine 0 N--CA 1.49 2.285 0 N-CA-C 109.5 -1.44 . . . . 0.0 109.5 -179.927 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -177.63 170.64 1.98 Allowed 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.226 -1.161 . . . . 0.0 110.178 179.935 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . 0.475 ' C ' HG23 ' A' ' 22' ' ' VAL . 4.0 t -93.49 155.11 17.52 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.284 -0.885 . . . . 0.0 110.217 -179.936 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.475 HG23 ' C ' ' A' ' 21' ' ' CYS . 98.0 t -149.79 94.49 0.18 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.64 0 O-C-N 121.29 -0.881 . . . . 0.0 110.115 179.933 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER 50.62 65.79 1.35 Allowed 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.26 -0.9 . . . . 0.0 110.239 179.999 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 61.33 37.71 94.51 Favored Glycine 0 N--CA 1.491 2.32 0 N-CA-C 109.603 -1.399 . . . . 0.0 109.603 179.986 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . 0.441 ' HB3' ' HB ' ' A' ' 22' ' ' VAL . 2.4 t -134.94 170.8 15.33 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.322 -1.104 . . . . 0.0 110.189 179.97 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 1.3 m -134.61 102.57 5.34 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.282 -0.886 . . . . 0.0 110.07 179.888 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 10.4 mm100 -105.24 164.82 11.55 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.399 -0.813 . . . . 0.0 110.318 -179.718 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . 0.506 ' HA ' ' HA2' ' A' ' 19' ' ' GLY . 59.4 m -145.79 158.03 43.88 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.301 -0.875 . . . . 0.0 110.294 -179.88 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.507 ' CB ' ' CE1' ' A' ' 18' ' ' PHE . 0.0 OUTLIER -138.37 149.13 45.26 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.306 -0.871 . . . . 0.0 110.159 179.927 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.587 0 O-C-N 121.315 -0.865 . . . . 0.0 110.266 179.977 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . 0.449 ' O ' ' O ' ' A' ' 3' ' ' ASN . 19.4 p . . . . . 0 N--CA 1.491 1.607 0 CA-C-O 121.267 0.556 . . . . 0.0 110.2 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 3' ' ' ASN . . . . . 0.449 ' O ' ' O ' ' A' ' 2' ' ' CYS . 2.1 t-20 59.92 124.02 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.256 -0.903 . . . . 0.0 110.208 -179.99 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 4' ' ' ASP . . . . . 0.452 ' OD1' ' HB2' ' A' ' 21' ' ' CYS . 0.3 OUTLIER -66.26 -28.63 68.86 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.276 -0.89 . . . . 0.0 110.239 -179.914 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 62.1 ttt180 -68.16 -44.96 74.83 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.26 -0.9 . . . . 0.0 110.149 -179.903 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 74.6 m-20 -79.4 -17.16 54.94 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.223 -0.923 . . . . 0.0 110.079 179.974 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.415 ' SG ' ' O ' ' A' ' 20' ' ' LYS . 14.7 t -82.73 -33.31 27.56 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.376 -0.827 . . . . 0.0 110.083 179.846 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . 0.748 ' O ' HD12 ' A' ' 12' ' ' ILE . 34.8 p -80.94 -50.11 10.14 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.359 -0.838 . . . . 0.0 110.286 -179.909 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -56.01 -22.53 27.59 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.165 -0.96 . . . . 0.0 110.064 179.928 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -73.96 -47.02 40.39 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.309 -0.87 . . . . 0.0 110.125 179.934 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.457 ' O ' ' HB2' ' A' ' 16' ' ' TYR . 21.0 m -67.22 -44.73 78.8 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.184 -0.948 . . . . 0.0 109.989 179.918 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . 0.748 HD12 ' O ' ' A' ' 8' ' ' SER . 2.5 mt -63.74 -30.48 50.03 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.601 0 O-C-N 121.239 -0.913 . . . . 0.0 110.069 179.844 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -74.98 -28.25 60.48 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.223 -0.923 . . . . 0.0 110.126 179.82 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 3.2 mtpp -82.73 -18.07 42.09 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.327 -0.858 . . . . 0.0 110.339 179.973 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 117.65 8.87 10.6 Favored Glycine 0 N--CA 1.491 2.362 0 N-CA-C 109.635 -1.386 . . . . 0.0 109.635 179.836 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' TYR . . . . . 0.457 ' HB2' ' O ' ' A' ' 11' ' ' CYS . 40.4 m-85 -83.77 -172.5 4.19 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.18 -1.188 . . . . 0.0 110.139 179.965 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . 0.586 ' HB3' ' CE1' ' A' ' 18' ' ' PHE . 0.4 OUTLIER -133.05 0.49 3.45 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.219 -0.925 . . . . 0.0 110.475 -179.819 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . 0.586 ' CE1' ' HB3' ' A' ' 17' ' ' ASN . 5.9 m-85 -141.37 162.49 35.36 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.137 -0.977 . . . . 0.0 110.414 -179.948 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . 0.443 ' HA3' ' HA ' ' A' ' 8' ' ' SER . . . -156.85 121.4 1.07 Allowed Glycine 0 N--CA 1.49 2.239 0 N-CA-C 109.355 -1.498 . . . . 0.0 109.355 179.904 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.415 ' O ' ' SG ' ' A' ' 7' ' ' CYS . 23.1 ttpt -134.64 149.74 50.59 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.155 -1.203 . . . . 0.0 110.424 -179.787 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . 0.452 ' HB2' ' OD1' ' A' ' 4' ' ' ASP . 0.1 OUTLIER -105.57 126.54 52.25 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.357 -0.84 . . . . 0.0 110.042 179.829 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.42 HG23 ' C ' ' A' ' 21' ' ' CYS . 59.0 t -145.59 139.14 21.48 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.637 0 O-C-N 121.291 -0.881 . . . . 0.0 110.26 -179.897 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 42.2 mtm180 47.67 53.73 10.83 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.27 -0.893 . . . . 0.0 110.261 179.87 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 51.7 29.49 25.71 Favored Glycine 0 N--CA 1.49 2.259 0 N-CA-C 109.652 -1.379 . . . . 0.0 109.652 179.912 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 8.4 t -131.09 -170.61 2.4 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.227 -1.161 . . . . 0.0 110.235 -179.952 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 53.3 t -143.31 140.73 30.72 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.292 -0.88 . . . . 0.0 110.096 -179.976 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 30.3 mt-30 -120.28 141.78 49.68 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.127 -0.983 . . . . 0.0 110.619 -179.813 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 43.4 m -124.22 150.57 45.11 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.355 -0.841 . . . . 0.0 109.886 179.602 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.476 ' HB3' ' CD1' ' A' ' 18' ' ' PHE . 0.0 OUTLIER -136.38 161.12 36.68 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.131 -0.981 . . . . 0.0 110.227 -179.91 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.425 ' HG2' ' HA ' ' A' ' 16' ' ' TYR . 0.2 OUTLIER . . . . . 0 N--CA 1.493 1.691 0 O-C-N 121.187 -0.945 . . . . 0.0 110.002 179.927 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . 0.453 ' O ' ' SG ' ' A' ' 2' ' ' CYS . 10.6 t . . . . . 0 N--CA 1.491 1.597 0 CA-C-O 121.273 0.558 . . . . 0.0 110.088 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -79.11 134.08 36.74 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.235 -0.916 . . . . 0.0 110.228 179.988 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 4' ' ' ASP . . . . . 0.508 ' OD1' ' N ' ' A' ' 4' ' ' ASP . 8.6 p-10 -57.01 -41.3 78.24 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.235 -0.916 . . . . 0.0 110.208 179.9 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 7.0 tpt180 -62.25 -42.46 99.35 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.24 -0.912 . . . . 0.0 109.925 179.942 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -79.34 -17.04 55.34 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.365 -0.834 . . . . 0.0 109.741 179.608 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.454 ' O ' ' SG ' ' A' ' 11' ' ' CYS . 0.9 OUTLIER -78.0 -33.02 51.48 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.43 -0.794 . . . . 0.0 109.874 179.618 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . 0.452 ' O ' HG13 ' A' ' 12' ' ' ILE . 0.3 OUTLIER -82.04 -43.99 17.21 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.393 -0.817 . . . . 0.0 110.152 179.734 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.4 mt -55.32 -46.94 76.31 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.262 -0.899 . . . . 0.0 110.193 179.943 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 19.9 t0 -63.77 -37.37 87.1 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.274 -0.891 . . . . 0.0 110.168 179.977 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.454 ' SG ' ' O ' ' A' ' 7' ' ' CYS . 82.4 m -66.32 -41.07 90.19 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.26 -0.9 . . . . 0.0 109.849 179.86 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . 0.452 HG13 ' O ' ' A' ' 8' ' ' SER . 81.4 mt -63.83 -35.65 73.92 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.587 0 O-C-N 121.322 -0.861 . . . . 0.0 109.901 179.822 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -70.72 -28.66 64.89 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.275 -0.891 . . . . 0.0 109.83 179.769 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.29 -23.93 46.94 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.313 -0.867 . . . . 0.0 110.132 179.889 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 124.52 -3.15 8.8 Favored Glycine 0 N--CA 1.491 2.348 0 N-CA-C 109.592 -1.403 . . . . 0.0 109.592 179.957 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' TYR . . . . . 0.417 ' CD2' ' CB ' ' A' ' 28' ' ' CYS . 48.1 m-85 -86.96 -175.71 5.46 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.126 -1.22 . . . . 0.0 110.334 -179.955 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 28.1 m-80 -109.18 -55.01 2.47 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.265 -0.897 . . . . 0.0 110.223 -179.979 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . 0.605 ' CE2' ' HB2' ' A' ' 29' ' ' ARG . 8.2 p90 -129.62 170.15 14.14 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.154 -0.967 . . . . 0.0 110.408 179.958 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -140.15 -178.38 16.86 Favored Glycine 0 N--CA 1.49 2.297 0 N-CA-C 109.405 -1.478 . . . . 0.0 109.405 179.952 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -164.62 160.9 20.58 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.227 -1.161 . . . . 0.0 110.323 179.96 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . 0.466 ' HA ' ' O ' ' A' ' 25' ' ' SER . 1.8 t -92.94 141.14 28.74 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.235 -0.916 . . . . 0.0 110.351 -179.851 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.442 ' O ' ' HB2' ' A' ' 25' ' ' SER . 72.8 t -147.42 123.85 2.91 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.614 0 O-C-N 121.301 -0.874 . . . . 0.0 110.058 179.894 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . 0.436 ' HB2' ' O ' ' A' ' 22' ' ' VAL . 3.7 mmm-85 55.43 35.79 25.77 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.275 -0.89 . . . . 0.0 110.13 -179.904 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 73.17 29.19 64.88 Favored Glycine 0 N--CA 1.489 2.218 0 N-CA-C 109.5 -1.44 . . . . 0.0 109.5 -179.925 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . 0.466 ' O ' ' HA ' ' A' ' 21' ' ' CYS . 69.7 m -129.3 -171.59 2.53 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.283 -1.128 . . . . 0.0 110.307 179.999 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 47.3 t -141.53 121.41 13.59 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.346 -0.846 . . . . 0.0 110.181 179.956 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 4.8 mm-40 -120.21 174.74 6.31 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.171 -0.956 . . . . 0.0 110.458 -179.915 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . 0.417 ' CB ' ' CD2' ' A' ' 16' ' ' TYR . 73.1 m -125.05 149.58 47.65 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.323 -0.861 . . . . 0.0 110.085 179.886 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.605 ' HB2' ' CE2' ' A' ' 18' ' ' PHE . 0.7 OUTLIER -136.42 146.03 45.94 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.216 -0.928 . . . . 0.0 110.258 -179.916 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.491 1.624 0 O-C-N 121.259 -0.901 . . . . 0.0 110.241 -179.98 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . 0.434 ' O ' ' SG ' ' A' ' 2' ' ' CYS . 15.8 p . . . . . 0 N--CA 1.492 1.648 0 CA-C-O 121.246 0.546 . . . . 0.0 110.236 . . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 3' ' ' ASN . . . . . 0.467 ' O ' ' HB2' ' A' ' 7' ' ' CYS . 20.4 t-20 -100.54 125.14 46.86 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.3 -0.875 . . . . 0.0 110.253 -179.945 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 4' ' ' ASP . . . . . 0.472 ' HA ' ' HB3' ' A' ' 7' ' ' CYS . 3.6 m-20 -66.58 -34.37 77.74 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.197 -0.939 . . . . 0.0 110.38 179.976 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . 0.454 ' O ' ' HB2' ' A' ' 9' ' ' LEU . 1.8 mmm-85 -62.15 -54.47 40.69 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.159 -0.963 . . . . 0.0 110.125 179.951 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -79.5 2.22 22.85 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.239 -0.913 . . . . 0.0 110.045 179.758 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.472 ' HB3' ' HA ' ' A' ' 4' ' ' ASP . 14.8 t -95.3 -40.44 9.54 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.254 -0.904 . . . . 0.0 109.997 179.97 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 26.8 t -86.42 -35.39 19.75 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.376 -0.828 . . . . 0.0 110.045 179.875 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.454 ' HB2' ' O ' ' A' ' 5' ' ' ARG . 0.6 OUTLIER -55.22 -47.53 75.18 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.208 -0.932 . . . . 0.0 110.008 179.944 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -65.13 -35.02 79.79 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.321 -0.862 . . . . 0.0 110.122 179.912 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 1.5 t -70.45 -39.37 74.36 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.214 -0.929 . . . . 0.0 110.131 179.968 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 39.8 mt -63.55 -35.44 72.64 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.579 0 O-C-N 121.2 -0.938 . . . . 0.0 109.809 179.703 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -77.77 -27.57 50.31 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.382 -0.824 . . . . 0.0 109.754 179.39 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.51 -27.82 65.51 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.354 -0.841 . . . . 0.0 109.958 179.743 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 121.89 10.82 6.15 Favored Glycine 0 N--CA 1.489 2.192 0 N-CA-C 109.669 -1.373 . . . . 0.0 109.669 179.983 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 60.6 m-85 -93.44 -161.73 0.87 Allowed 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.301 -1.117 . . . . 0.0 110.327 -179.958 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . 0.477 ' HB3' ' CD2' ' A' ' 18' ' ' PHE . 1.8 t-20 -119.76 -51.44 2.26 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.264 -0.898 . . . . 0.0 110.36 -179.882 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . 0.588 ' CE1' ' HB2' ' A' ' 29' ' ' ARG . 6.5 p90 -161.84 156.66 22.93 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.277 -0.889 . . . . 0.0 110.154 -179.817 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . 0.514 ' HA2' ' HA ' ' A' ' 28' ' ' CYS . . . -127.88 -149.69 7.15 Favored Glycine 0 N--CA 1.491 2.363 0 N-CA-C 109.684 -1.366 . . . . 0.0 109.684 179.946 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.507 ' O ' ' HA ' ' A' ' 26' ' ' CYS . 9.7 tttp -175.26 152.98 1.48 Allowed 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.233 -1.157 . . . . 0.0 110.177 179.962 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 0.3 OUTLIER -90.84 129.58 36.88 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.274 -0.891 . . . . 0.0 110.312 179.957 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.446 ' O ' ' N ' ' A' ' 24' ' ' GLY . 84.5 t -109.72 98.35 6.92 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.613 0 O-C-N 121.242 -0.911 . . . . 0.0 110.07 -179.974 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 59.37 -84.81 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.174 -0.954 . . . . 0.0 110.13 -179.844 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . 0.446 ' N ' ' O ' ' A' ' 22' ' ' VAL . . . -126.05 15.71 6.9 Favored Glycine 0 N--CA 1.49 2.297 0 N-CA-C 109.527 -1.429 . . . . 0.0 109.527 179.887 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -130.87 -163.71 1.35 Allowed 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.264 -1.139 . . . . 0.0 110.076 179.88 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . 0.507 ' HA ' ' O ' ' A' ' 20' ' ' LYS . 0.5 OUTLIER -158.24 132.97 8.33 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.167 -0.958 . . . . 0.0 110.33 179.83 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 10.0 mm100 -108.89 -174.14 2.44 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.353 -0.842 . . . . 0.0 110.301 -179.935 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . 0.514 ' HA ' ' HA2' ' A' ' 19' ' ' GLY . 1.1 m -140.46 153.21 46.18 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.327 -0.858 . . . . 0.0 110.207 -179.994 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.588 ' HB2' ' CE1' ' A' ' 18' ' ' PHE . 4.5 mmt180 -144.04 137.95 28.0 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.309 -0.869 . . . . 0.0 110.286 -179.957 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.656 0 O-C-N 121.23 -0.919 . . . . 0.0 110.147 179.913 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . 0.447 ' SG ' ' O ' ' A' ' 25' ' ' SER . 12.0 p . . . . . 0 N--CA 1.491 1.616 0 CA-C-O 121.255 0.55 . . . . 0.0 110.174 . . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 2.8 m-20 -111.9 133.53 54.04 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.279 -0.888 . . . . 0.0 110.143 -179.937 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -50.75 -34.57 27.72 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.211 -0.931 . . . . 0.0 110.101 179.961 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -65.76 -49.89 66.73 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.254 -0.904 . . . . 0.0 110.084 179.812 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -79.68 0.86 28.62 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.243 -0.911 . . . . 0.0 110.098 179.846 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 11.6 t -100.23 -36.75 9.18 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.184 -0.947 . . . . 0.0 110.169 179.908 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . 0.441 ' OG ' ' HA3' ' A' ' 19' ' ' GLY . 0.1 OUTLIER -86.57 -35.26 19.58 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.296 -0.878 . . . . 0.0 110.091 179.909 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.478 ' HA ' HD12 ' A' ' 12' ' ' ILE . 2.2 mt -55.52 -55.36 32.83 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.258 -0.901 . . . . 0.0 110.136 179.924 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -62.78 -30.59 71.57 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.321 -0.862 . . . . 0.0 110.016 179.819 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 1.2 m -74.81 -39.48 61.66 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.316 -0.865 . . . . 0.0 110.098 179.856 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . 0.478 HD12 ' HA ' ' A' ' 9' ' ' LEU . 36.0 mt -63.64 -32.02 55.24 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.581 0 O-C-N 121.337 -0.852 . . . . 0.0 110.006 179.881 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -86.76 -20.24 27.93 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.33 -0.856 . . . . 0.0 110.016 179.826 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.62 -22.08 51.33 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.394 -0.816 . . . . 0.0 110.155 179.928 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 126.04 5.42 6.25 Favored Glycine 0 N--CA 1.49 2.271 0 N-CA-C 109.642 -1.383 . . . . 0.0 109.642 -179.999 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 78.0 m-85 -94.41 -172.58 2.82 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.199 -1.177 . . . . 0.0 110.129 179.976 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . 0.479 ' HB3' ' CE2' ' A' ' 18' ' ' PHE . 44.1 t30 -139.08 7.05 2.42 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.135 -0.978 . . . . 0.0 110.2 179.907 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . 0.479 ' CE2' ' HB3' ' A' ' 17' ' ' ASN . 49.1 m-85 -143.62 168.97 18.62 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.252 -0.905 . . . . 0.0 110.155 179.946 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . 0.441 ' HA3' ' OG ' ' A' ' 8' ' ' SER . . . -155.73 100.17 0.19 Allowed Glycine 0 N--CA 1.49 2.283 0 N-CA-C 109.434 -1.466 . . . . 0.0 109.434 179.953 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -120.39 137.97 54.01 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.205 -1.174 . . . . 0.0 110.247 -179.806 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -87.32 153.35 21.54 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.214 -0.929 . . . . 0.0 110.191 -179.981 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.502 HG21 ' HG3' ' A' ' 27' ' ' GLN . 35.8 t -126.57 61.44 0.29 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.56 0 O-C-N 121.247 -0.908 . . . . 0.0 110.167 179.893 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 3.3 mpp_? 60.26 63.86 1.33 Allowed 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.364 -0.835 . . . . 0.0 110.141 -179.808 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 92.15 13.09 58.02 Favored Glycine 0 N--CA 1.49 2.29 0 N-CA-C 109.493 -1.443 . . . . 0.0 109.493 -179.885 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . 0.487 ' CB ' ' HB ' ' A' ' 22' ' ' VAL . 0.6 OUTLIER -133.28 -175.93 3.97 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.257 -1.143 . . . . 0.0 110.164 179.971 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 12.2 t -150.26 114.87 5.24 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.237 -0.914 . . . . 0.0 110.386 -179.977 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.502 ' HG3' HG21 ' A' ' 22' ' ' VAL . 2.7 mm100 -114.79 161.5 18.1 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.188 -0.945 . . . . 0.0 110.123 179.844 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . 0.451 ' SG ' ' O ' ' A' ' 27' ' ' GLN . 86.4 m -150.0 -178.45 6.49 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.223 -0.923 . . . . 0.0 110.333 -179.952 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -146.98 163.1 37.3 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.272 -0.892 . . . . 0.0 110.195 -179.986 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.667 0 O-C-N 121.235 -0.915 . . . . 0.0 110.183 179.927 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . 0.473 ' O ' ' HB3' ' A' ' 3' ' ' ASN . 26.6 p . . . . . 0 N--CA 1.492 1.642 0 CA-C-O 121.234 0.54 . . . . 0.0 110.253 . . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 3' ' ' ASN . . . . . 0.473 ' HB3' ' O ' ' A' ' 2' ' ' CYS . 8.9 t-20 62.71 126.24 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.228 -0.92 . . . . 0.0 110.104 -179.743 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -76.11 -18.78 59.02 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.237 -0.914 . . . . 0.0 110.412 -179.776 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -67.85 -55.78 11.64 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.256 -0.903 . . . . 0.0 110.288 -179.814 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 42.9 m-20 -79.33 -6.64 57.19 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.244 -0.91 . . . . 0.0 110.314 -179.799 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 53.1 t -90.28 -42.32 11.05 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.225 -0.922 . . . . 0.0 110.082 179.854 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 3.1 m -78.2 -43.18 29.2 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.266 -0.896 . . . . 0.0 110.174 -179.996 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 40.2 mt -54.61 -47.95 72.79 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.307 -0.871 . . . . 0.0 110.215 -179.893 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . 0.468 ' O ' ' HG3' ' A' ' 14' ' ' LYS . 0.2 OUTLIER -66.6 -33.35 75.46 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.276 -0.89 . . . . 0.0 110.361 179.978 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 7.4 m -68.26 -45.73 72.36 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.24 -0.913 . . . . 0.0 110.369 179.998 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 68.2 mt -68.13 -33.19 59.5 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.645 0 O-C-N 121.228 -0.92 . . . . 0.0 110.351 -179.866 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -67.04 -37.65 84.45 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.193 -0.942 . . . . 0.0 110.427 -179.878 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . 0.468 ' HG3' ' O ' ' A' ' 10' ' ' ASP . 8.3 mttm -63.02 -27.49 69.45 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.243 -0.91 . . . . 0.0 110.325 -179.834 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 133.23 -2.62 4.7 Favored Glycine 0 N--CA 1.491 2.31 0 N-CA-C 109.745 -1.342 . . . . 0.0 109.745 179.958 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 16' ' ' TYR . . . . . 0.426 ' HA ' ' HG2' ' A' ' 30' ' ' ARG . 96.8 m-85 -83.79 179.35 7.6 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.149 -1.207 . . . . 0.0 110.354 -179.859 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . 0.583 ' HB3' ' CD2' ' A' ' 18' ' ' PHE . 1.5 t-20 -103.46 -46.61 4.52 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.347 -0.846 . . . . 0.0 109.875 179.688 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . 0.592 ' CE1' ' HB3' ' A' ' 29' ' ' ARG . 32.6 p90 -154.18 140.09 18.21 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.34 -0.85 . . . . 0.0 110.013 179.643 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . 0.512 ' CA ' ' HA ' ' A' ' 28' ' ' CYS . . . -119.89 -152.03 8.92 Favored Glycine 0 N--CA 1.49 2.242 0 N-CA-C 109.575 -1.41 . . . . 0.0 109.575 -179.97 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -178.36 166.44 1.86 Allowed 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.27 -1.135 . . . . 0.0 110.184 -179.945 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . 0.462 ' HA ' ' O ' ' A' ' 25' ' ' SER . 12.3 t -84.98 142.76 29.39 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.228 -0.92 . . . . 0.0 110.297 -179.938 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.589 ' O ' HG12 ' A' ' 22' ' ' VAL . 19.3 t -130.15 88.05 1.07 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.499 0 O-C-N 121.218 -0.926 . . . . 0.0 110.011 179.838 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . 0.412 ' HB2' ' O ' ' A' ' 22' ' ' VAL . 42.5 mtt180 54.23 74.69 0.32 Allowed 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.327 -0.858 . . . . 0.0 110.114 -179.926 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 59.37 28.55 64.79 Favored Glycine 0 N--CA 1.49 2.292 0 N-CA-C 109.521 -1.432 . . . . 0.0 109.521 -179.967 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . 0.462 ' O ' ' HA ' ' A' ' 21' ' ' CYS . 2.1 m -136.96 176.38 8.77 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.27 -1.135 . . . . 0.0 110.172 -179.979 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 45.9 t -137.23 121.78 18.43 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.222 -0.924 . . . . 0.0 110.312 179.946 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.439 ' O ' ' HA3' ' A' ' 19' ' ' GLY . 1.7 mm-40 -120.03 161.21 21.34 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.278 -0.889 . . . . 0.0 110.14 179.849 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . 0.512 ' HA ' ' CA ' ' A' ' 19' ' ' GLY . 17.9 m -119.79 139.39 52.39 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.341 -0.85 . . . . 0.0 110.03 179.905 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.592 ' HB3' ' CE1' ' A' ' 18' ' ' PHE . 1.1 mtm180 -120.16 143.08 48.4 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.167 -0.958 . . . . 0.0 110.29 -179.989 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.426 ' HG2' ' HA ' ' A' ' 16' ' ' TYR . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.639 0 O-C-N 121.28 -0.888 . . . . 0.0 110.161 179.975 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 13.2 p . . . . . 0 N--CA 1.492 1.636 0 CA-C-O 121.255 0.55 . . . . 0.0 110.161 . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild core ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -116.1 156.42 26.43 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.143 -0.973 . . . . 0.0 110.278 -179.884 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 33.1 m-20 -61.93 -34.64 76.46 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.225 -0.922 . . . . 0.0 109.933 179.732 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . 0.413 ' O ' HD12 ' A' ' 9' ' ' LEU . 38.2 ttt180 -79.46 -38.18 35.18 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.289 -0.882 . . . . 0.0 109.855 179.737 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 24.9 t0 -79.52 -12.44 59.86 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.346 -0.846 . . . . 0.0 110.088 179.852 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 28.4 t -96.18 -35.32 11.34 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.313 -0.867 . . . . 0.0 110.172 179.982 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 11.5 p -78.02 -36.02 49.12 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.288 -0.882 . . . . 0.0 110.252 -179.89 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.413 HD12 ' O ' ' A' ' 5' ' ' ARG . 8.4 mt -53.49 -44.56 69.14 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.226 -0.921 . . . . 0.0 110.303 -179.999 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . 0.453 ' O ' ' HG3' ' A' ' 14' ' ' LYS . 19.8 t0 -72.24 -31.92 66.25 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.144 -0.972 . . . . 0.0 110.107 179.817 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.446 ' O ' ' HB2' ' A' ' 16' ' ' TYR . 55.7 m -66.76 -38.19 86.1 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.29 -0.881 . . . . 0.0 110.222 179.987 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 16.0 mt -71.54 -45.32 68.44 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.569 0 O-C-N 121.199 -0.938 . . . . 0.0 110.102 -179.99 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 1.4 ttt -63.79 -29.15 70.39 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.228 -0.92 . . . . 0.0 110.111 179.916 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . 0.453 ' HG3' ' O ' ' A' ' 10' ' ' ASP . 22.6 mttt -68.4 -20.25 64.66 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.359 -0.838 . . . . 0.0 110.153 179.842 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 119.82 -5.14 12.76 Favored Glycine 0 N--CA 1.491 2.323 0 N-CA-C 109.624 -1.39 . . . . 0.0 109.624 179.958 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 16' ' ' TYR . . . . . 0.446 ' HB2' ' O ' ' A' ' 11' ' ' CYS . 58.5 m-85 -86.73 -155.73 0.28 Allowed 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.238 -1.154 . . . . 0.0 110.083 179.96 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -129.2 -65.02 0.88 Allowed 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.117 -0.99 . . . . 0.0 110.259 -179.995 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . 0.558 ' CE1' ' HB3' ' A' ' 29' ' ' ARG . 39.7 p90 -129.11 139.83 51.81 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.272 -0.892 . . . . 0.0 110.301 -179.958 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . 0.481 ' HA3' ' O ' ' A' ' 27' ' ' GLN . . . -121.68 -162.88 11.77 Favored Glycine 0 N--CA 1.49 2.285 0 N-CA-C 109.571 -1.412 . . . . 0.0 109.571 179.997 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -162.31 151.76 15.84 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.35 -1.089 . . . . 0.0 110.198 -179.949 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . 0.465 ' HA ' ' O ' ' A' ' 25' ' ' SER . 0.8 OUTLIER -86.11 140.87 29.83 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.242 -0.911 . . . . 0.0 110.125 179.844 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.51 HG21 ' OE1' ' A' ' 27' ' ' GLN . 15.6 t -136.27 96.41 1.5 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.604 0 O-C-N 121.143 -0.973 . . . . 0.0 110.128 -179.998 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . 0.419 ' O ' ' C ' ' A' ' 24' ' ' GLY . 16.7 mtt180 52.16 85.43 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.192 -0.942 . . . . 0.0 110.144 -179.908 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . 0.419 ' C ' ' O ' ' A' ' 23' ' ' ARG . . . 44.88 33.34 3.51 Favored Glycine 0 N--CA 1.491 2.3 0 N-CA-C 109.362 -1.495 . . . . 0.0 109.362 -179.791 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . 0.5 ' CB ' ' O ' ' A' ' 22' ' ' VAL . 0.8 OUTLIER -138.03 165.14 27.33 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.237 -1.155 . . . . 0.0 110.15 -179.913 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 24.6 t -134.84 127.62 31.13 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.185 -0.947 . . . . 0.0 110.312 -179.979 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.51 ' OE1' HG21 ' A' ' 22' ' ' VAL . 27.5 mt-30 -118.85 159.6 23.46 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.339 -0.851 . . . . 0.0 109.978 179.82 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 61.9 m -120.67 136.0 54.96 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.196 -0.94 . . . . 0.0 110.26 -179.866 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.558 ' HB3' ' CE1' ' A' ' 18' ' ' PHE . 5.8 mmt180 -124.3 136.46 54.14 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.312 -0.867 . . . . 0.0 110.285 -179.968 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.427 ' HG3' ' HA ' ' A' ' 16' ' ' TYR . 0.9 OUTLIER . . . . . 0 N--CA 1.493 1.68 0 O-C-N 121.383 -0.823 . . . . 0.0 110.182 179.901 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 2' ' ' CYS . . . . . 0.428 ' O ' ' HB2' ' A' ' 3' ' ' ASN . 28.5 p . . . . . 0 N--CA 1.491 1.596 0 CA-C-O 121.234 0.54 . . . . 0.0 110.307 . . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 3' ' ' ASN . . . . . 0.428 ' HB2' ' O ' ' A' ' 2' ' ' CYS . 29.5 m-20 57.97 98.2 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.283 -0.885 . . . . 0.0 110.163 -179.919 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -69.47 -38.2 77.62 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.21 -0.931 . . . . 0.0 110.307 -179.928 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.85 -39.85 95.19 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.262 -0.899 . . . . 0.0 110.308 -179.98 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -79.68 -21.94 44.07 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.283 -0.886 . . . . 0.0 110.332 -179.9 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 8.6 t -78.41 -34.4 48.08 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.233 -0.917 . . . . 0.0 110.05 179.863 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 22.8 m -81.31 -34.72 31.71 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.241 -0.912 . . . . 0.0 110.118 179.909 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 8.6 mt -61.86 -51.95 66.1 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.217 -0.927 . . . . 0.0 110.205 179.855 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -62.64 -29.41 70.6 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.183 -0.948 . . . . 0.0 109.942 179.776 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 1.3 m -72.59 -47.86 44.53 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.289 -0.882 . . . . 0.0 110.143 179.816 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 40.9 mt -63.38 -22.45 30.84 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.599 0 O-C-N 121.306 -0.871 . . . . 0.0 109.88 179.828 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -77.86 -40.89 38.69 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.374 -0.829 . . . . 0.0 110.039 179.779 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -59.66 -48.35 82.02 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.277 -0.889 . . . . 0.0 110.089 179.936 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 144.65 36.71 0.07 OUTLIER Glycine 0 N--CA 1.492 2.388 0 N-CA-C 109.934 -1.266 . . . . 0.0 109.934 179.752 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 16' ' ' TYR . . . . . 0.541 ' CD1' ' HG3' ' A' ' 30' ' ' ARG . 64.8 m-85 -108.64 -164.38 0.95 Allowed 'General case' 0 N--CA 1.487 1.394 0 O-C-N 121.119 -1.224 . . . . 0.0 110.042 179.744 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . 0.557 ' HB3' ' CD1' ' A' ' 18' ' ' PHE . 51.9 t-20 -128.84 -54.41 1.22 Allowed 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.123 -0.985 . . . . 0.0 110.486 -179.941 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . 0.599 ' N ' ' CD1' ' A' ' 18' ' ' PHE . 5.8 p90 -131.73 150.4 52.16 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.129 -0.982 . . . . 0.0 110.177 179.95 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . 0.481 ' HA2' ' HA ' ' A' ' 28' ' ' CYS . . . -155.82 -176.64 28.2 Favored Glycine 0 N--CA 1.49 2.272 0 N-CA-C 109.812 -1.315 . . . . 0.0 109.812 -179.868 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -174.66 171.89 3.15 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.279 -1.13 . . . . 0.0 110.112 -179.974 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 21' ' ' CYS . . . . . 0.437 ' HA ' ' O ' ' A' ' 25' ' ' SER . 52.1 t -90.35 135.92 33.38 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.223 -0.923 . . . . 0.0 110.136 179.921 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.487 ' HB ' ' HB3' ' A' ' 25' ' ' SER . 5.2 t -113.98 85.45 0.82 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.625 0 O-C-N 121.146 -0.971 . . . . 0.0 110.196 -179.995 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 54.01 72.34 0.45 Allowed 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.264 -0.898 . . . . 0.0 110.223 179.917 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 65.0 34.76 90.74 Favored Glycine 0 N--CA 1.49 2.282 0 N-CA-C 109.624 -1.39 . . . . 0.0 109.624 179.853 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . 0.487 ' HB3' ' HB ' ' A' ' 22' ' ' VAL . 8.7 t -140.26 175.59 9.47 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.237 -1.155 . . . . 0.0 110.263 -179.993 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 52.8 t -135.27 97.72 3.78 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.265 -0.897 . . . . 0.0 110.136 179.909 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.46 ' HB2' ' CG2' ' A' ' 22' ' ' VAL . 28.1 mt-30 -113.42 151.23 31.63 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.269 -0.894 . . . . 0.0 110.251 -179.877 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . 0.481 ' HA ' ' HA2' ' A' ' 19' ' ' GLY . 91.2 m -144.77 168.96 18.97 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.297 -0.877 . . . . 0.0 110.16 179.857 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.59 ' HB2' ' CE2' ' A' ' 18' ' ' PHE . 1.8 mpt_? -136.21 167.63 20.92 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.308 -0.87 . . . . 0.0 110.283 -179.752 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 30' ' ' ARG . . . . . 0.541 ' HG3' ' CD1' ' A' ' 16' ' ' TYR . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.59 0 O-C-N 121.275 -0.89 . . . . 0.0 110.17 -179.987 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.645 0 CA-C-O 121.16 0.505 . . . . 0.0 110.242 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . 0.458 ' O ' ' SG ' ' A' ' 7' ' ' CYS . 11.4 t -79.58 -20.94 45.75 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.267 -0.895 . . . . 0.0 110.206 179.964 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . 0.464 ' O ' ' HB2' ' A' ' 7' ' ' CYS . 15.7 m120 48.0 84.22 0.03 OUTLIER 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.211 -0.931 . . . . 0.0 110.107 -179.96 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -52.02 -25.77 9.24 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.296 -0.877 . . . . 0.0 110.688 -179.824 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.466 ' O ' ' HB2' ' A' ' 9' ' ' LEU . 0.0 OUTLIER -79.39 -45.24 19.91 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.073 -1.017 . . . . 0.0 110.481 -179.694 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -79.6 -18.4 51.7 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.193 -0.942 . . . . 0.0 110.218 -179.887 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.468 ' O ' ' HB2' ' A' ' 11' ' ' CYS . 0.5 OUTLIER -83.53 -43.36 15.81 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.301 -0.874 . . . . 0.0 110.08 179.849 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . 0.435 ' O ' HG13 ' A' ' 12' ' ' ILE . 86.0 p -72.17 -39.64 68.53 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.266 -0.896 . . . . 0.0 110.335 -179.92 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.466 ' HB2' ' O ' ' A' ' 5' ' ' ARG . 0.2 OUTLIER -63.14 -51.4 66.65 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.248 -0.907 . . . . 0.0 110.343 -179.84 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -62.85 -35.95 81.64 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.261 -0.899 . . . . 0.0 110.457 -179.793 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.468 ' HB2' ' O ' ' A' ' 7' ' ' CYS . 0.5 OUTLIER -73.39 -43.83 59.74 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.109 -0.995 . . . . 0.0 110.425 -179.942 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . 0.435 HG13 ' O ' ' A' ' 8' ' ' SER . 47.6 mt -63.42 -23.18 32.65 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.614 0 O-C-N 121.185 -0.947 . . . . 0.0 109.885 179.906 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 1.9 ttt -80.22 -39.52 28.92 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.318 -0.864 . . . . 0.0 109.859 179.62 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 40.4 mtmt -54.03 -29.61 44.4 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.251 -0.905 . . . . 0.0 110.076 179.752 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 128.44 5.82 4.93 Favored Glycine 0 N--CA 1.491 2.321 0 N-CA-C 109.839 -1.304 . . . . 0.0 109.839 179.852 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 25.7 m-85 -80.37 -177.97 6.42 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.149 -1.206 . . . . 0.0 110.143 -179.975 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . 0.478 ' CB ' ' OG1' ' A' ' 31' ' ' THR . 3.5 t-20 -108.31 -51.39 2.9 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.189 -0.945 . . . . 0.0 110.174 -179.915 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . 0.564 ' CE1' ' CB ' ' A' ' 29' ' ' ARG . 8.9 p90 -151.42 159.07 44.4 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.283 -0.886 . . . . 0.0 110.372 -179.917 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . 0.518 ' CA ' ' HA ' ' A' ' 28' ' ' CYS . . . -153.42 -162.05 10.77 Favored Glycine 0 N--CA 1.49 2.279 0 N-CA-C 109.372 -1.491 . . . . 0.0 109.372 179.938 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.439 ' HB3' ' O ' ' A' ' 19' ' ' GLY . 1.6 pttt 176.79 160.94 0.39 Allowed 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.288 -1.125 . . . . 0.0 110.275 179.891 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 74.1 m -82.92 137.81 34.08 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.153 -0.967 . . . . 0.0 110.086 179.899 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.489 ' O ' ' N ' ' A' ' 25' ' ' SER . 41.7 t -131.85 131.11 61.96 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.568 0 O-C-N 121.271 -0.893 . . . . 0.0 110.208 179.951 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . 0.426 ' C ' ' O ' ' A' ' 22' ' ' VAL . 0.8 OUTLIER 42.88 40.97 2.36 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.287 -0.883 . . . . 0.0 110.288 179.955 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 72.47 27.17 70.11 Favored Glycine 0 N--CA 1.491 2.35 0 N-CA-C 109.728 -1.349 . . . . 0.0 109.728 179.964 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . 0.489 ' N ' ' O ' ' A' ' 22' ' ' VAL . 13.3 m -121.06 -173.37 2.59 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.217 -1.167 . . . . 0.0 110.112 179.927 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 16.9 t -134.68 101.16 4.84 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.284 -0.885 . . . . 0.0 110.312 -179.959 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 12.3 mm100 -118.61 154.37 32.76 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.253 -0.904 . . . . 0.0 110.154 179.954 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . 0.518 ' HA ' ' CA ' ' A' ' 19' ' ' GLY . 64.0 m -139.24 168.22 20.32 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.235 -0.916 . . . . 0.0 110.095 -179.944 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.564 ' CB ' ' CE1' ' A' ' 18' ' ' PHE . 0.2 OUTLIER -128.81 154.65 46.21 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.131 -0.981 . . . . 0.0 110.419 -179.8 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -119.91 136.01 54.67 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.374 -0.828 . . . . 0.0 110.091 179.915 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . 0.478 ' OG1' ' CB ' ' A' ' 17' ' ' ASN . 0.0 OUTLIER -111.3 165.59 11.81 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.186 -0.946 . . . . 0.0 110.131 179.96 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -149.68 -170.13 3.56 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.253 -0.904 . . . . 0.0 110.243 -179.927 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.404 0 N-CA-C 109.45 -1.46 . . . . 0.0 109.45 179.969 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.67 0 CA-C-O 121.196 0.522 . . . . 0.0 110.159 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 18.3 p -90.26 138.76 31.27 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.286 -0.884 . . . . 0.0 110.071 179.951 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 90.4 m-20 -114.6 146.26 41.02 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.185 -0.947 . . . . 0.0 110.319 -179.753 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 28.8 m-20 -64.96 -24.44 67.52 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.23 -0.919 . . . . 0.0 109.954 179.802 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.05 -54.07 12.46 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.352 -0.843 . . . . 0.0 110.274 -179.973 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 8.6 t0 -78.58 -4.66 49.93 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.356 -0.84 . . . . 0.0 109.783 179.822 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 5.1 t -95.15 -50.77 4.92 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.422 -0.799 . . . . 0.0 109.548 179.454 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 7.1 m -65.78 -39.8 91.34 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.365 -0.834 . . . . 0.0 109.906 179.633 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.409 HD23 ' HA ' ' A' ' 9' ' ' LEU . 6.5 mt -54.32 -39.24 66.85 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.193 -0.942 . . . . 0.0 110.015 179.828 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -72.25 -35.24 68.75 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.294 -0.878 . . . . 0.0 110.106 179.911 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.444 ' O ' ' HB2' ' A' ' 16' ' ' TYR . 92.0 m -66.57 -42.29 87.24 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.325 -0.859 . . . . 0.0 109.942 179.891 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 23.7 mt -67.43 -35.47 73.56 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.588 0 O-C-N 121.265 -0.897 . . . . 0.0 110.217 179.965 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 3.6 ttt -63.79 -46.33 85.69 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.232 -0.918 . . . . 0.0 110.186 179.996 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -59.19 -21.17 59.04 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.244 -0.91 . . . . 0.0 110.279 -179.941 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 115.63 7.86 15.1 Favored Glycine 0 N--CA 1.49 2.275 0 N-CA-C 109.606 -1.398 . . . . 0.0 109.606 179.849 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' TYR . . . . . 0.444 ' HB2' ' O ' ' A' ' 11' ' ' CYS . 24.7 m-85 -91.02 -159.33 0.62 Allowed 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.134 -1.215 . . . . 0.0 110.3 -179.986 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . 0.476 ' HB3' ' CD2' ' A' ' 18' ' ' PHE . 4.8 m-80 -116.88 -70.98 0.76 Allowed 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.209 -0.932 . . . . 0.0 110.372 -179.939 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . 0.527 ' CE1' ' HB2' ' A' ' 29' ' ' ARG . 14.8 p90 -128.42 -177.67 4.26 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.21 -0.931 . . . . 0.0 110.274 -179.862 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -151.53 -164.84 12.46 Favored Glycine 0 N--CA 1.49 2.258 0 N-CA-C 109.332 -1.507 . . . . 0.0 109.332 179.975 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.494 ' O ' ' HA ' ' A' ' 26' ' ' CYS . 0.3 OUTLIER -162.16 147.54 12.89 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.15 -1.206 . . . . 0.0 110.3 179.989 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . 0.515 ' C ' HG23 ' A' ' 22' ' ' VAL . 0.8 OUTLIER -82.3 139.08 34.37 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.353 -0.842 . . . . 0.0 110.385 -179.99 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.575 HG12 ' HG3' ' A' ' 23' ' ' ARG . 15.1 t -151.57 112.25 0.46 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.607 0 O-C-N 121.303 -0.873 . . . . 0.0 110.255 -179.987 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . 0.575 ' HG3' HG12 ' A' ' 22' ' ' VAL . 83.7 mtt180 61.02 73.38 0.48 Allowed 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.253 -0.904 . . . . 0.0 110.347 179.974 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . 0.419 ' C ' ' O ' ' A' ' 23' ' ' ARG . . . 42.65 28.12 0.6 Allowed Glycine 0 N--CA 1.492 2.386 0 N-CA-C 109.611 -1.396 . . . . 0.0 109.611 179.893 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . 0.407 ' N ' ' O ' ' A' ' 23' ' ' ARG . 0.5 OUTLIER -141.22 -163.74 1.61 Allowed 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.276 -1.132 . . . . 0.0 110.041 179.971 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . 0.494 ' HA ' ' O ' ' A' ' 20' ' ' LYS . 0.5 OUTLIER -167.07 142.86 4.24 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.234 -0.916 . . . . 0.0 110.171 179.917 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 6.3 mm-40 -119.84 176.18 5.53 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.387 -0.821 . . . . 0.0 110.302 -179.92 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 85.4 m -120.47 135.46 55.05 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.346 -0.846 . . . . 0.0 109.956 179.885 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.527 ' HB2' ' CE1' ' A' ' 18' ' ' PHE . 0.4 OUTLIER -120.53 150.35 40.99 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.26 -0.9 . . . . 0.0 110.395 -179.815 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 5.4 ttt180 -112.74 157.58 21.13 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.313 -0.867 . . . . 0.0 109.964 179.994 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -82.5 -148.88 0.08 Allowed 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.269 -0.894 . . . . 0.0 110.285 -179.957 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -141.29 118.44 11.31 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.256 -0.902 . . . . 0.0 110.073 -179.993 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.235 0 N-CA-C 109.484 -1.446 . . . . 0.0 109.484 179.963 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.618 0 CA-C-O 121.257 0.551 . . . . 0.0 110.204 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . 0.456 ' SG ' ' O ' ' A' ' 25' ' ' SER . 45.8 t -97.87 141.44 30.85 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.256 -0.902 . . . . 0.0 110.246 179.999 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 66.5 m-80 -116.62 140.79 49.0 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.337 -0.852 . . . . 0.0 110.113 -179.98 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . 0.407 ' O ' ' OG ' ' A' ' 8' ' ' SER . 2.8 m-20 -63.05 -13.4 35.39 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.249 -0.907 . . . . 0.0 110.096 179.994 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.859 ' O ' HD12 ' A' ' 9' ' ' LEU . 0.0 OUTLIER -80.89 -40.05 25.32 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.373 -0.83 . . . . 0.0 110.2 179.994 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . 0.415 ' O ' ' CB ' ' A' ' 10' ' ' ASP . 1.0 OUTLIER -79.62 -29.29 41.02 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.175 -0.953 . . . . 0.0 110.146 -179.958 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -76.38 -47.2 24.1 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.183 -0.948 . . . . 0.0 110.039 179.873 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . 0.407 ' OG ' ' O ' ' A' ' 4' ' ' ASP . 7.3 m -65.85 -39.81 91.12 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.192 -0.942 . . . . 0.0 109.994 179.884 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.859 HD12 ' O ' ' A' ' 5' ' ' ARG . 4.0 mt -73.77 -36.57 65.09 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.32 -0.862 . . . . 0.0 110.164 179.775 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . 0.415 ' CB ' ' O ' ' A' ' 6' ' ' ASP . 36.9 t0 -76.43 -42.32 44.43 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.239 -0.913 . . . . 0.0 110.126 179.909 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.447 ' O ' ' HB2' ' A' ' 16' ' ' TYR . 93.9 m -67.28 -40.81 86.19 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.244 -0.91 . . . . 0.0 110.174 179.992 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 44.7 mt -66.23 -40.0 85.77 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.616 0 O-C-N 121.307 -0.871 . . . . 0.0 110.267 179.932 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . 0.42 ' HB2' ' O ' ' A' ' 9' ' ' LEU . 2.3 ttp -68.29 -34.58 76.41 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.255 -0.903 . . . . 0.0 110.205 -179.994 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -64.05 -19.1 64.97 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.321 -0.862 . . . . 0.0 110.178 -179.991 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . 0.445 ' O ' ' NH1' ' A' ' 30' ' ' ARG . . . 109.91 16.42 10.7 Favored Glycine 0 N--CA 1.49 2.263 0 N-CA-C 109.662 -1.375 . . . . 0.0 109.662 -179.985 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' TYR . . . . . 0.459 ' HA ' ' NH1' ' A' ' 30' ' ' ARG . 31.5 m-85 -97.36 -160.92 0.83 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.311 -1.111 . . . . 0.0 110.178 -179.873 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . 0.421 ' OD1' ' CD2' ' A' ' 18' ' ' PHE . 2.9 t-20 -119.4 -64.47 1.27 Allowed 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.237 -0.915 . . . . 0.0 110.272 -179.881 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . 0.594 ' CE1' ' HB3' ' A' ' 29' ' ' ARG . 6.6 p90 -143.77 145.28 32.26 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.184 -0.947 . . . . 0.0 110.289 -179.897 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . 0.459 ' HA3' ' HA ' ' A' ' 28' ' ' CYS . . . -132.99 -150.1 6.31 Favored Glycine 0 N--CA 1.491 2.331 0 N-CA-C 109.736 -1.345 . . . . 0.0 109.736 -179.965 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -170.66 173.52 5.36 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.185 -1.186 . . . . 0.0 110.229 -179.949 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 9.7 m -104.42 125.64 50.81 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.255 -0.903 . . . . 0.0 110.13 179.852 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.47 ' HB ' ' HB2' ' A' ' 25' ' ' SER . 9.9 t -86.81 43.12 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.633 0 O-C-N 121.2 -0.938 . . . . 0.0 110.037 179.858 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 3.4 mtm180 54.13 33.8 18.66 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.324 -0.86 . . . . 0.0 110.362 179.731 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 158.13 -19.36 0.34 Allowed Glycine 0 N--CA 1.491 2.319 0 C-N-CA 119.767 -1.206 . . . . 0.0 110.086 179.802 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . 0.47 ' HB2' ' HB ' ' A' ' 22' ' ' VAL . 22.6 m -127.66 -176.55 3.79 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 120.993 -1.298 . . . . 0.0 110.681 -179.824 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . 0.45 ' SG ' ' SG ' ' A' ' 2' ' ' CYS . 0.1 OUTLIER -134.58 120.14 19.27 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.442 -0.787 . . . . 0.0 109.887 -179.863 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 1.8 mm-40 -118.68 167.2 11.88 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.202 -0.936 . . . . 0.0 110.494 -179.754 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . 0.459 ' HA ' ' HA3' ' A' ' 19' ' ' GLY . 17.7 m -136.52 152.05 50.1 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.206 -0.934 . . . . 0.0 109.97 179.849 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.594 ' HB3' ' CE1' ' A' ' 18' ' ' PHE . 0.0 OUTLIER -132.5 152.03 51.69 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.155 -0.966 . . . . 0.0 110.398 -179.868 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.459 ' NH1' ' HA ' ' A' ' 16' ' ' TYR . 0.0 OUTLIER -105.46 -166.18 1.19 Allowed 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.303 -0.873 . . . . 0.0 110.036 179.889 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 65.4 p -97.84 -172.71 2.44 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.192 -0.942 . . . . 0.0 110.108 179.95 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -97.34 121.48 39.28 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.111 -0.993 . . . . 0.0 110.227 -179.975 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.222 0 CA-C-O 118.017 -1.435 . . . . 0.0 109.551 -179.994 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.621 0 CA-C-O 121.245 0.545 . . . . 0.0 110.189 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . 0.439 ' HB2' ' SG ' ' A' ' 26' ' ' CYS . 23.3 p -73.96 155.3 38.78 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.276 -0.89 . . . . 0.0 110.342 -179.903 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . 0.455 ' O ' ' SG ' ' A' ' 7' ' ' CYS . 0.1 OUTLIER -112.6 110.22 20.25 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.159 -0.963 . . . . 0.0 110.226 179.955 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . 0.507 ' OD1' ' N ' ' A' ' 4' ' ' ASP . 0.8 OUTLIER -50.9 -35.46 33.11 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.291 -0.881 . . . . 0.0 110.32 -179.901 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.777 ' O ' HD12 ' A' ' 9' ' ' LEU . 0.1 OUTLIER -62.31 -49.04 77.19 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.201 -0.937 . . . . 0.0 110.195 -179.945 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . 0.466 ' O ' ' HB2' ' A' ' 10' ' ' ASP . 0.3 OUTLIER -79.2 -6.65 57.09 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.314 -0.866 . . . . 0.0 110.0 179.873 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.455 ' SG ' ' O ' ' A' ' 3' ' ' ASN . 87.4 m -89.81 -40.29 12.55 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.227 -0.921 . . . . 0.0 109.915 179.634 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 8.5 t -77.49 -39.24 47.07 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.297 -0.877 . . . . 0.0 110.082 179.693 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.777 HD12 ' O ' ' A' ' 5' ' ' ARG . 12.7 mt -72.54 -38.78 67.89 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.309 -0.869 . . . . 0.0 110.063 179.875 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . 0.474 ' O ' ' HG2' ' A' ' 14' ' ' LYS . 12.1 t70 -69.41 -43.21 73.87 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.293 -0.88 . . . . 0.0 109.999 179.821 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.401 ' O ' ' HB2' ' A' ' 16' ' ' TYR . 53.4 m -65.95 -40.36 91.27 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.289 -0.882 . . . . 0.0 109.733 179.82 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 27.1 mt -63.73 -32.1 55.63 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.509 0 O-C-N 121.286 -0.884 . . . . 0.0 109.494 179.411 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -65.27 -45.06 85.99 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.367 -0.833 . . . . 0.0 109.694 179.506 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . 0.474 ' HG2' ' O ' ' A' ' 10' ' ' ASP . 11.8 mmmm -57.61 -17.57 15.14 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.34 -0.85 . . . . 0.0 109.855 179.621 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 107.02 40.07 1.89 Allowed Glycine 0 N--CA 1.491 2.328 0 N-CA-C 109.222 -1.551 . . . . 0.0 109.222 -179.712 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' TYR . . . . . 0.401 ' HB2' ' O ' ' A' ' 11' ' ' CYS . 12.3 m-85 -121.88 -165.54 1.27 Allowed 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.346 -1.091 . . . . 0.0 110.418 -179.74 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . 0.589 ' HB3' ' CD2' ' A' ' 18' ' ' PHE . 9.5 m-80 -98.11 -53.54 3.34 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.33 -0.856 . . . . 0.0 110.154 179.904 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . 0.589 ' CD2' ' HB3' ' A' ' 17' ' ' ASN . 11.0 p90 -161.27 -171.11 2.89 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.194 -0.941 . . . . 0.0 110.268 179.848 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -140.64 -179.23 17.95 Favored Glycine 0 N--CA 1.491 2.34 0 N-CA-C 109.639 -1.384 . . . . 0.0 109.639 179.985 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.43 ' O ' ' HA ' ' A' ' 26' ' ' CYS . 0.2 OUTLIER -149.41 151.17 33.59 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.254 -1.145 . . . . 0.0 110.387 179.978 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . 0.434 ' SG ' ' SG ' ' A' ' 26' ' ' CYS . 0.8 OUTLIER -89.88 132.49 35.26 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.228 -0.92 . . . . 0.0 110.245 -179.971 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.522 ' O ' ' CB ' ' A' ' 25' ' ' SER . 99.1 t -136.31 100.93 2.43 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.594 0 O-C-N 121.271 -0.893 . . . . 0.0 110.317 -179.941 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 50.92 80.3 0.08 Allowed 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.266 -0.896 . . . . 0.0 110.431 179.843 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 47.78 23.71 2.55 Favored Glycine 0 N--CA 1.49 2.278 0 N-CA-C 109.696 -1.362 . . . . 0.0 109.696 179.866 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . 0.522 ' CB ' ' O ' ' A' ' 22' ' ' VAL . 1.2 t -127.16 173.67 9.53 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.217 -1.167 . . . . 0.0 110.137 179.968 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . 0.439 ' SG ' ' HB2' ' A' ' 2' ' ' CYS . 0.0 OUTLIER -158.47 123.57 4.32 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.227 -0.921 . . . . 0.0 110.318 179.919 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 25.1 mm-40 -120.28 -175.06 2.92 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.223 -0.923 . . . . 0.0 110.34 179.878 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 56.8 m -119.99 145.66 46.59 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.214 -0.929 . . . . 0.0 110.123 179.931 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.565 ' CB ' ' CE1' ' A' ' 18' ' ' PHE . 0.4 OUTLIER -126.99 165.04 20.17 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.167 -0.958 . . . . 0.0 110.141 -179.905 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -112.7 -157.16 0.61 Allowed 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.25 -0.906 . . . . 0.0 110.23 -179.979 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . 0.53 HG23 ' CG ' ' A' ' 17' ' ' ASN . 0.3 OUTLIER -114.64 -174.97 2.58 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.279 -0.888 . . . . 0.0 110.229 -179.992 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -100.85 -179.64 4.12 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.176 -0.953 . . . . 0.0 110.207 179.971 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.389 0 CA-C-O 117.968 -1.462 . . . . 0.0 109.573 -179.992 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.616 0 CA-C-O 121.254 0.55 . . . . 0.0 110.265 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . 0.439 ' SG ' ' O ' ' A' ' 25' ' ' SER . 6.5 t -88.33 120.36 29.62 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.238 -0.914 . . . . 0.0 110.171 179.986 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 2.8 m-80 -110.13 140.21 44.46 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.296 -0.878 . . . . 0.0 110.195 179.962 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -51.13 -43.44 61.17 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.203 -0.936 . . . . 0.0 110.182 -179.945 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 21.6 mtp180 -72.74 -42.81 63.69 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.253 -0.904 . . . . 0.0 110.203 179.998 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 1.3 t0 -79.92 3.93 18.36 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.36 -0.838 . . . . 0.0 110.154 179.964 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 8.6 t -107.21 -31.85 8.05 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.214 -0.929 . . . . 0.0 110.222 -179.966 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . 0.447 ' O ' HG13 ' A' ' 12' ' ' ILE . 36.7 t -93.12 -31.19 14.9 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.267 -0.895 . . . . 0.0 110.218 179.941 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.402 HD23 ' HA ' ' A' ' 9' ' ' LEU . 34.5 mt -57.2 -57.83 10.88 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.176 -0.953 . . . . 0.0 110.139 -179.992 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -62.7 -38.54 90.82 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.33 -0.856 . . . . 0.0 110.237 -179.997 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -66.21 -38.32 87.68 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.246 -0.909 . . . . 0.0 110.02 -179.984 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . 0.447 HG13 ' O ' ' A' ' 8' ' ' SER . 11.0 mt -63.94 -34.3 67.51 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.549 0 O-C-N 121.292 -0.88 . . . . 0.0 109.669 179.587 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 36.9 mtt -67.9 -38.86 83.49 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.411 -0.806 . . . . 0.0 110.068 179.68 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 33.8 mtmt -55.07 -33.28 62.62 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.303 -0.873 . . . . 0.0 110.378 -179.882 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 130.69 2.07 4.92 Favored Glycine 0 N--CA 1.491 2.31 0 N-CA-C 109.871 -1.291 . . . . 0.0 109.871 179.948 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 81.2 m-85 -79.41 -178.02 6.05 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.063 -1.257 . . . . 0.0 110.214 -179.96 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . 0.484 ' HB3' ' CD2' ' A' ' 18' ' ' PHE . 1.5 t-20 -103.73 -66.09 0.97 Allowed 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.287 -0.883 . . . . 0.0 110.272 -179.976 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . 0.53 ' CE1' ' HB2' ' A' ' 29' ' ' ARG . 7.2 p90 -138.58 159.07 43.0 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.164 -0.96 . . . . 0.0 110.387 -179.958 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . 0.523 ' CA ' ' HA ' ' A' ' 28' ' ' CYS . . . -156.64 172.35 34.33 Favored Glycine 0 N--CA 1.489 2.22 0 N-CA-C 109.816 -1.314 . . . . 0.0 109.816 179.992 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -143.2 166.8 23.71 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.333 -1.098 . . . . 0.0 110.14 179.923 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . 0.505 ' HA ' ' O ' ' A' ' 25' ' ' SER . 47.0 t -98.94 116.04 30.27 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.222 -0.924 . . . . 0.0 110.079 179.863 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.595 ' O ' HG12 ' A' ' 22' ' ' VAL . 41.1 t -80.22 82.86 1.25 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.676 0 O-C-N 121.155 -0.965 . . . . 0.0 110.085 -179.933 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 61.73 -77.03 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.298 -0.876 . . . . 0.0 109.895 -179.927 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . 0.519 ' N ' ' O ' ' A' ' 22' ' ' VAL . . . -127.24 39.32 1.97 Allowed Glycine 0 N--CA 1.489 2.183 0 N-CA-C 109.285 -1.526 . . . . 0.0 109.285 179.711 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . 0.505 ' O ' ' HA ' ' A' ' 21' ' ' CYS . 0.3 OUTLIER -147.01 172.97 12.9 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.326 -1.102 . . . . 0.0 110.039 -179.951 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 49.3 t -134.85 98.31 3.99 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.201 -0.937 . . . . 0.0 110.248 -179.884 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.408 ' C ' ' SG ' ' A' ' 28' ' ' CYS . 4.6 mm-40 -105.43 157.99 16.97 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.292 -0.88 . . . . 0.0 109.915 179.943 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . 0.523 ' HA ' ' CA ' ' A' ' 19' ' ' GLY . 34.3 m -142.65 170.72 15.17 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.079 -1.013 . . . . 0.0 110.541 -179.803 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.53 ' HB2' ' CE1' ' A' ' 18' ' ' PHE . 27.9 mmt180 -142.1 164.72 29.41 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.388 -0.82 . . . . 0.0 110.304 -179.75 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 54.3 mtp180 -112.46 -166.95 1.12 Allowed 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.282 -0.886 . . . . 0.0 110.139 179.973 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 2.0 p -95.5 -166.06 1.39 Allowed 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.268 -0.895 . . . . 0.0 110.246 -179.968 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 3.3 p -102.8 88.11 3.12 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.318 -0.864 . . . . 0.0 110.192 -179.89 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.338 0 CA-C-O 117.887 -1.507 . . . . 0.0 109.536 179.984 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.614 0 CA-C-O 121.199 0.523 . . . . 0.0 110.058 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . 0.471 ' HA ' ' HB2' ' A' ' 26' ' ' CYS . 12.1 t -96.67 89.8 5.08 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.29 -0.881 . . . . 0.0 110.288 -179.976 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . 0.41 ' O ' ' N ' ' A' ' 7' ' ' CYS . 1.4 m-20 -145.92 131.57 18.89 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.215 -0.928 . . . . 0.0 110.11 179.861 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . 0.425 ' O ' ' OG ' ' A' ' 8' ' ' SER . 65.6 m-20 -50.87 -37.25 42.31 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.219 -0.926 . . . . 0.0 110.259 179.997 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.461 ' O ' ' HB2' ' A' ' 9' ' ' LEU . 0.0 OUTLIER -73.44 -41.54 63.1 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.307 -0.871 . . . . 0.0 110.147 179.999 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 33.8 m-20 -80.0 -22.75 42.11 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.227 -0.921 . . . . 0.0 110.308 -179.944 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.41 ' N ' ' O ' ' A' ' 3' ' ' ASN . 41.4 m -76.36 -36.24 58.28 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.395 -0.816 . . . . 0.0 110.091 -179.914 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . 0.427 ' O ' HG13 ' A' ' 12' ' ' ILE . 0.7 OUTLIER -85.02 -33.69 22.48 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.242 -0.912 . . . . 0.0 110.517 -179.703 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.461 ' HB2' ' O ' ' A' ' 5' ' ' ARG . 0.7 OUTLIER -71.59 -52.95 15.43 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.173 -0.954 . . . . 0.0 110.322 -179.838 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . 0.401 ' O ' ' HG3' ' A' ' 14' ' ' LYS . 2.3 t0 -62.69 -24.71 67.79 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.193 -0.942 . . . . 0.0 110.147 179.899 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.402 ' SG ' ' O ' ' A' ' 7' ' ' CYS . 3.6 m -78.96 -45.65 19.94 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.185 -0.947 . . . . 0.0 110.287 -179.986 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . 0.427 HG13 ' O ' ' A' ' 8' ' ' SER . 64.2 mt -63.57 -30.25 49.36 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.626 0 O-C-N 121.123 -0.985 . . . . 0.0 110.222 179.991 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . 0.451 ' HG3' ' O ' ' A' ' 9' ' ' LEU . 11.9 mtp -84.24 -27.35 28.0 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.272 -0.893 . . . . 0.0 110.178 179.832 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . 0.401 ' HG3' ' O ' ' A' ' 10' ' ' ASP . 0.1 OUTLIER -78.93 -27.17 43.68 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.254 -0.904 . . . . 0.0 110.29 179.942 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 121.88 17.69 3.73 Favored Glycine 0 N--CA 1.492 2.415 0 N-CA-C 109.634 -1.387 . . . . 0.0 109.634 179.87 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' TYR . . . . . 0.473 ' HB3' ' SG ' ' A' ' 28' ' ' CYS . 45.0 m-85 -100.22 -170.45 1.87 Allowed 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.242 -1.152 . . . . 0.0 110.263 -179.99 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . 0.568 ' HB3' ' CD2' ' A' ' 18' ' ' PHE . 2.4 m120 -122.54 -56.92 1.77 Allowed 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.274 -0.891 . . . . 0.0 110.241 179.929 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . 0.58 ' CE1' ' HB3' ' A' ' 29' ' ' ARG . 11.6 p90 -147.33 153.88 40.23 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.188 -0.945 . . . . 0.0 110.186 -179.922 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . 0.539 ' CA ' ' HA ' ' A' ' 28' ' ' CYS . . . -136.74 -146.86 5.24 Favored Glycine 0 N--CA 1.492 2.367 0 N-CA-C 109.745 -1.342 . . . . 0.0 109.745 -179.924 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 175.04 141.99 0.05 Allowed 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.27 -1.135 . . . . 0.0 110.209 -179.957 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . 0.489 ' HA ' ' O ' ' A' ' 25' ' ' SER . 0.1 OUTLIER -97.04 125.61 41.61 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.203 -0.935 . . . . 0.0 110.456 -179.868 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.642 ' O ' HG12 ' A' ' 22' ' ' VAL . 60.7 t -94.39 45.47 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.564 0 O-C-N 121.348 -0.845 . . . . 0.0 109.964 179.812 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 61.32 84.85 0.13 Allowed 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.321 -0.862 . . . . 0.0 110.384 -179.96 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 103.63 -20.17 42.59 Favored Glycine 0 N--CA 1.491 2.34 0 N-CA-C 109.782 -1.327 . . . . 0.0 109.782 179.756 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . 0.489 ' O ' ' HA ' ' A' ' 21' ' ' CYS . 3.0 t -132.2 162.21 31.5 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.122 -1.222 . . . . 0.0 110.33 -179.875 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . 0.471 ' HB2' ' HA ' ' A' ' 2' ' ' CYS . 18.2 t -138.7 123.34 18.58 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.288 -0.883 . . . . 0.0 110.426 -179.926 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 76.9 mt-30 -108.74 175.2 5.55 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.344 -0.847 . . . . 0.0 110.085 179.872 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . 0.539 ' HA ' ' CA ' ' A' ' 19' ' ' GLY . 6.9 t -148.68 156.4 42.33 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.298 -0.876 . . . . 0.0 110.431 -179.856 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.58 ' HB3' ' CE1' ' A' ' 18' ' ' PHE . 6.2 mmm-85 -144.53 137.14 26.62 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.244 -0.91 . . . . 0.0 110.215 179.903 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.458 ' HG3' ' CD2' ' A' ' 16' ' ' TYR . 1.7 mpp_? -89.24 -160.84 0.71 Allowed 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.302 -0.874 . . . . 0.0 110.177 -179.958 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . 0.539 HG23 ' ND2' ' A' ' 17' ' ' ASN . 0.0 OUTLIER -106.95 171.6 7.28 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.23 -0.919 . . . . 0.0 110.201 179.932 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -163.42 -86.7 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.213 -0.93 . . . . 0.0 110.174 -179.976 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.313 0 N-CA-C 109.461 -1.455 . . . . 0.0 109.461 -179.951 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.608 0 CA-C-O 121.161 0.505 . . . . 0.0 110.165 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . 0.478 ' O ' ' HB2' ' A' ' 21' ' ' CYS . 17.7 p -92.15 37.52 0.99 Allowed 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.185 -0.947 . . . . 0.0 110.182 179.933 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . 0.417 ' OD1' ' O ' ' A' ' 3' ' ' ASN . 53.2 p-10 -51.98 154.89 2.0 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.178 -0.951 . . . . 0.0 110.132 179.994 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . 0.484 ' OD2' ' HG2' ' A' ' 20' ' ' LYS . 0.6 OUTLIER -65.23 -15.93 62.99 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.358 -0.839 . . . . 0.0 110.385 -179.798 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.405 ' HB3' ' ND2' ' A' ' 3' ' ' ASN . 0.0 OUTLIER -75.33 -54.45 7.06 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.271 -0.893 . . . . 0.0 110.522 -179.788 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 2.1 t0 -79.77 -25.85 40.85 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.255 -0.903 . . . . 0.0 110.674 -179.683 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.4 ' O ' ' SG ' ' A' ' 11' ' ' CYS . 30.9 t -76.76 -33.83 58.06 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.204 -0.935 . . . . 0.0 110.25 -179.868 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . 0.451 ' HB3' ' O ' ' A' ' 4' ' ' ASP . 22.7 p -79.58 -43.19 23.43 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.182 -0.949 . . . . 0.0 110.317 179.939 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -53.49 -42.04 66.87 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.258 -0.901 . . . . 0.0 110.203 -179.982 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 3.3 t70 -63.45 -27.19 69.11 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.298 -0.876 . . . . 0.0 110.097 179.733 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.4 ' SG ' ' O ' ' A' ' 7' ' ' CYS . 79.4 m -71.51 -41.4 69.3 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.271 -0.893 . . . . 0.0 110.107 -179.983 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 36.1 mt -63.65 -45.62 96.98 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.576 0 O-C-N 121.316 -0.865 . . . . 0.0 110.034 179.851 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 1.2 ttp -64.28 -31.42 72.62 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.243 -0.911 . . . . 0.0 109.98 179.767 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.47 -32.16 66.01 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.34 -0.85 . . . . 0.0 110.152 -179.945 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 137.3 -7.41 3.71 Favored Glycine 0 N--CA 1.491 2.323 0 N-CA-C 109.509 -1.436 . . . . 0.0 109.509 -179.904 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 26.2 m-85 -87.89 -170.12 2.86 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.321 -1.105 . . . . 0.0 110.15 -179.888 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 35.2 t-20 -120.61 -40.81 2.63 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.333 -0.854 . . . . 0.0 110.237 179.864 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . 0.605 ' CE2' ' CB ' ' A' ' 29' ' ' ARG . 38.4 p90 -146.58 146.96 30.64 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.342 -0.849 . . . . 0.0 110.193 179.829 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . 0.435 ' CA ' ' HA ' ' A' ' 28' ' ' CYS . . . -137.34 -173.01 12.73 Favored Glycine 0 N--CA 1.491 2.302 0 N-CA-C 109.524 -1.43 . . . . 0.0 109.524 -179.937 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.484 ' HG2' ' OD2' ' A' ' 4' ' ' ASP . 0.0 OUTLIER -161.96 159.25 26.32 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.191 -1.182 . . . . 0.0 110.258 179.963 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . 0.488 ' HA ' ' O ' ' A' ' 25' ' ' SER . 40.7 t -87.43 139.47 30.52 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.29 -0.881 . . . . 0.0 110.018 -179.977 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.49 ' HB ' ' HB2' ' A' ' 25' ' ' SER . 43.0 t -117.89 92.49 2.15 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.684 0 O-C-N 121.154 -0.966 . . . . 0.0 110.679 -179.8 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER 50.66 53.87 12.2 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.477 -0.764 . . . . 0.0 111.108 179.328 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 89.97 15.98 56.86 Favored Glycine 0 N--CA 1.491 2.345 0 C-N-CA 119.886 -1.15 . . . . 0.0 110.312 179.205 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . 0.49 ' HB2' ' HB ' ' A' ' 22' ' ' VAL . 1.1 m -122.04 178.99 4.67 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.006 -1.29 . . . . 0.0 110.134 179.719 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 46.0 t -145.75 95.03 2.58 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.258 -0.901 . . . . 0.0 110.32 -179.911 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -105.64 178.42 4.57 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.333 -0.855 . . . . 0.0 110.195 179.83 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . 0.435 ' HA ' ' CA ' ' A' ' 19' ' ' GLY . 82.0 m -134.69 150.33 50.6 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.259 -0.901 . . . . 0.0 110.284 -179.962 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.605 ' CB ' ' CE2' ' A' ' 18' ' ' PHE . 10.1 mtt180 -122.59 146.37 47.49 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.259 -0.901 . . . . 0.0 110.1 -179.972 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.444 ' O ' ' CZ ' ' A' ' 18' ' ' PHE . 0.0 OUTLIER -95.3 174.13 7.19 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.217 -0.927 . . . . 0.0 110.19 179.985 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 30.0 p -77.96 -164.17 0.49 Allowed 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.36 -0.837 . . . . 0.0 110.126 -179.963 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 69.0 p -145.49 48.6 1.26 Allowed 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.178 -0.951 . . . . 0.0 110.173 -179.94 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.193 0 CA-C-O 118.014 -1.437 . . . . 0.0 109.618 179.95 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.617 0 CA-C-O 121.322 0.582 . . . . 0.0 110.17 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . 0.446 ' HB3' ' HB3' ' A' ' 21' ' ' CYS . 48.9 t -82.57 120.86 26.06 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.222 -0.924 . . . . 0.0 110.257 179.968 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -82.41 139.34 34.08 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.197 -0.939 . . . . 0.0 110.24 179.941 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 46.7 m-20 -66.85 -30.92 71.22 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.195 -0.941 . . . . 0.0 110.118 179.912 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.525 ' O ' HD12 ' A' ' 9' ' ' LEU . 6.5 mtp180 -75.98 -41.84 50.12 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.277 -0.89 . . . . 0.0 110.098 179.868 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -79.64 -23.04 42.84 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.253 -0.904 . . . . 0.0 110.323 179.967 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 46.7 t -78.75 -38.06 39.71 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.21 -0.931 . . . . 0.0 110.145 179.877 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 38.1 t -75.06 -42.05 57.72 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.245 -0.909 . . . . 0.0 110.079 179.879 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.525 HD12 ' O ' ' A' ' 5' ' ' ARG . 61.5 mt -53.86 -47.02 71.42 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.306 -0.871 . . . . 0.0 110.292 -179.963 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . 0.487 ' O ' ' HG3' ' A' ' 14' ' ' LYS . 5.5 m-20 -62.66 -38.82 91.83 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.272 -0.893 . . . . 0.0 110.108 179.959 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.449 ' O ' ' HB2' ' A' ' 16' ' ' TYR . 87.5 m -66.69 -39.13 87.97 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.285 -0.885 . . . . 0.0 110.042 179.94 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . 0.414 HG21 HD13 ' A' ' 12' ' ' ILE . 17.1 mt -63.67 -33.23 60.43 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.633 0 O-C-N 121.356 -0.84 . . . . 0.0 110.187 -179.865 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . 0.446 ' HA ' ' CE ' ' A' ' 13' ' ' MET . 0.3 OUTLIER -71.28 -39.94 71.21 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.321 -0.862 . . . . 0.0 110.198 -179.977 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . 0.487 ' HG3' ' O ' ' A' ' 10' ' ' ASP . 1.1 mtmm -59.42 -14.58 12.72 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.126 -0.984 . . . . 0.0 110.218 -179.852 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 108.2 11.86 23.05 Favored Glycine 0 N--CA 1.49 2.262 0 N-CA-C 109.452 -1.459 . . . . 0.0 109.452 -179.931 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' TYR . . . . . 0.449 ' HB2' ' O ' ' A' ' 11' ' ' CYS . 5.8 m-85 -93.69 -165.08 1.26 Allowed 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.209 -1.171 . . . . 0.0 110.202 179.953 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -113.56 -62.12 1.64 Allowed 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.32 -0.863 . . . . 0.0 109.907 179.888 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . 0.527 ' CE2' HG23 ' A' ' 31' ' ' THR . 1.0 OUTLIER -133.09 159.97 38.54 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.36 -0.837 . . . . 0.0 110.017 179.777 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -137.46 173.61 22.19 Favored Glycine 0 N--CA 1.491 2.306 0 N-CA-C 109.638 -1.385 . . . . 0.0 109.638 -179.799 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 19.3 ttpt -153.35 144.92 23.31 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.278 -1.13 . . . . 0.0 110.0 -179.919 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . 0.496 ' C ' HG23 ' A' ' 22' ' ' VAL . 83.5 m -84.1 153.75 23.57 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.248 -0.907 . . . . 0.0 110.323 -179.93 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.538 ' O ' ' CG ' ' A' ' 23' ' ' ARG . 58.1 t -150.16 145.52 17.14 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.557 0 O-C-N 121.279 -0.888 . . . . 0.0 110.155 179.947 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . 0.538 ' CG ' ' O ' ' A' ' 22' ' ' VAL . 16.1 ptt180 38.22 33.46 0.06 Allowed 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.632 -0.667 . . . . 0.0 110.697 179.998 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . 0.408 ' N ' ' O ' ' A' ' 22' ' ' VAL . . . 79.91 37.55 22.13 Favored Glycine 0 N--CA 1.489 2.231 0 N-CA-C 109.523 -1.431 . . . . 0.0 109.523 -179.938 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . 0.485 ' N ' ' O ' ' A' ' 22' ' ' VAL . 7.7 t -138.05 -168.85 2.44 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.268 -1.136 . . . . 0.0 110.173 179.999 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . 0.442 ' HB2' ' SG ' ' A' ' 2' ' ' CYS . 49.4 t -141.15 120.16 12.8 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.26 -0.9 . . . . 0.0 110.265 -179.959 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 24.6 mt-30 -118.75 166.15 13.13 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.232 -0.918 . . . . 0.0 110.208 -179.988 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 18.1 m -128.81 148.59 50.89 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.255 -0.903 . . . . 0.0 110.091 -179.904 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.492 ' HB2' ' CE1' ' A' ' 18' ' ' PHE . 8.4 mmm-85 -129.02 168.02 16.65 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.182 -0.949 . . . . 0.0 110.299 179.969 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 15.2 mtm180 -116.29 -177.65 3.22 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.334 -0.854 . . . . 0.0 110.331 -179.987 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . 0.527 HG23 ' CE2' ' A' ' 18' ' ' PHE . 0.0 OUTLIER -114.92 160.98 18.89 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.334 -0.854 . . . . 0.0 110.202 179.973 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -142.03 -51.82 0.41 Allowed 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.275 -0.891 . . . . 0.0 110.161 -179.961 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.27 0 CA-C-O 117.968 -1.462 . . . . 0.0 109.531 -179.919 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.623 0 CA-C-O 121.221 0.534 . . . . 0.0 110.175 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 16.3 p -100.67 142.21 32.47 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.172 -0.955 . . . . 0.0 110.195 179.927 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 6.2 m120 -100.32 128.05 46.48 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.142 -0.974 . . . . 0.0 110.305 -179.889 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -66.41 -48.56 69.67 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.306 -0.871 . . . . 0.0 110.044 179.909 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.766 ' O ' HD12 ' A' ' 9' ' ' LEU . 1.5 ttt85 -62.53 -35.89 80.87 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.295 -0.878 . . . . 0.0 109.723 179.701 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 1.9 t0 -79.53 -20.97 45.83 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.357 -0.839 . . . . 0.0 109.563 179.47 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.423 ' O ' ' HB2' ' A' ' 11' ' ' CYS . 7.5 t -80.34 -45.71 17.33 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.432 -0.793 . . . . 0.0 109.874 179.639 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . 0.688 ' O ' HD12 ' A' ' 12' ' ' ILE . 0.4 OUTLIER -68.35 -44.28 75.58 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.428 -0.795 . . . . 0.0 110.207 -179.971 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.766 HD12 ' O ' ' A' ' 5' ' ' ARG . 0.2 OUTLIER -53.99 -43.43 69.99 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.272 -0.893 . . . . 0.0 110.023 179.939 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . 0.474 ' O ' ' HG3' ' A' ' 14' ' ' LYS . 11.5 t0 -74.02 -43.5 57.75 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.319 -0.863 . . . . 0.0 110.255 179.953 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.423 ' HB2' ' O ' ' A' ' 7' ' ' CYS . 0.0 OUTLIER -66.48 -39.95 89.04 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.166 -0.959 . . . . 0.0 110.433 -179.779 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . 0.688 HD12 ' O ' ' A' ' 8' ' ' SER . 14.3 mt -63.4 -47.05 93.65 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.672 0 O-C-N 121.141 -0.975 . . . . 0.0 110.034 179.962 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -64.41 -25.32 67.97 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.156 -0.965 . . . . 0.0 109.83 179.719 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . 0.474 ' HG3' ' O ' ' A' ' 10' ' ' ASP . 3.4 mttt -73.29 -36.75 66.36 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.293 -0.879 . . . . 0.0 110.151 179.78 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 147.47 -13.78 1.4 Allowed Glycine 0 N--CA 1.491 2.349 0 N-CA-C 109.666 -1.374 . . . . 0.0 109.666 179.941 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' TYR . . . . . 0.474 ' CE2' ' HD2' ' A' ' 30' ' ' ARG . 85.6 m-85 -74.05 -168.7 0.65 Allowed 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.117 -1.225 . . . . 0.0 110.299 179.997 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . 0.573 ' HB3' ' CD2' ' A' ' 18' ' ' PHE . 0.7 OUTLIER -132.12 -53.06 0.97 Allowed 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.193 -0.942 . . . . 0.0 110.339 -179.967 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . 0.605 ' CE1' ' HB2' ' A' ' 29' ' ' ARG . 9.4 p90 -141.62 152.82 44.33 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.138 -0.977 . . . . 0.0 110.428 179.928 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -148.72 -152.18 5.65 Favored Glycine 0 N--CA 1.489 2.222 0 N-CA-C 109.565 -1.414 . . . . 0.0 109.565 179.977 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.496 ' O ' ' HA ' ' A' ' 26' ' ' CYS . 0.0 OUTLIER -174.18 149.42 1.42 Allowed 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.267 -1.137 . . . . 0.0 110.096 -179.989 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -90.14 129.04 36.47 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.258 -0.901 . . . . 0.0 110.322 179.977 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.456 ' O ' ' HB2' ' A' ' 23' ' ' ARG . 54.0 t -111.08 94.1 2.91 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.58 0 O-C-N 121.264 -0.898 . . . . 0.0 110.33 -179.955 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . 0.456 ' HB2' ' O ' ' A' ' 22' ' ' VAL . 5.4 mtt-85 61.32 -88.67 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.328 -0.858 . . . . 0.0 110.506 179.863 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -119.94 24.21 7.97 Favored Glycine 0 N--CA 1.489 2.197 0 N-CA-C 109.784 -1.327 . . . . 0.0 109.784 -179.703 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . 0.453 ' O ' ' N ' ' A' ' 22' ' ' VAL . 0.3 OUTLIER -147.98 -174.54 4.59 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.165 -1.197 . . . . 0.0 110.076 179.856 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . 0.496 ' HA ' ' O ' ' A' ' 20' ' ' LYS . 9.2 t -149.67 150.7 32.54 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.257 -0.902 . . . . 0.0 110.48 179.942 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.43 ' O ' ' SG ' ' A' ' 28' ' ' CYS . 12.5 mt-30 -113.5 175.25 5.53 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.381 -0.824 . . . . 0.0 109.763 179.64 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . 0.43 ' SG ' ' O ' ' A' ' 27' ' ' GLN . 7.5 m -155.66 141.4 18.0 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.214 -0.929 . . . . 0.0 110.339 -179.883 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.605 ' HB2' ' CE1' ' A' ' 18' ' ' PHE . 1.0 OUTLIER -134.1 137.63 44.71 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.31 -0.869 . . . . 0.0 110.109 -179.974 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.474 ' HD2' ' CE2' ' A' ' 16' ' ' TYR . 0.4 OUTLIER -100.22 174.8 5.97 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.299 -0.876 . . . . 0.0 110.415 -179.811 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 22.1 p -97.5 138.47 34.88 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.343 -0.848 . . . . 0.0 110.158 179.972 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 3.2 m -112.26 27.06 9.98 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.212 -0.93 . . . . 0.0 110.24 -179.985 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.267 0 N-CA-C 109.5 -1.44 . . . . 0.0 109.5 179.92 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.577 0 CA-C-O 121.295 0.569 . . . . 0.0 110.194 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . 0.445 ' SG ' ' HB2' ' A' ' 26' ' ' CYS . 39.6 t -97.98 116.96 31.25 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.202 -0.937 . . . . 0.0 110.124 179.943 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 10.8 m120 -83.56 115.15 21.98 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.308 -0.87 . . . . 0.0 110.136 179.96 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -58.03 -21.74 46.57 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.267 -0.896 . . . . 0.0 110.147 179.96 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.451 ' O ' HD12 ' A' ' 9' ' ' LEU . 0.0 OUTLIER -78.51 -45.62 21.54 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.21 -0.931 . . . . 0.0 110.097 179.975 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 21.0 m-20 -79.03 -18.41 53.6 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.244 -0.91 . . . . 0.0 109.818 179.791 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.477 ' O ' ' HB2' ' A' ' 11' ' ' CYS . 8.1 t -78.37 -54.08 6.58 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.345 -0.847 . . . . 0.0 109.947 179.801 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . 0.44 ' O ' HG13 ' A' ' 12' ' ' ILE . 0.3 OUTLIER -64.58 -42.03 95.88 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.288 -0.882 . . . . 0.0 110.133 179.932 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.451 HD12 ' O ' ' A' ' 5' ' ' ARG . 0.3 OUTLIER -54.05 -51.85 62.73 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.146 -0.971 . . . . 0.0 110.231 -179.997 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 2.4 t0 -69.36 -38.77 78.24 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.278 -0.889 . . . . 0.0 110.417 -179.923 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.477 ' HB2' ' O ' ' A' ' 7' ' ' CYS . 0.1 OUTLIER -66.58 -39.79 88.62 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.159 -0.963 . . . . 0.0 110.132 -179.957 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . 0.44 HG13 ' O ' ' A' ' 8' ' ' SER . 15.5 mt -63.63 -38.72 83.0 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.563 0 O-C-N 121.278 -0.889 . . . . 0.0 109.833 179.87 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 2.6 mmm -69.87 -28.87 66.01 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.271 -0.893 . . . . 0.0 109.999 179.715 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -67.15 -32.06 72.91 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.255 -0.903 . . . . 0.0 110.205 179.836 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 138.25 -7.51 3.44 Favored Glycine 0 N--CA 1.491 2.313 0 N-CA-C 109.581 -1.408 . . . . 0.0 109.581 -179.823 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 97.2 m-85 -80.09 -163.73 0.59 Allowed 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.135 -1.215 . . . . 0.0 110.242 179.914 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . 0.589 ' HB3' ' CD2' ' A' ' 18' ' ' PHE . 0.7 OUTLIER -133.11 -63.31 0.77 Allowed 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.297 -0.877 . . . . 0.0 110.203 179.871 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . 0.596 ' CE1' ' HB2' ' A' ' 29' ' ' ARG . 5.4 p90 -133.89 145.75 49.92 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.12 -0.988 . . . . 0.0 110.38 179.78 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . 0.471 ' CA ' ' HA ' ' A' ' 28' ' ' CYS . . . -140.29 -150.51 5.47 Favored Glycine 0 N--CA 1.489 2.219 0 N-CA-C 109.529 -1.428 . . . . 0.0 109.529 -179.973 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 4.1 tttm -173.61 152.97 2.18 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.179 -1.189 . . . . 0.0 110.265 179.932 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . 0.433 ' SG ' ' SG ' ' A' ' 26' ' ' CYS . 22.1 m -91.31 144.27 25.78 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.346 -0.846 . . . . 0.0 110.315 179.969 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.419 ' O ' ' HB2' ' A' ' 23' ' ' ARG . 39.2 t -139.25 115.73 9.92 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.67 0 O-C-N 121.323 -0.86 . . . . 0.0 110.159 179.919 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . 0.419 ' HB2' ' O ' ' A' ' 22' ' ' VAL . 0.1 OUTLIER 56.31 -92.85 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.344 -0.848 . . . . 0.0 110.3 179.939 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -131.65 23.62 4.21 Favored Glycine 0 N--CA 1.49 2.238 0 N-CA-C 109.456 -1.457 . . . . 0.0 109.456 -179.955 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 4.0 t -142.34 172.47 12.65 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.226 -1.161 . . . . 0.0 109.931 179.872 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . 0.445 ' HB2' ' SG ' ' A' ' 2' ' ' CYS . 1.0 OUTLIER -138.46 145.37 40.8 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.084 -1.01 . . . . 0.0 110.837 -179.749 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.464 ' O ' ' HA3' ' A' ' 19' ' ' GLY . 14.1 mm-40 -119.97 170.18 9.5 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.34 -0.85 . . . . 0.0 109.791 179.572 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . 0.471 ' HA ' ' CA ' ' A' ' 19' ' ' GLY . 96.6 m -150.4 157.93 43.59 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.076 -1.015 . . . . 0.0 110.452 -179.949 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.596 ' HB2' ' CE1' ' A' ' 18' ' ' PHE . 9.7 mtp180 -128.96 159.59 35.38 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.207 -0.933 . . . . 0.0 110.395 179.967 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -107.48 154.78 20.86 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.205 -0.935 . . . . 0.0 110.143 179.866 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . 0.519 ' CG2' ' OD1' ' A' ' 17' ' ' ASN . 44.0 p -79.57 -170.63 2.43 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.203 -0.936 . . . . 0.0 110.106 -179.986 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 2.8 m -104.55 -163.02 0.93 Allowed 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.334 -0.854 . . . . 0.0 110.205 179.936 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.344 0 N-CA-C 109.456 -1.458 . . . . 0.0 109.456 -179.997 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.576 0 CA-C-O 121.245 0.545 . . . . 0.0 110.209 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . 0.439 ' O ' ' CB ' ' A' ' 3' ' ' ASN . 16.4 p -93.74 11.8 27.85 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.344 -0.847 . . . . 0.0 110.025 -179.965 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . 0.439 ' CB ' ' O ' ' A' ' 2' ' ' CYS . 1.0 OUTLIER 66.16 84.78 0.15 Allowed 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.272 -0.893 . . . . 0.0 109.872 -179.829 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -53.02 -40.42 63.86 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.314 -0.866 . . . . 0.0 110.372 -179.792 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.84 ' O ' HD12 ' A' ' 9' ' ' LEU . 8.0 ptm180 -62.35 -36.35 81.95 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.172 -0.955 . . . . 0.0 110.093 -179.916 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 22.7 t0 -81.16 -12.75 59.13 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.232 -0.917 . . . . 0.0 109.915 179.717 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.416 ' O ' ' SG ' ' A' ' 11' ' ' CYS . 0.8 OUTLIER -82.44 -39.76 22.14 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.324 -0.86 . . . . 0.0 110.095 179.923 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . 0.503 ' O ' HD12 ' A' ' 12' ' ' ILE . 2.2 t -84.52 -35.15 23.09 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.312 -0.867 . . . . 0.0 110.001 179.918 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.84 HD12 ' O ' ' A' ' 5' ' ' ARG . 5.6 mt -65.01 -46.91 79.41 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.353 -0.842 . . . . 0.0 109.992 179.808 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -64.16 -39.78 94.72 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.166 -0.959 . . . . 0.0 110.062 179.767 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.416 ' SG ' ' O ' ' A' ' 7' ' ' CYS . 82.5 m -67.37 -41.28 85.33 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.282 -0.886 . . . . 0.0 110.21 179.807 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . 0.503 HD12 ' O ' ' A' ' 8' ' ' SER . 53.6 mt -66.81 -44.0 89.4 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.603 0 O-C-N 121.297 -0.877 . . . . 0.0 110.258 179.981 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -69.1 -20.24 64.07 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.14 -0.975 . . . . 0.0 110.096 -179.962 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.61 -21.48 60.31 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.266 -0.896 . . . . 0.0 110.253 -179.961 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 124.32 -1.0 8.9 Favored Glycine 0 N--CA 1.491 2.328 0 N-CA-C 109.749 -1.341 . . . . 0.0 109.749 179.823 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' TYR . . . . . 0.445 ' N ' ' CD1' ' A' ' 16' ' ' TYR . 30.4 m-85 -89.09 -158.69 0.52 Allowed 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.138 -1.213 . . . . 0.0 110.236 -179.998 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . 0.577 ' HB3' ' CD2' ' A' ' 18' ' ' PHE . 5.3 t30 -120.1 -40.7 2.69 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.146 -0.971 . . . . 0.0 110.239 179.978 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . 0.577 ' CD2' ' HB3' ' A' ' 17' ' ' ASN . 12.3 p90 -157.1 158.01 35.6 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.127 -0.983 . . . . 0.0 110.404 179.874 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . 0.44 ' O ' ' HB3' ' A' ' 20' ' ' LYS . . . -138.88 -165.12 10.15 Favored Glycine 0 N--CA 1.492 2.37 0 N-CA-C 109.427 -1.469 . . . . 0.0 109.427 179.993 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.44 ' HB3' ' O ' ' A' ' 19' ' ' GLY . 0.0 OUTLIER -176.75 163.04 2.25 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.264 -1.139 . . . . 0.0 110.207 179.965 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . 0.591 ' O ' HG23 ' A' ' 22' ' ' VAL . 2.8 t -92.03 155.7 17.92 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.331 -0.856 . . . . 0.0 110.375 -179.93 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.591 HG23 ' O ' ' A' ' 21' ' ' CYS . 73.0 t -157.48 103.63 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.567 0 O-C-N 121.319 -0.863 . . . . 0.0 110.027 179.785 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . 0.442 ' HB2' ' O ' ' A' ' 22' ' ' VAL . 0.0 OUTLIER 57.87 66.15 1.18 Allowed 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.219 -0.926 . . . . 0.0 110.122 -179.854 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 50.48 44.59 45.93 Favored Glycine 0 N--CA 1.491 2.344 0 N-CA-C 109.499 -1.44 . . . . 0.0 109.499 -179.975 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . 0.405 ' O ' ' SG ' ' A' ' 21' ' ' CYS . 0.2 OUTLIER -142.26 164.91 28.86 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.203 -1.175 . . . . 0.0 110.209 179.988 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -134.93 111.21 9.65 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.242 -0.911 . . . . 0.0 110.09 179.938 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -117.77 168.06 10.81 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.368 -0.833 . . . . 0.0 110.273 -179.793 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 23.3 m -124.44 142.71 51.1 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.301 -0.875 . . . . 0.0 110.05 179.84 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.481 ' HB2' ' CE1' ' A' ' 18' ' ' PHE . 3.8 mmp_? -129.72 136.43 49.66 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.194 -0.942 . . . . 0.0 110.25 -179.933 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 10.4 mtp85 -98.69 -172.63 2.35 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.242 -0.911 . . . . 0.0 110.226 -179.941 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -116.17 -26.05 7.37 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.277 -0.889 . . . . 0.0 110.227 179.997 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -106.35 -178.19 3.58 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.254 -0.904 . . . . 0.0 110.3 179.999 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.239 0 N-CA-C 109.569 -1.412 . . . . 0.0 109.569 179.967 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.672 0 CA-C-O 121.16 0.505 . . . . 0.0 110.254 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . 0.415 ' C ' ' SG ' ' A' ' 21' ' ' CYS . 7.2 t -83.71 83.08 8.04 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.364 -0.835 . . . . 0.0 110.115 179.93 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . 0.489 ' O ' ' HB3' ' A' ' 7' ' ' CYS . 0.8 OUTLIER -126.44 129.61 49.05 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.387 -0.821 . . . . 0.0 110.036 -179.971 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 10.4 m-20 -54.64 -41.9 70.63 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.275 -0.89 . . . . 0.0 110.675 -179.749 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.726 ' O ' HD12 ' A' ' 9' ' ' LEU . 3.0 ttt180 -81.88 -35.34 29.35 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.13 -0.981 . . . . 0.0 110.264 -179.808 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . 0.449 ' O ' ' HB2' ' A' ' 10' ' ' ASP . 3.0 t70 -79.4 -25.66 42.08 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.357 -0.839 . . . . 0.0 110.167 -179.943 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.489 ' HB3' ' O ' ' A' ' 3' ' ' ASN . 17.0 t -87.25 -42.11 13.19 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.316 -0.865 . . . . 0.0 110.067 179.937 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . 0.475 ' O ' ' HB ' ' A' ' 12' ' ' ILE . 84.6 p -67.92 -46.49 71.4 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.366 -0.834 . . . . 0.0 110.285 -179.854 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.726 HD12 ' O ' ' A' ' 5' ' ' ARG . 3.0 mt -65.27 -38.3 89.87 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.181 -0.949 . . . . 0.0 110.414 -179.883 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . 0.449 ' HB2' ' O ' ' A' ' 6' ' ' ASP . 26.1 m-20 -74.11 -48.82 27.0 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.213 -0.929 . . . . 0.0 110.502 -179.844 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.496 ' SG ' ' CB ' ' A' ' 16' ' ' TYR . 53.0 t -68.71 -39.18 80.57 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.185 -0.947 . . . . 0.0 110.631 -179.764 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . 0.475 ' HB ' ' O ' ' A' ' 8' ' ' SER . 46.8 mt -63.48 -39.3 84.8 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.553 0 O-C-N 121.095 -1.003 . . . . 0.0 110.152 179.942 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . 0.438 ' HB2' ' O ' ' A' ' 9' ' ' LEU . 5.4 ttm -77.85 -19.07 55.51 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.243 -0.91 . . . . 0.0 109.981 179.759 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.11 -24.47 61.49 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.299 -0.876 . . . . 0.0 110.128 179.849 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 132.49 -2.93 5.03 Favored Glycine 0 N--CA 1.49 2.239 0 N-CA-C 109.559 -1.416 . . . . 0.0 109.559 -179.969 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' TYR . . . . . 0.587 ' CD1' ' HB3' ' A' ' 28' ' ' CYS . 82.2 m-85 -82.22 -172.24 3.87 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.287 -1.126 . . . . 0.0 110.183 -179.956 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . 0.52 ' C ' ' CD1' ' A' ' 18' ' ' PHE . 1.8 t-20 -127.18 -32.13 2.52 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.244 -0.91 . . . . 0.0 110.269 -179.935 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . 0.52 ' CD1' ' C ' ' A' ' 17' ' ' ASN . 2.9 m-85 -123.84 169.47 11.54 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.123 -0.986 . . . . 0.0 110.37 -179.912 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -156.67 129.12 2.34 Favored Glycine 0 N--CA 1.491 2.341 0 N-CA-C 109.439 -1.464 . . . . 0.0 109.439 179.853 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.446 ' O ' ' SG ' ' A' ' 26' ' ' CYS . 32.8 tttp -144.5 140.91 29.17 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.131 -1.217 . . . . 0.0 110.367 -179.843 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . 0.461 ' HA ' ' HA ' ' A' ' 26' ' ' CYS . 0.0 OUTLIER -97.58 131.62 44.0 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.185 -0.947 . . . . 0.0 110.206 -179.993 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.478 ' N ' ' O ' ' A' ' 25' ' ' SER . 54.2 t -151.23 127.83 2.01 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.615 0 O-C-N 121.149 -0.969 . . . . 0.0 110.471 179.998 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . 0.443 ' CB ' ' O ' ' A' ' 22' ' ' VAL . 14.9 ttp180 64.56 57.51 1.11 Allowed 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.32 -0.863 . . . . 0.0 110.314 179.829 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 50.24 22.19 4.81 Favored Glycine 0 N--CA 1.49 2.285 0 N-CA-C 109.5 -1.44 . . . . 0.0 109.5 -179.973 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . 0.478 ' O ' ' N ' ' A' ' 22' ' ' VAL . 41.3 m -142.2 177.94 7.89 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.348 -1.089 . . . . 0.0 109.915 -179.986 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . 0.461 ' HA ' ' HA ' ' A' ' 21' ' ' CYS . 0.7 OUTLIER -136.8 143.13 43.02 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.145 -0.972 . . . . 0.0 110.392 179.998 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 2.4 mt-30 -115.19 156.3 25.59 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.309 -0.869 . . . . 0.0 109.971 179.821 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . 0.587 ' HB3' ' CD1' ' A' ' 16' ' ' TYR . 32.1 m -125.37 171.27 10.57 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.258 -0.901 . . . . 0.0 110.314 -179.861 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -143.19 139.66 30.4 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.376 -0.828 . . . . 0.0 110.033 179.891 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -108.85 117.19 33.55 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.218 -0.926 . . . . 0.0 110.252 -179.998 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . 0.513 HG21 ' ND2' ' A' ' 17' ' ' ASN . 3.3 t -77.83 -164.61 0.53 Allowed 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.322 -0.861 . . . . 0.0 110.259 -179.976 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . 0.425 ' N ' ' OG1' ' A' ' 31' ' ' THR . 37.4 t -125.25 169.14 12.56 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.253 -0.905 . . . . 0.0 110.155 179.924 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.22 0 CA-C-O 117.988 -1.451 . . . . 0.0 109.543 -179.961 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.575 0 CA-C-O 121.239 0.542 . . . . 0.0 110.211 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . 0.464 ' O ' ' O ' ' A' ' 3' ' ' ASN . 16.7 p -106.07 -34.94 7.4 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.17 -0.956 . . . . 0.0 110.301 179.984 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . 0.503 ' O ' ' HB2' ' A' ' 7' ' ' CYS . 2.1 m-20 58.89 124.53 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.289 -0.882 . . . . 0.0 110.54 179.683 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . 0.495 ' HA ' ' HB3' ' A' ' 7' ' ' CYS . 23.7 m-20 -80.14 -24.82 40.19 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.159 -0.963 . . . . 0.0 110.227 179.811 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 5.3 ttt180 -63.81 -60.77 2.86 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.329 -0.857 . . . . 0.0 110.471 -179.831 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 5.6 t70 -79.65 6.31 10.99 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.232 -0.918 . . . . 0.0 110.155 -179.943 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.503 ' HB2' ' O ' ' A' ' 3' ' ' ASN . 4.9 t -99.58 -36.05 9.65 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.347 -0.846 . . . . 0.0 110.073 179.89 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -93.26 -29.3 15.75 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.314 -0.866 . . . . 0.0 110.22 179.923 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 2.7 mt -55.27 -55.65 29.04 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.31 -0.869 . . . . 0.0 110.332 -179.937 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 3.1 t0 -65.62 -35.97 82.37 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.156 -0.965 . . . . 0.0 110.369 -179.877 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -66.67 -49.47 66.07 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.255 -0.903 . . . . 0.0 110.2 179.997 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 61.2 mt -63.65 -24.1 35.0 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.637 0 O-C-N 121.328 -0.858 . . . . 0.0 109.894 179.855 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 2.7 mtt -79.66 -26.55 41.0 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.314 -0.866 . . . . 0.0 110.003 179.801 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.21 -25.79 60.9 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.274 -0.891 . . . . 0.0 110.102 179.907 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 134.51 -9.04 4.65 Favored Glycine 0 N--CA 1.491 2.331 0 N-CA-C 109.62 -1.392 . . . . 0.0 109.62 179.986 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 23.1 m-85 -68.02 -158.45 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.159 -1.201 . . . . 0.0 110.165 -179.98 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . 0.59 ' HB3' ' CD2' ' A' ' 18' ' ' PHE . 0.1 OUTLIER -135.71 -53.1 0.76 Allowed 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.343 -0.848 . . . . 0.0 110.118 179.953 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . 0.592 ' CE1' ' HB2' ' A' ' 29' ' ' ARG . 6.1 p90 -152.93 157.61 40.88 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.226 -0.921 . . . . 0.0 110.37 179.799 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . 0.432 ' HA3' ' HA ' ' A' ' 28' ' ' CYS . . . -154.05 -160.5 9.83 Favored Glycine 0 N--CA 1.49 2.24 0 N-CA-C 109.474 -1.45 . . . . 0.0 109.474 179.883 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -172.75 176.02 3.25 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.097 -1.237 . . . . 0.0 110.335 179.981 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . 0.448 ' SG ' ' O ' ' A' ' 25' ' ' SER . 8.4 t -83.99 132.9 34.71 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.29 -0.881 . . . . 0.0 110.317 179.943 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.443 ' O ' ' HB2' ' A' ' 25' ' ' SER . 71.0 t -118.27 92.13 2.04 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.675 0 O-C-N 121.293 -0.879 . . . . 0.0 110.254 -179.947 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . 0.458 ' O ' ' OG ' ' A' ' 25' ' ' SER . 4.7 tmm_? 50.81 84.15 0.04 OUTLIER 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.311 -0.868 . . . . 0.0 110.363 179.909 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 51.62 22.71 8.58 Favored Glycine 0 N--CA 1.49 2.24 0 N-CA-C 109.69 -1.364 . . . . 0.0 109.69 179.964 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . 0.458 ' OG ' ' O ' ' A' ' 23' ' ' ARG . 1.1 m -135.78 -161.66 1.18 Allowed 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.333 -1.098 . . . . 0.0 109.718 179.794 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -167.03 124.62 1.26 Allowed 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.231 -0.918 . . . . 0.0 110.677 179.937 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.446 ' O ' ' SG ' ' A' ' 28' ' ' CYS . 33.8 mm-40 -119.06 -179.86 3.95 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.427 -0.796 . . . . 0.0 109.694 179.639 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . 0.446 ' SG ' ' O ' ' A' ' 27' ' ' GLN . 84.3 m -149.49 157.9 43.7 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.114 -0.991 . . . . 0.0 109.914 179.921 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.592 ' HB2' ' CE1' ' A' ' 18' ' ' PHE . 6.2 mmm180 -134.31 156.52 48.32 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.105 -0.997 . . . . 0.0 110.483 -179.642 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -113.21 174.23 6.01 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.292 -0.88 . . . . 0.0 110.122 179.92 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -80.28 -87.12 0.08 Allowed 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.158 -0.964 . . . . 0.0 110.216 179.922 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 10.6 t -132.99 50.18 2.26 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.271 -0.893 . . . . 0.0 110.237 -179.975 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.267 0 N-CA-C 109.554 -1.418 . . . . 0.0 109.554 -179.96 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.639 0 CA-C-O 121.265 0.555 . . . . 0.0 110.415 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . 0.425 ' O ' ' CB ' ' A' ' 3' ' ' ASN . 20.6 p -77.86 176.0 9.49 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.268 -0.895 . . . . 0.0 110.269 179.956 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . 0.467 ' O ' ' N ' ' A' ' 7' ' ' CYS . 0.8 OUTLIER 173.66 137.76 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.195 -0.941 . . . . 0.0 110.251 -179.969 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . 0.4 ' O ' ' HB3' ' A' ' 8' ' ' SER . 0.7 OUTLIER -53.36 -34.96 59.67 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.122 -0.986 . . . . 0.0 110.203 -179.989 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.806 ' O ' HD12 ' A' ' 9' ' ' LEU . 0.1 OUTLIER -78.4 -39.69 38.22 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.279 -0.888 . . . . 0.0 110.415 -179.946 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 4.3 t0 -84.8 -19.02 33.18 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.301 -0.875 . . . . 0.0 110.287 -179.889 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.467 ' N ' ' O ' ' A' ' 3' ' ' ASN . 10.1 t -87.64 -27.9 22.2 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.235 -0.916 . . . . 0.0 110.113 179.977 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . 0.4 ' HB3' ' O ' ' A' ' 4' ' ' ASP . 6.0 t -92.41 -33.04 14.7 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.285 -0.884 . . . . 0.0 110.337 -179.882 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.806 HD12 ' O ' ' A' ' 5' ' ' ARG . 0.8 OUTLIER -57.02 -55.9 28.75 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.173 -0.954 . . . . 0.0 110.284 -179.792 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -67.09 -38.22 85.32 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.15 -0.969 . . . . 0.0 110.179 -179.949 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.418 ' SG ' ' O ' ' A' ' 7' ' ' CYS . 55.0 m -68.11 -44.74 75.47 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.285 -0.885 . . . . 0.0 110.185 -179.975 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 19.8 mt -63.56 -41.13 91.57 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.589 0 O-C-N 121.187 -0.945 . . . . 0.0 109.997 179.882 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -69.08 -34.77 75.65 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.27 -0.894 . . . . 0.0 110.024 179.83 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -65.85 -57.12 8.66 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.294 -0.879 . . . . 0.0 109.945 179.832 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 159.91 36.65 0.02 OUTLIER Glycine 0 N--CA 1.491 2.352 0 N-CA-C 109.663 -1.375 . . . . 0.0 109.663 -179.991 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' TYR . . . . . 0.462 ' CD2' ' HG2' ' A' ' 30' ' ' ARG . 36.8 m-85 -113.09 -173.43 2.25 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.154 -1.203 . . . . 0.0 110.19 -179.996 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . 0.537 ' CG ' ' CE2' ' A' ' 18' ' ' PHE . 7.8 p30 -121.81 -34.92 3.29 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.312 -0.867 . . . . 0.0 109.942 179.662 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . 0.594 ' CE1' ' HB2' ' A' ' 29' ' ' ARG . 3.3 p90 -164.77 154.25 13.3 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.327 -0.858 . . . . 0.0 110.051 179.804 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . 0.443 ' O ' ' HB3' ' A' ' 20' ' ' LYS . . . -155.04 -162.77 11.49 Favored Glycine 0 N--CA 1.491 2.301 0 N-CA-C 109.391 -1.484 . . . . 0.0 109.391 179.997 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.443 ' HB3' ' O ' ' A' ' 19' ' ' GLY . 0.0 OUTLIER 178.45 165.7 0.8 Allowed 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.214 -1.168 . . . . 0.0 110.19 179.974 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . 0.488 ' HA ' ' O ' ' A' ' 25' ' ' SER . 39.3 t -83.0 145.67 29.19 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.2 -0.937 . . . . 0.0 109.968 179.839 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.431 ' O ' ' C ' ' A' ' 23' ' ' ARG . 92.5 t -138.47 126.46 29.08 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.597 0 O-C-N 121.197 -0.939 . . . . 0.0 110.393 -179.915 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . 0.431 ' C ' ' O ' ' A' ' 22' ' ' VAL . 3.0 ttp180 42.15 39.74 1.48 Allowed 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.259 -0.9 . . . . 0.0 110.149 -179.989 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 79.91 31.55 39.18 Favored Glycine 0 N--CA 1.49 2.281 0 N-CA-C 109.318 -1.513 . . . . 0.0 109.318 -179.879 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . 0.488 ' O ' ' HA ' ' A' ' 21' ' ' CYS . 44.2 m -128.63 -164.19 1.36 Allowed 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.281 -1.129 . . . . 0.0 110.025 179.967 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 7.3 t -153.11 97.33 2.17 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.274 -0.891 . . . . 0.0 109.979 179.951 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.431 ' O ' ' SG ' ' A' ' 28' ' ' CYS . 14.5 mm-40 -106.67 164.26 12.23 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.294 -0.879 . . . . 0.0 110.522 -179.792 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . 0.431 ' SG ' ' O ' ' A' ' 27' ' ' GLN . 81.0 m -149.5 161.58 41.83 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.357 -0.84 . . . . 0.0 109.843 179.891 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.594 ' HB2' ' CE1' ' A' ' 18' ' ' PHE . 14.2 mmm180 -123.28 164.35 18.95 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.156 -0.965 . . . . 0.0 110.328 -179.888 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.472 ' C ' ' ND2' ' A' ' 17' ' ' ASN . 59.4 mtp180 -119.24 160.32 22.4 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.241 -0.912 . . . . 0.0 110.065 179.855 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . 0.423 ' CG2' ' HB3' ' A' ' 17' ' ' ASN . 49.3 p -76.83 -173.45 2.66 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.184 -0.947 . . . . 0.0 110.217 -179.923 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 16.2 m -93.7 85.81 4.96 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.286 -0.884 . . . . 0.0 110.172 -179.976 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.281 0 CA-C-O 117.972 -1.46 . . . . 0.0 109.532 179.932 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.592 0 CA-C-O 121.277 0.561 . . . . 0.0 110.179 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . 0.417 ' O ' ' C ' ' A' ' 3' ' ' ASN . 21.4 p -98.72 48.01 0.98 Allowed 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.167 -0.958 . . . . 0.0 110.296 179.959 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . 0.46 ' O ' ' HB2' ' A' ' 7' ' ' CYS . 3.3 m-20 -42.93 149.66 0.19 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.221 -0.924 . . . . 0.0 110.19 -179.927 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 19.7 m-20 -68.55 -33.19 73.67 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.233 -0.917 . . . . 0.0 110.246 179.983 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.599 ' O ' HD12 ' A' ' 9' ' ' LEU . 2.1 mtp180 -72.22 -41.57 66.74 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.245 -0.909 . . . . 0.0 110.177 179.97 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -79.92 3.16 20.77 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.239 -0.913 . . . . 0.0 110.196 179.879 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.46 ' HB2' ' O ' ' A' ' 3' ' ' ASN . 7.0 t -107.97 -30.46 8.45 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.182 -0.949 . . . . 0.0 110.227 -179.923 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -93.46 -43.33 8.79 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.216 -0.928 . . . . 0.0 110.186 -179.839 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.599 HD12 ' O ' ' A' ' 5' ' ' ARG . 47.3 mt -56.37 -49.61 73.92 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.214 -0.929 . . . . 0.0 110.298 -179.787 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 56.8 t0 -64.43 -45.94 85.35 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.261 -0.899 . . . . 0.0 110.289 -179.838 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.442 ' HA ' ' HG3' ' A' ' 14' ' ' LYS . 0.5 OUTLIER -66.21 -32.98 74.73 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.315 -0.866 . . . . 0.0 110.184 -179.896 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 24.2 mt -63.41 -39.36 85.02 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.547 0 O-C-N 121.19 -0.944 . . . . 0.0 109.373 179.616 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 4.6 ttm -71.18 -27.62 63.65 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.364 -0.835 . . . . 0.0 109.397 179.274 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . 0.442 ' HG3' ' HA ' ' A' ' 11' ' ' CYS . 2.7 mmpt? -63.47 -35.6 80.98 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.411 -0.806 . . . . 0.0 110.094 179.61 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 133.27 2.02 3.81 Favored Glycine 0 N--CA 1.491 2.34 0 N-CA-C 110.141 -1.184 . . . . 0.0 110.141 179.875 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' TYR . . . . . 0.51 ' HA ' ' CG ' ' A' ' 30' ' ' ARG . 17.8 m-85 -85.86 -167.58 1.91 Allowed 'General case' 0 N--CA 1.49 1.563 0 O-C-N 120.915 -1.344 . . . . 0.0 110.145 179.919 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . 0.58 ' HB3' ' CD2' ' A' ' 18' ' ' PHE . 0.7 OUTLIER -112.78 -62.52 1.57 Allowed 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.331 -0.856 . . . . 0.0 109.944 179.713 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . 0.58 ' CD2' ' HB3' ' A' ' 17' ' ' ASN . 7.5 p90 -143.71 151.66 40.32 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.274 -0.892 . . . . 0.0 110.142 179.597 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . 0.509 ' CA ' ' HA ' ' A' ' 28' ' ' CYS . . . -149.52 -164.6 11.79 Favored Glycine 0 N--CA 1.49 2.26 0 N-CA-C 109.501 -1.44 . . . . 0.0 109.501 -179.994 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.4 ' HB3' ' O ' ' A' ' 19' ' ' GLY . 0.0 OUTLIER -178.42 178.56 0.85 Allowed 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.226 -1.161 . . . . 0.0 110.111 179.972 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . 0.471 ' HA ' ' O ' ' A' ' 25' ' ' SER . 50.8 t -83.41 152.94 24.77 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.206 -0.934 . . . . 0.0 110.111 179.99 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.538 ' CG2' ' HB2' ' A' ' 27' ' ' GLN . 46.8 t -127.6 69.85 0.38 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.593 0 O-C-N 121.235 -0.916 . . . . 0.0 110.396 -179.994 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . 0.429 ' CB ' ' O ' ' A' ' 22' ' ' VAL . 0.4 OUTLIER 66.13 50.14 1.44 Allowed 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.275 -0.89 . . . . 0.0 110.368 179.849 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 94.53 16.95 40.83 Favored Glycine 0 N--CA 1.491 2.301 0 N-CA-C 109.674 -1.37 . . . . 0.0 109.674 179.857 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . 0.471 ' O ' ' HA ' ' A' ' 21' ' ' CYS . 0.6 OUTLIER -133.49 -166.32 1.76 Allowed 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.1 -1.235 . . . . 0.0 110.154 179.922 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 0.3 OUTLIER -148.36 105.49 3.62 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.154 -0.966 . . . . 0.0 110.27 -179.973 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.538 ' HB2' ' CG2' ' A' ' 22' ' ' VAL . 3.2 mm100 -105.89 179.34 4.3 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.17 -0.956 . . . . 0.0 110.277 179.927 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . 0.509 ' HA ' ' CA ' ' A' ' 19' ' ' GLY . 66.4 m -151.9 164.76 36.44 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.348 -0.845 . . . . 0.0 109.929 179.817 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.502 ' HB2' ' CE1' ' A' ' 18' ' ' PHE . 0.0 OUTLIER -142.97 133.04 24.32 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.055 -1.028 . . . . 0.0 110.47 179.975 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.51 ' CG ' ' HA ' ' A' ' 16' ' ' TYR . 9.4 mtm180 -111.49 166.72 10.89 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.357 -0.839 . . . . 0.0 110.253 179.988 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 33.6 p -94.75 147.95 22.8 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.248 -0.907 . . . . 0.0 110.16 179.929 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . 0.471 ' OG ' ' N ' ' A' ' 33' ' ' GLY . 1.1 p -129.4 -153.45 0.57 Allowed 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.181 -0.949 . . . . 0.0 110.243 179.98 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . 0.471 ' N ' ' OG ' ' A' ' 32' ' ' SER . . . . . . . . 0 N--CA 1.491 2.304 0 CA-C-O 117.976 -1.458 . . . . 0.0 109.535 -179.975 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.629 0 CA-C-O 121.469 0.652 . . . . 0.0 110.319 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . 0.435 ' O ' ' SG ' ' A' ' 2' ' ' CYS . 32.0 p -90.12 126.5 35.81 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.359 -0.838 . . . . 0.0 110.246 -179.947 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . 0.44 ' O ' ' SG ' ' A' ' 7' ' ' CYS . 0.1 OUTLIER -88.11 146.01 25.65 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.242 -0.911 . . . . 0.0 110.161 -179.982 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 2.4 p30 -69.07 -41.52 77.44 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.279 -0.888 . . . . 0.0 110.369 -179.988 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.81 -33.8 66.44 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.079 -1.013 . . . . 0.0 110.184 179.978 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 14.7 t0 -78.54 -11.03 59.94 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.259 -0.901 . . . . 0.0 109.743 179.894 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.44 ' SG ' ' O ' ' A' ' 3' ' ' ASN . 19.3 m -93.5 -42.34 9.29 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.347 -0.846 . . . . 0.0 109.606 179.418 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . 0.616 ' O ' HD12 ' A' ' 12' ' ' ILE . 6.7 p -67.21 -37.52 83.77 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.346 -0.846 . . . . 0.0 109.912 179.669 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.479 ' O ' ' HB2' ' A' ' 13' ' ' MET . 18.5 mt -66.38 -25.71 66.91 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.296 -0.877 . . . . 0.0 110.235 179.854 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -75.27 -47.01 29.99 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.296 -0.878 . . . . 0.0 110.392 -179.775 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.464 ' O ' ' HB2' ' A' ' 16' ' ' TYR . 30.7 m -67.06 -44.22 80.7 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.286 -0.884 . . . . 0.0 110.472 -179.668 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . 0.616 HD12 ' O ' ' A' ' 8' ' ' SER . 31.8 mt -63.36 -38.61 82.61 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.654 0 O-C-N 121.188 -0.945 . . . . 0.0 110.457 -179.721 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . 0.479 ' HB2' ' O ' ' A' ' 9' ' ' LEU . 1.9 tpp -65.31 -46.64 79.55 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.223 -0.923 . . . . 0.0 110.246 179.956 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 6.4 mtpt -63.01 -31.43 72.56 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.209 -0.932 . . . . 0.0 110.328 -179.889 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 139.67 -7.48 3.03 Favored Glycine 0 N--CA 1.49 2.254 0 N-CA-C 109.804 -1.318 . . . . 0.0 109.804 179.963 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' TYR . . . . . 0.464 ' HB2' ' O ' ' A' ' 11' ' ' CYS . 99.1 m-85 -76.73 -171.42 1.89 Allowed 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.209 -1.171 . . . . 0.0 110.092 179.999 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . 0.448 ' HB3' ' CD2' ' A' ' 18' ' ' PHE . 0.1 OUTLIER -118.24 -42.56 2.78 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.082 -1.012 . . . . 0.0 110.521 -179.749 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . 0.448 ' CD2' ' HB3' ' A' ' 17' ' ' ASN . 2.9 p90 -159.81 158.53 31.23 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.091 -1.006 . . . . 0.0 110.549 -179.885 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . 0.479 ' HA3' ' O ' ' A' ' 27' ' ' GLN . . . -144.47 -148.66 4.9 Favored Glycine 0 N--CA 1.491 2.339 0 N-CA-C 109.42 -1.472 . . . . 0.0 109.42 179.948 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.486 ' O ' ' HA ' ' A' ' 26' ' ' CYS . 0.3 OUTLIER -176.12 168.93 2.87 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.231 -1.158 . . . . 0.0 110.253 179.97 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . 0.446 ' SG ' ' SG ' ' A' ' 26' ' ' CYS . 1.2 m -87.62 142.19 28.04 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.351 -0.843 . . . . 0.0 110.166 -179.92 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 22.1 t -131.98 76.57 0.48 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.7 0 O-C-N 121.35 -0.843 . . . . 0.0 110.145 179.897 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 2.3 mtm-85 60.26 77.22 0.33 Allowed 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.335 -0.853 . . . . 0.0 110.243 179.98 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 62.8 11.81 38.62 Favored Glycine 0 N--CA 1.49 2.278 0 N-CA-C 109.578 -1.409 . . . . 0.0 109.578 179.979 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . 0.42 ' O ' ' HA ' ' A' ' 21' ' ' CYS . 0.1 OUTLIER -130.33 176.34 8.21 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.221 -1.164 . . . . 0.0 109.926 179.877 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . 0.486 ' HA ' ' O ' ' A' ' 20' ' ' LYS . 0.5 OUTLIER -154.08 132.26 11.84 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.172 -0.955 . . . . 0.0 110.204 -179.972 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.479 ' O ' ' HA3' ' A' ' 19' ' ' GLY . 2.5 mm100 -120.13 174.81 6.26 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.289 -0.882 . . . . 0.0 110.409 -179.885 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . 0.445 ' HB3' ' HB3' ' A' ' 11' ' ' CYS . 56.5 m -126.96 144.31 51.04 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.367 -0.833 . . . . 0.0 110.163 179.919 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 17.1 mmt180 -122.6 148.49 45.17 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.251 -0.905 . . . . 0.0 110.258 -179.925 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -98.09 178.58 5.05 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.323 -0.861 . . . . 0.0 110.222 179.996 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -115.63 -19.84 10.39 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.281 -0.887 . . . . 0.0 110.219 179.963 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 7.1 t -105.22 144.4 32.06 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.267 -0.896 . . . . 0.0 110.201 179.953 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.273 0 CA-C-O 117.925 -1.486 . . . . 0.0 109.535 179.967 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.563 0 CA-C-O 121.231 0.539 . . . . 0.0 110.209 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 17.9 p -86.08 153.75 21.88 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.273 -0.892 . . . . 0.0 110.254 -179.895 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 35.0 m120 -117.55 133.58 55.8 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.231 -0.918 . . . . 0.0 110.122 179.978 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . 0.459 ' N ' ' OD1' ' A' ' 4' ' ' ASP . 0.9 OUTLIER -61.85 -30.41 70.83 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.262 -0.899 . . . . 0.0 110.224 179.95 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.08 -29.55 64.23 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.255 -0.903 . . . . 0.0 110.089 179.904 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -79.47 -14.36 58.96 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.297 -0.877 . . . . 0.0 110.126 179.869 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -96.97 -25.15 15.49 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.291 -0.881 . . . . 0.0 109.888 179.863 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . 0.42 ' OG ' ' O ' ' A' ' 4' ' ' ASP . 0.1 OUTLIER -82.82 -43.78 16.26 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.339 -0.85 . . . . 0.0 110.083 179.846 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -62.37 -49.61 74.86 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.267 -0.896 . . . . 0.0 110.087 179.818 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -62.47 -27.08 68.88 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.26 -0.9 . . . . 0.0 109.638 179.681 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.54 ' O ' ' N ' ' A' ' 16' ' ' TYR . 0.1 OUTLIER -66.77 -46.12 76.34 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.395 -0.816 . . . . 0.0 109.641 179.428 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 89.4 mt -75.49 -33.34 27.02 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.502 0 O-C-N 121.339 -0.85 . . . . 0.0 110.2 179.971 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 1.7 ttt -69.0 -52.92 23.78 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.121 -0.987 . . . . 0.0 110.226 -179.989 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 4.1 mttt -60.8 -30.51 70.11 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.321 -0.862 . . . . 0.0 110.344 -179.977 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 122.68 14.55 4.26 Favored Glycine 0 N--CA 1.491 2.365 0 N-CA-C 109.756 -1.337 . . . . 0.0 109.756 179.944 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' TYR . . . . . 0.54 ' N ' ' O ' ' A' ' 11' ' ' CYS . 48.2 m-85 -92.53 -179.98 5.34 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.246 -1.15 . . . . 0.0 110.08 179.879 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . 0.75 ' CB ' HG23 ' A' ' 31' ' ' THR . 6.7 m120 -101.56 -52.1 3.3 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.094 -1.004 . . . . 0.0 110.486 -179.792 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . 0.541 ' CE2' ' HB2' ' A' ' 29' ' ' ARG . 33.2 p90 -146.91 163.19 36.92 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.103 -0.998 . . . . 0.0 110.567 -179.872 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -138.38 -170.45 11.86 Favored Glycine 0 N--CA 1.491 2.316 0 N-CA-C 109.375 -1.49 . . . . 0.0 109.375 179.944 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -170.52 164.61 8.49 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.216 -1.167 . . . . 0.0 110.2 179.916 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . 0.49 ' HA ' ' O ' ' A' ' 25' ' ' SER . 0.8 OUTLIER -90.99 137.72 32.15 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.219 -0.926 . . . . 0.0 110.113 179.943 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.53 ' HB ' ' CB ' ' A' ' 25' ' ' SER . 57.3 t -110.07 76.26 0.42 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.641 0 O-C-N 121.234 -0.916 . . . . 0.0 110.173 -179.98 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 13.6 mtm180 54.37 54.16 9.82 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.229 -0.92 . . . . 0.0 110.208 179.894 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 93.9 15.41 49.09 Favored Glycine 0 N--CA 1.49 2.3 0 N-CA-C 109.753 -1.339 . . . . 0.0 109.753 179.957 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . 0.53 ' CB ' ' HB ' ' A' ' 22' ' ' VAL . 0.5 OUTLIER -127.36 -176.15 3.65 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.226 -1.161 . . . . 0.0 110.213 -179.946 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 8.1 t -143.56 114.17 7.57 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.207 -0.933 . . . . 0.0 110.175 -179.988 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 21.4 mm100 -117.45 157.6 25.94 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.269 -0.894 . . . . 0.0 110.132 179.961 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -124.32 133.23 53.52 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.325 -0.86 . . . . 0.0 110.084 -179.982 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.541 ' HB2' ' CE2' ' A' ' 18' ' ' PHE . 3.4 mtm180 -123.37 163.6 20.48 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.162 -0.961 . . . . 0.0 110.383 -179.941 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.511 ' HA ' ' HB2' ' A' ' 17' ' ' ASN . 0.0 OUTLIER -115.34 -178.49 3.39 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.327 -0.858 . . . . 0.0 110.118 179.955 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . 0.75 HG23 ' CB ' ' A' ' 17' ' ' ASN . 43.4 p -115.72 132.85 56.51 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.227 -0.921 . . . . 0.0 110.224 -179.872 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . 0.404 ' OG ' ' N ' ' A' ' 33' ' ' GLY . 1.4 t -133.66 -84.25 0.45 Allowed 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.216 -0.927 . . . . 0.0 110.189 179.891 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . 0.404 ' N ' ' OG ' ' A' ' 32' ' ' SER . . . . . . . . 0 N--CA 1.491 2.311 0 CA-C-O 118.0 -1.445 . . . . 0.0 109.589 179.967 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.647 0 CA-C-O 121.199 0.524 . . . . 0.0 110.185 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . 0.443 ' O ' ' CB ' ' A' ' 3' ' ' ASN . 18.3 p -79.65 1.91 24.52 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.252 -0.905 . . . . 0.0 110.244 179.976 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . 0.455 ' O ' ' CB ' ' A' ' 7' ' ' CYS . 17.3 t-20 64.9 93.42 0.06 Allowed 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.24 -0.913 . . . . 0.0 110.158 -179.801 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 93.0 m-20 -57.35 -35.78 70.37 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.26 -0.9 . . . . 0.0 110.359 -179.908 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.454 ' O ' ' HB2' ' A' ' 9' ' ' LEU . 1.3 ttm-85 -62.6 -57.26 11.72 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.081 -1.012 . . . . 0.0 110.161 -179.935 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -79.89 6.63 10.63 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.279 -0.888 . . . . 0.0 110.211 179.916 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.455 ' CB ' ' O ' ' A' ' 3' ' ' ASN . 39.5 t -107.22 -34.0 7.25 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.268 -0.895 . . . . 0.0 110.232 -179.946 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . 0.454 ' O ' HG13 ' A' ' 12' ' ' ILE . 19.4 m -93.96 -42.2 9.18 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.293 -0.879 . . . . 0.0 110.434 -179.777 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.454 ' HB2' ' O ' ' A' ' 5' ' ' ARG . 0.2 OUTLIER -53.32 -49.24 67.48 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.187 -0.946 . . . . 0.0 110.362 -179.71 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -62.87 -46.73 86.49 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.152 -0.967 . . . . 0.0 110.158 179.914 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -66.64 -38.96 87.96 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.197 -0.939 . . . . 0.0 110.179 -179.885 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . 0.454 HG13 ' O ' ' A' ' 8' ' ' SER . 14.2 mt -64.65 -33.58 64.13 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.611 0 O-C-N 121.232 -0.918 . . . . 0.0 110.149 179.907 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 7.3 ttm -73.85 -30.17 62.52 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.265 -0.897 . . . . 0.0 110.098 179.906 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 3.9 mtpp -59.64 -30.44 68.72 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.298 -0.876 . . . . 0.0 110.307 -179.978 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 138.98 -6.32 3.13 Favored Glycine 0 N--CA 1.49 2.298 0 N-CA-C 109.829 -1.308 . . . . 0.0 109.829 179.978 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 94.9 m-85 -77.15 177.37 7.89 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.174 -1.192 . . . . 0.0 110.202 179.988 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . 0.46 ' HB3' ' CD2' ' A' ' 18' ' ' PHE . 34.2 t-20 -102.81 -59.52 1.69 Allowed 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.207 -0.933 . . . . 0.0 110.367 179.994 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . 0.507 ' CE1' ' CB ' ' A' ' 29' ' ' ARG . 17.1 p90 -140.82 161.81 36.93 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.232 -0.918 . . . . 0.0 110.309 179.974 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . 0.506 ' HA2' ' HA ' ' A' ' 28' ' ' CYS . . . -148.04 -160.6 9.06 Favored Glycine 0 N--CA 1.49 2.285 0 N-CA-C 109.5 -1.44 . . . . 0.0 109.5 -179.927 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -177.63 170.64 1.98 Allowed 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.226 -1.161 . . . . 0.0 110.178 179.935 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . 0.475 ' C ' HG23 ' A' ' 22' ' ' VAL . 4.0 t -93.49 155.11 17.52 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.284 -0.885 . . . . 0.0 110.217 -179.936 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.475 HG23 ' C ' ' A' ' 21' ' ' CYS . 98.0 t -149.79 94.49 0.18 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.64 0 O-C-N 121.29 -0.881 . . . . 0.0 110.115 179.933 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER 50.62 65.79 1.35 Allowed 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.26 -0.9 . . . . 0.0 110.239 179.999 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 61.33 37.71 94.51 Favored Glycine 0 N--CA 1.491 2.32 0 N-CA-C 109.603 -1.399 . . . . 0.0 109.603 179.986 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . 0.441 ' HB3' ' HB ' ' A' ' 22' ' ' VAL . 2.4 t -134.94 170.8 15.33 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.322 -1.104 . . . . 0.0 110.189 179.97 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 1.3 m -134.61 102.57 5.34 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.282 -0.886 . . . . 0.0 110.07 179.888 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 10.4 mm100 -105.24 164.82 11.55 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.399 -0.813 . . . . 0.0 110.318 -179.718 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . 0.506 ' HA ' ' HA2' ' A' ' 19' ' ' GLY . 59.4 m -145.79 158.03 43.88 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.301 -0.875 . . . . 0.0 110.294 -179.88 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.507 ' CB ' ' CE1' ' A' ' 18' ' ' PHE . 0.0 OUTLIER -138.37 149.13 45.26 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.306 -0.871 . . . . 0.0 110.159 179.927 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -109.21 -149.33 0.44 Allowed 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.315 -0.865 . . . . 0.0 110.266 179.977 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 18.1 p -108.15 -174.22 2.47 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.296 -0.877 . . . . 0.0 110.232 -179.967 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 18.9 p -121.19 57.9 0.99 Allowed 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.227 -0.921 . . . . 0.0 110.174 -179.982 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.177 0 CA-C-O 117.99 -1.45 . . . . 0.0 109.594 179.966 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.607 0 CA-C-O 121.18 0.514 . . . . 0.0 110.267 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . 0.449 ' O ' ' O ' ' A' ' 3' ' ' ASN . 19.4 p -80.9 -29.06 35.66 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.431 -0.793 . . . . 0.0 110.2 179.971 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . 0.449 ' O ' ' O ' ' A' ' 2' ' ' CYS . 2.1 t-20 59.92 124.02 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.256 -0.903 . . . . 0.0 110.208 -179.99 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . 0.452 ' OD1' ' HB2' ' A' ' 21' ' ' CYS . 0.3 OUTLIER -66.26 -28.63 68.86 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.276 -0.89 . . . . 0.0 110.239 -179.914 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 62.1 ttt180 -68.16 -44.96 74.83 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.26 -0.9 . . . . 0.0 110.149 -179.903 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 74.6 m-20 -79.4 -17.16 54.94 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.223 -0.923 . . . . 0.0 110.079 179.974 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.415 ' SG ' ' O ' ' A' ' 20' ' ' LYS . 14.7 t -82.73 -33.31 27.56 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.376 -0.827 . . . . 0.0 110.083 179.846 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . 0.748 ' O ' HD12 ' A' ' 12' ' ' ILE . 34.8 p -80.94 -50.11 10.14 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.359 -0.838 . . . . 0.0 110.286 -179.909 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -56.01 -22.53 27.59 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.165 -0.96 . . . . 0.0 110.064 179.928 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -73.96 -47.02 40.39 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.309 -0.87 . . . . 0.0 110.125 179.934 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.457 ' O ' ' HB2' ' A' ' 16' ' ' TYR . 21.0 m -67.22 -44.73 78.8 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.184 -0.948 . . . . 0.0 109.989 179.918 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . 0.748 HD12 ' O ' ' A' ' 8' ' ' SER . 2.5 mt -63.74 -30.48 50.03 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.601 0 O-C-N 121.239 -0.913 . . . . 0.0 110.069 179.844 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -74.98 -28.25 60.48 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.223 -0.923 . . . . 0.0 110.126 179.82 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 3.2 mtpp -82.73 -18.07 42.09 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.327 -0.858 . . . . 0.0 110.339 179.973 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 117.65 8.87 10.6 Favored Glycine 0 N--CA 1.491 2.362 0 N-CA-C 109.635 -1.386 . . . . 0.0 109.635 179.836 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' TYR . . . . . 0.457 ' HB2' ' O ' ' A' ' 11' ' ' CYS . 40.4 m-85 -83.77 -172.5 4.19 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.18 -1.188 . . . . 0.0 110.139 179.965 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . 0.586 ' HB3' ' CE1' ' A' ' 18' ' ' PHE . 0.4 OUTLIER -133.05 0.49 3.45 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.219 -0.925 . . . . 0.0 110.475 -179.819 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . 0.586 ' CE1' ' HB3' ' A' ' 17' ' ' ASN . 5.9 m-85 -141.37 162.49 35.36 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.137 -0.977 . . . . 0.0 110.414 -179.948 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . 0.443 ' HA3' ' HA ' ' A' ' 8' ' ' SER . . . -156.85 121.4 1.07 Allowed Glycine 0 N--CA 1.49 2.239 0 N-CA-C 109.355 -1.498 . . . . 0.0 109.355 179.904 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.415 ' O ' ' SG ' ' A' ' 7' ' ' CYS . 23.1 ttpt -134.64 149.74 50.59 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.155 -1.203 . . . . 0.0 110.424 -179.787 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . 0.452 ' HB2' ' OD1' ' A' ' 4' ' ' ASP . 0.1 OUTLIER -105.57 126.54 52.25 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.357 -0.84 . . . . 0.0 110.042 179.829 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.42 HG23 ' C ' ' A' ' 21' ' ' CYS . 59.0 t -145.59 139.14 21.48 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.637 0 O-C-N 121.291 -0.881 . . . . 0.0 110.26 -179.897 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 42.2 mtm180 47.67 53.73 10.83 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.27 -0.893 . . . . 0.0 110.261 179.87 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 51.7 29.49 25.71 Favored Glycine 0 N--CA 1.49 2.259 0 N-CA-C 109.652 -1.379 . . . . 0.0 109.652 179.912 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 8.4 t -131.09 -170.61 2.4 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.227 -1.161 . . . . 0.0 110.235 -179.952 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 53.3 t -143.31 140.73 30.72 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.292 -0.88 . . . . 0.0 110.096 -179.976 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 30.3 mt-30 -120.28 141.78 49.68 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.127 -0.983 . . . . 0.0 110.619 -179.813 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 43.4 m -124.22 150.57 45.11 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.355 -0.841 . . . . 0.0 109.886 179.602 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.476 ' HB3' ' CD1' ' A' ' 18' ' ' PHE . 0.0 OUTLIER -136.38 161.12 36.68 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.131 -0.981 . . . . 0.0 110.227 -179.91 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.425 ' HG2' ' HA ' ' A' ' 16' ' ' TYR . 0.2 OUTLIER -119.49 173.08 7.2 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.187 -0.945 . . . . 0.0 110.002 179.927 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 2.1 p -78.46 140.82 38.6 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.207 -0.933 . . . . 0.0 110.22 179.929 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 12.0 m -154.71 -38.83 0.09 Allowed 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.323 -0.861 . . . . 0.0 110.169 -179.96 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.341 0 CA-C-O 118.015 -1.436 . . . . 0.0 109.563 -179.991 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.581 0 CA-C-O 121.283 0.564 . . . . 0.0 110.208 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . 0.453 ' O ' ' SG ' ' A' ' 2' ' ' CYS . 10.6 t -99.95 73.66 1.76 Allowed 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.22 -0.925 . . . . 0.0 110.088 179.973 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -79.11 134.08 36.74 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.235 -0.916 . . . . 0.0 110.228 179.988 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . 0.508 ' OD1' ' N ' ' A' ' 4' ' ' ASP . 8.6 p-10 -57.01 -41.3 78.24 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.235 -0.916 . . . . 0.0 110.208 179.9 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 7.0 tpt180 -62.25 -42.46 99.35 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.24 -0.912 . . . . 0.0 109.925 179.942 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -79.34 -17.04 55.34 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.365 -0.834 . . . . 0.0 109.741 179.608 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.454 ' O ' ' SG ' ' A' ' 11' ' ' CYS . 0.9 OUTLIER -78.0 -33.02 51.48 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.43 -0.794 . . . . 0.0 109.874 179.618 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . 0.452 ' O ' HG13 ' A' ' 12' ' ' ILE . 0.3 OUTLIER -82.04 -43.99 17.21 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.393 -0.817 . . . . 0.0 110.152 179.734 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.4 mt -55.32 -46.94 76.31 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.262 -0.899 . . . . 0.0 110.193 179.943 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 19.9 t0 -63.77 -37.37 87.1 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.274 -0.891 . . . . 0.0 110.168 179.977 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.454 ' SG ' ' O ' ' A' ' 7' ' ' CYS . 82.4 m -66.32 -41.07 90.19 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.26 -0.9 . . . . 0.0 109.849 179.86 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . 0.452 HG13 ' O ' ' A' ' 8' ' ' SER . 81.4 mt -63.83 -35.65 73.92 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.587 0 O-C-N 121.322 -0.861 . . . . 0.0 109.901 179.822 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -70.72 -28.66 64.89 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.275 -0.891 . . . . 0.0 109.83 179.769 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.29 -23.93 46.94 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.313 -0.867 . . . . 0.0 110.132 179.889 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 124.52 -3.15 8.8 Favored Glycine 0 N--CA 1.491 2.348 0 N-CA-C 109.592 -1.403 . . . . 0.0 109.592 179.957 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' TYR . . . . . 0.417 ' CD2' ' CB ' ' A' ' 28' ' ' CYS . 48.1 m-85 -86.96 -175.71 5.46 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.126 -1.22 . . . . 0.0 110.334 -179.955 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 28.1 m-80 -109.18 -55.01 2.47 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.265 -0.897 . . . . 0.0 110.223 -179.979 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . 0.605 ' CE2' ' HB2' ' A' ' 29' ' ' ARG . 8.2 p90 -129.62 170.15 14.14 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.154 -0.967 . . . . 0.0 110.408 179.958 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -140.15 -178.38 16.86 Favored Glycine 0 N--CA 1.49 2.297 0 N-CA-C 109.405 -1.478 . . . . 0.0 109.405 179.952 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -164.62 160.9 20.58 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.227 -1.161 . . . . 0.0 110.323 179.96 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . 0.466 ' HA ' ' O ' ' A' ' 25' ' ' SER . 1.8 t -92.94 141.14 28.74 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.235 -0.916 . . . . 0.0 110.351 -179.851 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.442 ' O ' ' HB2' ' A' ' 25' ' ' SER . 72.8 t -147.42 123.85 2.91 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.614 0 O-C-N 121.301 -0.874 . . . . 0.0 110.058 179.894 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . 0.436 ' HB2' ' O ' ' A' ' 22' ' ' VAL . 3.7 mmm-85 55.43 35.79 25.77 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.275 -0.89 . . . . 0.0 110.13 -179.904 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 73.17 29.19 64.88 Favored Glycine 0 N--CA 1.489 2.218 0 N-CA-C 109.5 -1.44 . . . . 0.0 109.5 -179.925 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . 0.466 ' O ' ' HA ' ' A' ' 21' ' ' CYS . 69.7 m -129.3 -171.59 2.53 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.283 -1.128 . . . . 0.0 110.307 179.999 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 47.3 t -141.53 121.41 13.59 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.346 -0.846 . . . . 0.0 110.181 179.956 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 4.8 mm-40 -120.21 174.74 6.31 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.171 -0.956 . . . . 0.0 110.458 -179.915 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . 0.417 ' CB ' ' CD2' ' A' ' 16' ' ' TYR . 73.1 m -125.05 149.58 47.65 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.323 -0.861 . . . . 0.0 110.085 179.886 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.605 ' HB2' ' CE2' ' A' ' 18' ' ' PHE . 0.7 OUTLIER -136.42 146.03 45.94 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.216 -0.928 . . . . 0.0 110.258 -179.916 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -96.29 166.6 11.65 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.259 -0.901 . . . . 0.0 110.241 -179.98 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 36.7 p -80.13 168.99 18.44 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.206 -0.934 . . . . 0.0 110.218 179.978 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 75.6 p -132.54 132.54 42.71 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.271 -0.893 . . . . 0.0 110.288 179.962 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.358 0 CA-C-O 117.939 -1.479 . . . . 0.0 109.613 -179.95 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.593 0 CA-C-O 121.272 0.558 . . . . 0.0 110.199 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . 0.434 ' O ' ' SG ' ' A' ' 2' ' ' CYS . 15.8 p -93.52 133.41 36.86 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.263 -0.898 . . . . 0.0 110.236 -179.984 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . 0.467 ' O ' ' HB2' ' A' ' 7' ' ' CYS . 20.4 t-20 -100.54 125.14 46.86 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.3 -0.875 . . . . 0.0 110.253 -179.945 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . 0.472 ' HA ' ' HB3' ' A' ' 7' ' ' CYS . 3.6 m-20 -66.58 -34.37 77.74 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.197 -0.939 . . . . 0.0 110.38 179.976 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.454 ' O ' ' HB2' ' A' ' 9' ' ' LEU . 1.8 mmm-85 -62.15 -54.47 40.69 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.159 -0.963 . . . . 0.0 110.125 179.951 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -79.5 2.22 22.85 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.239 -0.913 . . . . 0.0 110.045 179.758 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.472 ' HB3' ' HA ' ' A' ' 4' ' ' ASP . 14.8 t -95.3 -40.44 9.54 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.254 -0.904 . . . . 0.0 109.997 179.97 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 26.8 t -86.42 -35.39 19.75 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.376 -0.828 . . . . 0.0 110.045 179.875 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.454 ' HB2' ' O ' ' A' ' 5' ' ' ARG . 0.6 OUTLIER -55.22 -47.53 75.18 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.208 -0.932 . . . . 0.0 110.008 179.944 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -65.13 -35.02 79.79 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.321 -0.862 . . . . 0.0 110.122 179.912 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 1.5 t -70.45 -39.37 74.36 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.214 -0.929 . . . . 0.0 110.131 179.968 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 39.8 mt -63.55 -35.44 72.64 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.579 0 O-C-N 121.2 -0.938 . . . . 0.0 109.809 179.703 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -77.77 -27.57 50.31 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.382 -0.824 . . . . 0.0 109.754 179.39 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.51 -27.82 65.51 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.354 -0.841 . . . . 0.0 109.958 179.743 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 121.89 10.82 6.15 Favored Glycine 0 N--CA 1.489 2.192 0 N-CA-C 109.669 -1.373 . . . . 0.0 109.669 179.983 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 60.6 m-85 -93.44 -161.73 0.87 Allowed 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.301 -1.117 . . . . 0.0 110.327 -179.958 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . 0.693 ' OD1' HG23 ' A' ' 31' ' ' THR . 1.8 t-20 -119.76 -51.44 2.26 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.264 -0.898 . . . . 0.0 110.36 -179.882 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . 0.588 ' CE1' ' HB2' ' A' ' 29' ' ' ARG . 6.5 p90 -161.84 156.66 22.93 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.277 -0.889 . . . . 0.0 110.154 -179.817 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . 0.514 ' HA2' ' HA ' ' A' ' 28' ' ' CYS . . . -127.88 -149.69 7.15 Favored Glycine 0 N--CA 1.491 2.363 0 N-CA-C 109.684 -1.366 . . . . 0.0 109.684 179.946 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.507 ' O ' ' HA ' ' A' ' 26' ' ' CYS . 9.7 tttp -175.26 152.98 1.48 Allowed 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.233 -1.157 . . . . 0.0 110.177 179.962 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 0.3 OUTLIER -90.84 129.58 36.88 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.274 -0.891 . . . . 0.0 110.312 179.957 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.446 ' O ' ' N ' ' A' ' 24' ' ' GLY . 84.5 t -109.72 98.35 6.92 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.613 0 O-C-N 121.242 -0.911 . . . . 0.0 110.07 -179.974 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 59.37 -84.81 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.174 -0.954 . . . . 0.0 110.13 -179.844 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . 0.446 ' N ' ' O ' ' A' ' 22' ' ' VAL . . . -126.05 15.71 6.9 Favored Glycine 0 N--CA 1.49 2.297 0 N-CA-C 109.527 -1.429 . . . . 0.0 109.527 179.887 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -130.87 -163.71 1.35 Allowed 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.264 -1.139 . . . . 0.0 110.076 179.88 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . 0.507 ' HA ' ' O ' ' A' ' 20' ' ' LYS . 0.5 OUTLIER -158.24 132.97 8.33 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.167 -0.958 . . . . 0.0 110.33 179.83 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 10.0 mm100 -108.89 -174.14 2.44 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.353 -0.842 . . . . 0.0 110.301 -179.935 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . 0.514 ' HA ' ' HA2' ' A' ' 19' ' ' GLY . 1.1 m -140.46 153.21 46.18 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.327 -0.858 . . . . 0.0 110.207 -179.994 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.588 ' HB2' ' CE1' ' A' ' 18' ' ' PHE . 4.5 mmt180 -144.04 137.95 28.0 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.309 -0.869 . . . . 0.0 110.286 -179.957 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -96.3 -156.68 0.54 Allowed 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.23 -0.919 . . . . 0.0 110.147 179.913 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . 0.693 HG23 ' OD1' ' A' ' 17' ' ' ASN . 0.1 OUTLIER -113.61 156.84 22.95 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.257 -0.902 . . . . 0.0 110.113 179.914 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 46.9 t -85.83 77.19 9.79 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.248 -0.907 . . . . 0.0 110.225 -179.962 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.317 0 N-CA-C 109.557 -1.417 . . . . 0.0 109.557 179.954 . . . . . . . . 0 0 . 1 . 022 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.651 0 CA-C-O 121.113 0.483 . . . . 0.0 110.088 . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . 0.447 ' SG ' ' O ' ' A' ' 25' ' ' SER . 12.0 p -99.02 137.72 37.14 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.225 -0.922 . . . . 0.0 110.174 -179.943 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 2.8 m-20 -111.9 133.53 54.04 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.279 -0.888 . . . . 0.0 110.143 -179.937 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -50.75 -34.57 27.72 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.211 -0.931 . . . . 0.0 110.101 179.961 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -65.76 -49.89 66.73 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.254 -0.904 . . . . 0.0 110.084 179.812 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -79.68 0.86 28.62 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.243 -0.911 . . . . 0.0 110.098 179.846 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 11.6 t -100.23 -36.75 9.18 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.184 -0.947 . . . . 0.0 110.169 179.908 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . 0.441 ' OG ' ' HA3' ' A' ' 19' ' ' GLY . 0.1 OUTLIER -86.57 -35.26 19.58 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.296 -0.878 . . . . 0.0 110.091 179.909 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.478 ' HA ' HD12 ' A' ' 12' ' ' ILE . 2.2 mt -55.52 -55.36 32.83 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.258 -0.901 . . . . 0.0 110.136 179.924 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -62.78 -30.59 71.57 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.321 -0.862 . . . . 0.0 110.016 179.819 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 1.2 m -74.81 -39.48 61.66 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.316 -0.865 . . . . 0.0 110.098 179.856 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . 0.478 HD12 ' HA ' ' A' ' 9' ' ' LEU . 36.0 mt -63.64 -32.02 55.24 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.581 0 O-C-N 121.337 -0.852 . . . . 0.0 110.006 179.881 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -86.76 -20.24 27.93 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.33 -0.856 . . . . 0.0 110.016 179.826 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.62 -22.08 51.33 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.394 -0.816 . . . . 0.0 110.155 179.928 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 126.04 5.42 6.25 Favored Glycine 0 N--CA 1.49 2.271 0 N-CA-C 109.642 -1.383 . . . . 0.0 109.642 -179.999 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 78.0 m-85 -94.41 -172.58 2.82 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.199 -1.177 . . . . 0.0 110.129 179.976 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . 0.479 ' HB3' ' CE2' ' A' ' 18' ' ' PHE . 44.1 t30 -139.08 7.05 2.42 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.135 -0.978 . . . . 0.0 110.2 179.907 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . 0.479 ' CE2' ' HB3' ' A' ' 17' ' ' ASN . 49.1 m-85 -143.62 168.97 18.62 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.252 -0.905 . . . . 0.0 110.155 179.946 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . 0.441 ' HA3' ' OG ' ' A' ' 8' ' ' SER . . . -155.73 100.17 0.19 Allowed Glycine 0 N--CA 1.49 2.283 0 N-CA-C 109.434 -1.466 . . . . 0.0 109.434 179.953 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -120.39 137.97 54.01 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.205 -1.174 . . . . 0.0 110.247 -179.806 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -87.32 153.35 21.54 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.214 -0.929 . . . . 0.0 110.191 -179.981 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.502 HG21 ' HG3' ' A' ' 27' ' ' GLN . 35.8 t -126.57 61.44 0.29 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.56 0 O-C-N 121.247 -0.908 . . . . 0.0 110.167 179.893 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 3.3 mpp_? 60.26 63.86 1.33 Allowed 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.364 -0.835 . . . . 0.0 110.141 -179.808 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 92.15 13.09 58.02 Favored Glycine 0 N--CA 1.49 2.29 0 N-CA-C 109.493 -1.443 . . . . 0.0 109.493 -179.885 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . 0.487 ' CB ' ' HB ' ' A' ' 22' ' ' VAL . 0.6 OUTLIER -133.28 -175.93 3.97 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.257 -1.143 . . . . 0.0 110.164 179.971 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 12.2 t -150.26 114.87 5.24 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.237 -0.914 . . . . 0.0 110.386 -179.977 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.502 ' HG3' HG21 ' A' ' 22' ' ' VAL . 2.7 mm100 -114.79 161.5 18.1 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.188 -0.945 . . . . 0.0 110.123 179.844 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . 0.451 ' SG ' ' O ' ' A' ' 27' ' ' GLN . 86.4 m -150.0 -178.45 6.49 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.223 -0.923 . . . . 0.0 110.333 -179.952 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -146.98 163.1 37.3 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.272 -0.892 . . . . 0.0 110.195 -179.986 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -119.95 148.38 43.6 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.235 -0.915 . . . . 0.0 110.183 179.927 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 77.7 p -93.07 151.31 19.95 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.305 -0.872 . . . . 0.0 110.164 -179.984 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 6.2 m -112.78 -28.1 7.89 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.216 -0.927 . . . . 0.0 110.259 -179.974 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.31 0 CA-C-O 118.035 -1.425 . . . . 0.0 109.542 -179.996 . . . . . . . . 0 0 . 1 . 023 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.638 0 CA-C-O 121.246 0.546 . . . . 0.0 110.189 . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . 0.473 ' O ' ' HB3' ' A' ' 3' ' ' ASN . 26.6 p -106.14 -25.66 11.92 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.365 -0.834 . . . . 0.0 110.253 -179.911 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . 0.473 ' HB3' ' O ' ' A' ' 2' ' ' CYS . 8.9 t-20 62.71 126.24 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.228 -0.92 . . . . 0.0 110.104 -179.743 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -76.11 -18.78 59.02 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.237 -0.914 . . . . 0.0 110.412 -179.776 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -67.85 -55.78 11.64 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.256 -0.903 . . . . 0.0 110.288 -179.814 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 42.9 m-20 -79.33 -6.64 57.19 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.244 -0.91 . . . . 0.0 110.314 -179.799 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 53.1 t -90.28 -42.32 11.05 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.225 -0.922 . . . . 0.0 110.082 179.854 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 3.1 m -78.2 -43.18 29.2 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.266 -0.896 . . . . 0.0 110.174 -179.996 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 40.2 mt -54.61 -47.95 72.79 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.307 -0.871 . . . . 0.0 110.215 -179.893 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . 0.468 ' O ' ' HG3' ' A' ' 14' ' ' LYS . 0.2 OUTLIER -66.6 -33.35 75.46 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.276 -0.89 . . . . 0.0 110.361 179.978 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 7.4 m -68.26 -45.73 72.36 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.24 -0.913 . . . . 0.0 110.369 179.998 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 68.2 mt -68.13 -33.19 59.5 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.645 0 O-C-N 121.228 -0.92 . . . . 0.0 110.351 -179.866 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -67.04 -37.65 84.45 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.193 -0.942 . . . . 0.0 110.427 -179.878 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . 0.468 ' HG3' ' O ' ' A' ' 10' ' ' ASP . 8.3 mttm -63.02 -27.49 69.45 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.243 -0.91 . . . . 0.0 110.325 -179.834 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 133.23 -2.62 4.7 Favored Glycine 0 N--CA 1.491 2.31 0 N-CA-C 109.745 -1.342 . . . . 0.0 109.745 179.958 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 16' ' ' TYR . . . . . 0.426 ' HA ' ' HG2' ' A' ' 30' ' ' ARG . 96.8 m-85 -83.79 179.35 7.6 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 121.149 -1.207 . . . . 0.0 110.354 -179.859 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . 0.583 ' HB3' ' CD2' ' A' ' 18' ' ' PHE . 1.5 t-20 -103.46 -46.61 4.52 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.347 -0.846 . . . . 0.0 109.875 179.688 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . 0.592 ' CE1' ' HB3' ' A' ' 29' ' ' ARG . 32.6 p90 -154.18 140.09 18.21 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.34 -0.85 . . . . 0.0 110.013 179.643 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . 0.512 ' CA ' ' HA ' ' A' ' 28' ' ' CYS . . . -119.89 -152.03 8.92 Favored Glycine 0 N--CA 1.49 2.242 0 N-CA-C 109.575 -1.41 . . . . 0.0 109.575 -179.97 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -178.36 166.44 1.86 Allowed 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.27 -1.135 . . . . 0.0 110.184 -179.945 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . 0.462 ' HA ' ' O ' ' A' ' 25' ' ' SER . 12.3 t -84.98 142.76 29.39 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.228 -0.92 . . . . 0.0 110.297 -179.938 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.589 ' O ' HG12 ' A' ' 22' ' ' VAL . 19.3 t -130.15 88.05 1.07 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.499 0 O-C-N 121.218 -0.926 . . . . 0.0 110.011 179.838 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . 0.412 ' HB2' ' O ' ' A' ' 22' ' ' VAL . 42.5 mtt180 54.23 74.69 0.32 Allowed 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.327 -0.858 . . . . 0.0 110.114 -179.926 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 59.37 28.55 64.79 Favored Glycine 0 N--CA 1.49 2.292 0 N-CA-C 109.521 -1.432 . . . . 0.0 109.521 -179.967 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . 0.462 ' O ' ' HA ' ' A' ' 21' ' ' CYS . 2.1 m -136.96 176.38 8.77 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.27 -1.135 . . . . 0.0 110.172 -179.979 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 45.9 t -137.23 121.78 18.43 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.222 -0.924 . . . . 0.0 110.312 179.946 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.439 ' O ' ' HA3' ' A' ' 19' ' ' GLY . 1.7 mm-40 -120.03 161.21 21.34 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.278 -0.889 . . . . 0.0 110.14 179.849 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . 0.512 ' HA ' ' CA ' ' A' ' 19' ' ' GLY . 17.9 m -119.79 139.39 52.39 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.341 -0.85 . . . . 0.0 110.03 179.905 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.592 ' HB3' ' CE1' ' A' ' 18' ' ' PHE . 1.1 mtm180 -120.16 143.08 48.4 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.167 -0.958 . . . . 0.0 110.29 -179.989 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.426 ' HG2' ' HA ' ' A' ' 16' ' ' TYR . 0.0 OUTLIER -105.15 163.76 12.33 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.28 -0.888 . . . . 0.0 110.161 179.975 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -84.03 -163.32 0.76 Allowed 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.25 -0.907 . . . . 0.0 110.107 -179.917 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -98.75 82.97 2.88 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.273 -0.892 . . . . 0.0 110.248 179.976 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.343 0 CA-C-O 118.02 -1.433 . . . . 0.0 109.52 179.972 . . . . . . . . 0 0 . 1 . 024 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.613 0 CA-C-O 121.203 0.525 . . . . 0.0 110.112 . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 13.2 p -83.48 145.18 29.08 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.157 -0.964 . . . . 0.0 110.161 -179.991 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -116.1 156.42 26.43 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.143 -0.973 . . . . 0.0 110.278 -179.884 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 33.1 m-20 -61.93 -34.64 76.46 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.225 -0.922 . . . . 0.0 109.933 179.732 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.413 ' O ' HD12 ' A' ' 9' ' ' LEU . 38.2 ttt180 -79.46 -38.18 35.18 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.289 -0.882 . . . . 0.0 109.855 179.737 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 24.9 t0 -79.52 -12.44 59.86 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.346 -0.846 . . . . 0.0 110.088 179.852 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 28.4 t -96.18 -35.32 11.34 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.313 -0.867 . . . . 0.0 110.172 179.982 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 11.5 p -78.02 -36.02 49.12 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.288 -0.882 . . . . 0.0 110.252 -179.89 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.413 HD12 ' O ' ' A' ' 5' ' ' ARG . 8.4 mt -53.49 -44.56 69.14 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.226 -0.921 . . . . 0.0 110.303 -179.999 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . 0.453 ' O ' ' HG3' ' A' ' 14' ' ' LYS . 19.8 t0 -72.24 -31.92 66.25 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.144 -0.972 . . . . 0.0 110.107 179.817 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.446 ' O ' ' HB2' ' A' ' 16' ' ' TYR . 55.7 m -66.76 -38.19 86.1 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.29 -0.881 . . . . 0.0 110.222 179.987 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 16.0 mt -71.54 -45.32 68.44 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.569 0 O-C-N 121.199 -0.938 . . . . 0.0 110.102 -179.99 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 1.4 ttt -63.79 -29.15 70.39 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.228 -0.92 . . . . 0.0 110.111 179.916 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . 0.453 ' HG3' ' O ' ' A' ' 10' ' ' ASP . 22.6 mttt -68.4 -20.25 64.66 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.359 -0.838 . . . . 0.0 110.153 179.842 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 119.82 -5.14 12.76 Favored Glycine 0 N--CA 1.491 2.323 0 N-CA-C 109.624 -1.39 . . . . 0.0 109.624 179.958 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 16' ' ' TYR . . . . . 0.446 ' HB2' ' O ' ' A' ' 11' ' ' CYS . 58.5 m-85 -86.73 -155.73 0.28 Allowed 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.238 -1.154 . . . . 0.0 110.083 179.96 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -129.2 -65.02 0.88 Allowed 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.117 -0.99 . . . . 0.0 110.259 -179.995 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . 0.558 ' CE1' ' HB3' ' A' ' 29' ' ' ARG . 39.7 p90 -129.11 139.83 51.81 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.272 -0.892 . . . . 0.0 110.301 -179.958 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . 0.481 ' HA3' ' O ' ' A' ' 27' ' ' GLN . . . -121.68 -162.88 11.77 Favored Glycine 0 N--CA 1.49 2.285 0 N-CA-C 109.571 -1.412 . . . . 0.0 109.571 179.997 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -162.31 151.76 15.84 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.35 -1.089 . . . . 0.0 110.198 -179.949 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . 0.465 ' HA ' ' O ' ' A' ' 25' ' ' SER . 0.8 OUTLIER -86.11 140.87 29.83 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.242 -0.911 . . . . 0.0 110.125 179.844 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.51 HG21 ' OE1' ' A' ' 27' ' ' GLN . 15.6 t -136.27 96.41 1.5 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.604 0 O-C-N 121.143 -0.973 . . . . 0.0 110.128 -179.998 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . 0.419 ' O ' ' C ' ' A' ' 24' ' ' GLY . 16.7 mtt180 52.16 85.43 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.192 -0.942 . . . . 0.0 110.144 -179.908 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . 0.419 ' C ' ' O ' ' A' ' 23' ' ' ARG . . . 44.88 33.34 3.51 Favored Glycine 0 N--CA 1.491 2.3 0 N-CA-C 109.362 -1.495 . . . . 0.0 109.362 -179.791 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . 0.5 ' CB ' ' O ' ' A' ' 22' ' ' VAL . 0.8 OUTLIER -138.03 165.14 27.33 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.237 -1.155 . . . . 0.0 110.15 -179.913 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 24.6 t -134.84 127.62 31.13 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.185 -0.947 . . . . 0.0 110.312 -179.979 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.51 ' OE1' HG21 ' A' ' 22' ' ' VAL . 27.5 mt-30 -118.85 159.6 23.46 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.339 -0.851 . . . . 0.0 109.978 179.82 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 61.9 m -120.67 136.0 54.96 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.196 -0.94 . . . . 0.0 110.26 -179.866 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.558 ' HB3' ' CE1' ' A' ' 18' ' ' PHE . 5.8 mmt180 -124.3 136.46 54.14 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.312 -0.867 . . . . 0.0 110.285 -179.968 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.427 ' HG3' ' HA ' ' A' ' 16' ' ' TYR . 0.9 OUTLIER -106.12 177.36 4.88 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.383 -0.823 . . . . 0.0 110.182 179.901 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -79.68 131.65 36.01 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.241 -0.912 . . . . 0.0 110.177 -179.906 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -122.36 -24.38 5.03 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.254 -0.904 . . . . 0.0 110.135 -179.965 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.329 0 CA-C-O 117.997 -1.446 . . . . 0.0 109.528 -179.909 . . . . . . . . 0 0 . 1 . 025 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.658 0 CA-C-O 121.205 0.526 . . . . 0.0 110.195 . . . . . . . . . 0 0 . 1 . 025 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . 0.428 ' O ' ' HB2' ' A' ' 3' ' ' ASN . 28.5 p -101.2 -8.66 22.0 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.29 -0.881 . . . . 0.0 110.307 -179.999 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 3' ' ' ASN . . . . . 0.428 ' HB2' ' O ' ' A' ' 2' ' ' CYS . 29.5 m-20 57.97 98.2 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.283 -0.885 . . . . 0.0 110.163 -179.919 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -69.47 -38.2 77.62 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.21 -0.931 . . . . 0.0 110.307 -179.928 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.85 -39.85 95.19 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.262 -0.899 . . . . 0.0 110.308 -179.98 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -79.68 -21.94 44.07 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.283 -0.886 . . . . 0.0 110.332 -179.9 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 8.6 t -78.41 -34.4 48.08 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.233 -0.917 . . . . 0.0 110.05 179.863 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 22.8 m -81.31 -34.72 31.71 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.241 -0.912 . . . . 0.0 110.118 179.909 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 8.6 mt -61.86 -51.95 66.1 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.217 -0.927 . . . . 0.0 110.205 179.855 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -62.64 -29.41 70.6 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.183 -0.948 . . . . 0.0 109.942 179.776 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 1.3 m -72.59 -47.86 44.53 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.289 -0.882 . . . . 0.0 110.143 179.816 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 40.9 mt -63.38 -22.45 30.84 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.599 0 O-C-N 121.306 -0.871 . . . . 0.0 109.88 179.828 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -77.86 -40.89 38.69 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.374 -0.829 . . . . 0.0 110.039 179.779 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -59.66 -48.35 82.02 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.277 -0.889 . . . . 0.0 110.089 179.936 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 144.65 36.71 0.07 OUTLIER Glycine 0 N--CA 1.492 2.388 0 N-CA-C 109.934 -1.266 . . . . 0.0 109.934 179.752 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 16' ' ' TYR . . . . . 0.541 ' CD1' ' HG3' ' A' ' 30' ' ' ARG . 64.8 m-85 -108.64 -164.38 0.95 Allowed 'General case' 0 N--CA 1.487 1.394 0 O-C-N 121.119 -1.224 . . . . 0.0 110.042 179.744 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . 0.557 ' HB3' ' CD1' ' A' ' 18' ' ' PHE . 51.9 t-20 -128.84 -54.41 1.22 Allowed 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.123 -0.985 . . . . 0.0 110.486 -179.941 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . 0.599 ' N ' ' CD1' ' A' ' 18' ' ' PHE . 5.8 p90 -131.73 150.4 52.16 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.129 -0.982 . . . . 0.0 110.177 179.95 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . 0.481 ' HA2' ' HA ' ' A' ' 28' ' ' CYS . . . -155.82 -176.64 28.2 Favored Glycine 0 N--CA 1.49 2.272 0 N-CA-C 109.812 -1.315 . . . . 0.0 109.812 -179.868 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -174.66 171.89 3.15 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.279 -1.13 . . . . 0.0 110.112 -179.974 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 21' ' ' CYS . . . . . 0.437 ' HA ' ' O ' ' A' ' 25' ' ' SER . 52.1 t -90.35 135.92 33.38 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.223 -0.923 . . . . 0.0 110.136 179.921 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.487 ' HB ' ' HB3' ' A' ' 25' ' ' SER . 5.2 t -113.98 85.45 0.82 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.625 0 O-C-N 121.146 -0.971 . . . . 0.0 110.196 -179.995 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 54.01 72.34 0.45 Allowed 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.264 -0.898 . . . . 0.0 110.223 179.917 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 65.0 34.76 90.74 Favored Glycine 0 N--CA 1.49 2.282 0 N-CA-C 109.624 -1.39 . . . . 0.0 109.624 179.853 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . 0.487 ' HB3' ' HB ' ' A' ' 22' ' ' VAL . 8.7 t -140.26 175.59 9.47 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.237 -1.155 . . . . 0.0 110.263 -179.993 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 52.8 t -135.27 97.72 3.78 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.265 -0.897 . . . . 0.0 110.136 179.909 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.46 ' HB2' ' CG2' ' A' ' 22' ' ' VAL . 28.1 mt-30 -113.42 151.23 31.63 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.269 -0.894 . . . . 0.0 110.251 -179.877 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . 0.481 ' HA ' ' HA2' ' A' ' 19' ' ' GLY . 91.2 m -144.77 168.96 18.97 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.297 -0.877 . . . . 0.0 110.16 179.857 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.59 ' HB2' ' CE2' ' A' ' 18' ' ' PHE . 1.8 mpt_? -136.21 167.63 20.92 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.308 -0.87 . . . . 0.0 110.283 -179.752 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.541 ' HG3' ' CD1' ' A' ' 16' ' ' TYR . 0.0 OUTLIER -118.24 -155.87 0.62 Allowed 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.275 -0.89 . . . . 0.0 110.17 -179.987 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 69.7 p -113.01 127.78 56.32 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.277 -0.889 . . . . 0.0 110.207 179.96 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 3.6 t -93.91 133.03 37.76 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.175 -0.953 . . . . 0.0 110.236 179.931 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.376 0 N-CA-C 109.508 -1.437 . . . . 0.0 109.508 -179.9 . . . . . . . . 0 0 . 1 stop_ save_