data_2h9r_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 2h9r _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 ' 10' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.238 0 N-CA-C 109.498 -1.441 . . . . 0.0 109.498 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -76.0 -21.98 56.32 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.232 -1.158 . . . . 0.0 110.099 179.937 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 92.6 m -74.07 -37.35 64.26 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.236 -0.915 . . . . 0.0 110.213 -179.97 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -82.04 -47.46 12.6 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.367 -0.833 . . . . 0.0 110.208 179.986 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -53.45 -41.72 66.41 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.177 -0.952 . . . . 0.0 110.115 179.86 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 71.0 mt -71.48 -37.53 71.29 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.191 -0.943 . . . . 0.0 109.989 179.789 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.38 -34.13 77.46 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.275 -0.891 . . . . 0.0 110.137 179.893 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -67.43 -45.23 80.38 Favored Glycine 0 N--CA 1.491 2.315 0 N-CA-C 109.218 -1.553 . . . . 0.0 109.218 179.721 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 20.4 t80 -63.6 -47.22 82.33 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.346 -1.091 . . . . 0.0 109.697 179.581 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 59.4 m -57.42 -27.1 62.1 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.329 -0.857 . . . . 0.0 110.139 179.715 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 46.1 t -74.74 -73.91 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.59 0 O-C-N 121.396 -0.815 . . . . 0.0 110.316 -179.959 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.469 ' OE1' ' CE1' ' A' ' 37' ' ' TYR . 10.3 pt-20 -44.7 -44.32 9.05 Favored 'General case' 0 N--CA 1.497 1.898 0 O-C-N 121.482 -0.761 . . . . 0.0 111.319 -179.443 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 89.6 t -55.21 -50.84 61.08 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.638 0 O-C-N 120.96 -1.087 . . . . 0.0 110.188 179.969 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 88.8 mt -77.34 -3.64 41.05 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.319 -0.863 . . . . 0.0 110.892 -179.734 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -106.72 -52.78 2.72 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 120.923 -1.111 . . . . 0.0 110.388 -179.919 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 3.3 tp-100 -78.89 -24.98 43.83 Favored 'General case' 0 C--N 1.306 -1.322 0 O-C-N 121.278 -0.889 . . . . 0.0 109.831 -179.999 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 2.7 mt-30 52.77 70.85 1.64 Allowed Pre-proline 0 N--CA 1.491 1.59 0 O-C-N 121.192 -0.942 . . . . 0.0 110.091 179.996 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 45.4 Cg_endo -70.3 159.7 52.08 Favored 'Trans proline' 0 C--N 1.31 -1.485 0 O-C-N 123.67 1.353 . . . . 0.0 110.5 -179.95 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 44.4 Cg_endo -71.22 -30.4 15.95 Favored 'Trans proline' 0 C--N 1.311 -1.402 0 O-C-N 123.761 1.4 . . . . 0.0 110.278 179.96 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -140.26 116.01 10.23 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.267 -0.896 . . . . 0.0 110.17 179.864 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 16.7 tp -67.45 -38.73 84.92 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.221 -0.924 . . . . 0.0 109.955 179.972 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 42.6 t -55.06 -66.55 0.26 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.632 0 O-C-N 121.379 -0.825 . . . . 0.0 109.837 179.796 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -56.78 -34.63 67.81 Favored 'General case' 0 N--CA 1.487 1.406 0 O-C-N 121.48 -0.763 . . . . 0.0 109.819 179.735 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 46.1 t80 -64.18 -47.71 78.76 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.269 -0.895 . . . . 0.0 109.609 179.337 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . 0.471 ' O ' ' CD2' ' A' ' 38' ' ' PHE . . . -52.53 -32.07 38.7 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.369 -0.832 . . . . 0.0 110.132 179.762 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 58.5 t -74.86 -39.04 45.0 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.388 0 O-C-N 121.379 -0.826 . . . . 0.0 110.356 -179.963 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 39.5 mm-40 -72.23 -32.0 66.33 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.148 -0.97 . . . . 0.0 110.479 -179.763 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . 0.469 ' CE1' ' OE1' ' A' ' 21' ' ' GLU . 34.1 t80 -73.37 -68.88 0.46 Allowed 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.256 -0.902 . . . . 0.0 110.594 -179.686 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . 0.471 ' CD2' ' O ' ' A' ' 34' ' ' ALA . 24.1 m-85 -50.28 -49.51 53.16 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.207 -0.933 . . . . 0.0 110.665 -179.565 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 45.5 m -52.35 -40.51 62.05 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.151 -0.968 . . . . 0.0 109.941 179.912 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 12.0 mtt85 -74.93 -27.0 60.03 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.253 -0.904 . . . . 0.0 109.717 179.562 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -58.23 -32.38 68.27 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.317 -0.865 . . . . 0.0 109.745 179.655 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . 0.417 ' NH2' ' OD1' ' B' ' 32' ' ' ASP . 5.0 ttp180 -53.09 -43.42 66.77 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.385 -0.822 . . . . 0.0 110.158 179.945 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 5.5 mt-10 -75.32 -30.88 60.46 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.327 -0.858 . . . . 0.0 110.468 -179.748 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.635 0 O-C-N 121.185 -0.947 . . . . 0.0 110.663 -179.787 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 47.8 Cg_endo . . . . . 0 N--CA 1.485 1.003 0 N-CA-C 110.671 -0.55 . . . . 0.0 110.671 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' B' B ' 9' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_endo -76.82 165.21 28.95 Favored 'Trans proline' 0 C--N 1.313 -1.34 0 O-C-N 123.594 1.312 . . . . 0.0 110.378 179.848 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 108.65 -26.09 17.21 Favored Glycine 0 N--CA 1.491 2.33 0 N-CA-C 109.93 -1.268 . . . . 0.0 109.93 179.64 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -80.2 -26.8 39.04 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.16 -1.2 . . . . 0.0 110.267 -179.89 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 88.8 m -68.53 -36.99 79.61 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.194 -0.941 . . . . 0.0 110.344 179.993 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -74.27 -40.48 62.3 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.28 -0.888 . . . . 0.0 110.111 179.923 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 3.2 mt -62.68 -37.6 87.1 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.183 -0.948 . . . . 0.0 110.055 179.786 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -72.84 -49.07 32.45 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.324 -0.86 . . . . 0.0 110.054 179.859 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 16' ' ' GLN . . . . . 0.42 ' O ' ' CG2' ' B' ' 20' ' ' VAL . 2.5 mt-30 -55.52 -37.54 68.04 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.282 -0.886 . . . . 0.0 110.013 179.789 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 17' ' ' GLY . . . . . . . . . . . . . . . -62.59 -40.29 98.95 Favored Glycine 0 N--CA 1.489 2.224 0 N-CA-C 109.0 -1.64 . . . . 0.0 109.0 179.769 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 18' ' ' TYR . . . . . 0.427 ' O ' ' CG2' ' B' ' 22' ' ' VAL . 34.1 t80 -71.17 -53.71 13.53 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.304 -1.116 . . . . 0.0 109.722 179.572 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 90.6 m -51.1 -27.07 7.48 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.239 -0.913 . . . . 0.0 110.185 179.721 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 20' ' ' VAL . . . . . 0.42 ' CG2' ' O ' ' B' ' 16' ' ' GLN . 55.7 t -73.88 -75.44 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.651 0 O-C-N 121.316 -0.865 . . . . 0.0 109.829 179.669 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 21' ' ' GLU . . . . . 0.427 ' HG3' ' N ' ' B' ' 22' ' ' VAL . 11.0 pt-20 -47.09 -41.5 17.28 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.459 -0.775 . . . . 0.0 110.793 -179.849 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 22' ' ' VAL . . . . . 0.427 ' CG2' ' O ' ' B' ' 18' ' ' TYR . 78.7 t -55.94 -44.9 79.59 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.575 0 O-C-N 121.176 -0.953 . . . . 0.0 110.116 179.912 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -73.22 -26.18 61.03 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.196 -0.94 . . . . 0.0 110.4 -179.86 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.55 -55.47 4.11 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.113 -0.992 . . . . 0.0 110.425 -179.868 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 25' ' ' GLN . . . . . 0.437 ' O ' ' CG ' ' B' ' 26' ' ' GLN . 5.6 mp0 -65.67 -20.35 66.26 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.147 -0.97 . . . . 0.0 110.657 -179.708 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 26' ' ' GLN . . . . . 0.437 ' CG ' ' O ' ' B' ' 25' ' ' GLN . 12.7 pt20 36.45 55.22 2.91 Favored Pre-proline 0 N--CA 1.507 2.38 0 O-C-N 122.058 -0.401 . . . . 0.0 111.534 -179.791 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 27' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_endo -68.09 152.02 76.82 Favored 'Trans proline' 0 C--N 1.31 -1.488 0 O-C-N 123.678 1.357 . . . . 0.0 110.526 -179.798 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 44.3 Cg_endo -71.06 -14.41 31.96 Favored 'Trans proline' 0 C--N 1.312 -1.392 0 O-C-N 123.755 1.397 . . . . 0.0 110.503 -179.958 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 12.5 m-20 -137.46 111.2 8.16 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.066 -1.021 . . . . 0.0 110.282 179.915 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -76.73 -34.19 58.11 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.345 -0.847 . . . . 0.0 109.492 179.641 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 21.6 t -61.93 -50.8 78.65 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.603 0 CA-C-O 121.658 0.742 . . . . 0.0 109.468 179.484 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 32' ' ' ASP . . . . . 0.417 ' OD1' ' NH2' ' A' ' 42' ' ' ARG . 10.5 t70 -67.61 -30.25 69.78 Favored 'General case' 0 C--N 1.303 -1.456 0 O-C-N 121.643 -0.661 . . . . 0.0 109.97 179.775 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 33' ' ' PHE . . . . . . . . . . . . . 83.5 t80 -72.68 -39.48 67.03 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.273 -0.892 . . . . 0.0 109.501 179.284 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -65.83 -38.35 88.67 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.376 -0.827 . . . . 0.0 109.938 179.633 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 35' ' ' VAL . . . . . . . . . . . . . 96.8 t -73.8 -32.58 35.01 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.325 0 O-C-N 121.309 -0.87 . . . . 0.0 110.195 179.886 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -80.13 -30.18 38.98 Favored 'General case' 0 N--CA 1.487 1.42 0 O-C-N 121.262 -0.899 . . . . 0.0 109.592 179.892 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 37' ' ' TYR . . . . . . . . . . . . . 16.5 t80 -76.96 -64.14 1.2 Allowed 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.18 -0.95 . . . . 0.0 110.205 -179.957 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 12.7 m-85 -51.95 -50.27 61.54 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.255 -0.903 . . . . 0.0 110.444 -179.845 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 39' ' ' THR . . . . . . . . . . . . . 43.1 m -53.19 -40.98 64.82 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.2 -0.938 . . . . 0.0 110.031 179.853 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 16.6 ttt85 -72.13 -25.27 61.66 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.266 -0.896 . . . . 0.0 110.076 179.766 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -57.68 -55.27 37.02 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.262 -0.899 . . . . 0.0 110.089 179.856 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.93 -36.22 26.95 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.16 -0.963 . . . . 0.0 110.633 -179.958 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 43' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 . . . . . 0 N--CA 1.491 1.612 0 O-C-N 121.211 -0.931 . . . . 0.0 110.371 -179.844 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' C' C ' 2' ' ' LEU . . . . . . . . . . . . . 4.0 tp . . . . . 0 N--CA 1.491 1.584 0 CA-C-O 121.245 0.545 . . . . 0.0 110.222 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' C' C ' 3' ' ' ILE . . . . . . . . . . . . . 1.8 pp -63.09 -23.16 32.55 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.591 0 O-C-N 121.339 -0.851 . . . . 0.0 110.239 -179.977 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 4' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 -78.6 -32.35 47.54 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.235 -0.916 . . . . 0.0 110.329 -179.918 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 5' ' ' THR . . . . . . . . . . . . . 93.1 m -74.82 -34.57 62.38 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.221 -0.924 . . . . 0.0 110.262 -179.958 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 6' ' ' ALA . . . . . . . . . . . . . . . -77.7 -37.92 48.48 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.243 -0.911 . . . . 0.0 110.306 -179.895 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 7' ' ' SER . . . . . . . . . . . . . 31.9 m -52.44 -69.85 0.1 Allowed 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.157 -0.964 . . . . 0.0 110.204 -179.885 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 8' ' ' SER . . . . . . . . . . . . . 1.9 m -58.68 -24.54 61.52 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.262 -0.899 . . . . 0.0 110.265 179.908 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 9' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -52.24 -43.14 64.15 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.248 -0.907 . . . . 0.0 110.301 -179.923 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' C' C ' 10' ' ' VAL . . . . . . . . . . . . . 71.1 t -71.95 -30.11 35.73 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.595 0 O-C-N 121.166 -0.959 . . . . 0.0 110.309 -179.887 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 11' ' ' LYS . . . . . . . . . . . . . 34.4 mmtm -66.05 -48.6 70.51 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.19 -0.944 . . . . 0.0 110.361 -179.901 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' C' C ' 12' ' ' ASN . . . . . . . . . . . . . 28.7 m-80 . . . . . 0 N--CA 1.492 1.646 0 O-C-N 121.288 -0.882 . . . . 0.0 110.262 -179.918 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.396 0 N-CA-C 109.608 -1.397 . . . . 0.0 109.608 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -69.06 -23.14 64.0 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.236 -1.156 . . . . 0.0 110.35 -179.881 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 31.9 m -76.91 -51.15 11.72 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.221 -0.925 . . . . 0.0 110.259 -179.96 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -57.77 -31.71 66.79 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.262 -0.899 . . . . 0.0 110.272 -179.923 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.1 mp -72.29 -40.35 67.64 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.357 -0.84 . . . . 0.0 110.282 -179.882 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 5.8 mp -77.79 -52.76 8.4 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.284 -0.885 . . . . 0.0 110.246 -179.94 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -51.79 -44.27 63.38 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.185 -0.947 . . . . 0.0 110.257 179.956 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -58.38 -47.76 87.82 Favored Glycine 0 N--CA 1.49 2.297 0 N-CA-C 109.149 -1.58 . . . . 0.0 109.149 179.729 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . 0.418 ' O ' ' CG2' ' A' ' 22' ' ' VAL . 46.8 t80 -61.15 -47.19 87.37 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.271 -1.135 . . . . 0.0 109.629 179.466 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 7.9 m -56.58 -36.11 68.97 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.361 -0.837 . . . . 0.0 110.147 179.743 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 41.6 t -67.15 -71.95 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.674 0 O-C-N 121.293 -0.879 . . . . 0.0 110.216 -179.981 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 5.4 pt-20 -46.58 -49.11 19.33 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.357 -0.839 . . . . 0.0 111.425 -179.392 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.418 ' CG2' ' O ' ' A' ' 18' ' ' TYR . 93.5 t -50.8 -44.28 26.16 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.717 0 O-C-N 120.774 -1.204 . . . . 0.0 110.529 -179.777 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -73.26 -25.1 60.56 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.218 -0.926 . . . . 0.0 110.252 -179.987 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -76.49 -69.39 0.51 Allowed 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.255 -0.903 . . . . 0.0 110.417 -179.929 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 2.7 pt20 -71.94 -33.67 68.42 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.126 -0.984 . . . . 0.0 110.285 -179.845 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 52.13 81.38 0.26 Allowed Pre-proline 0 N--CA 1.492 1.662 0 O-C-N 121.275 -0.891 . . . . 0.0 110.18 179.965 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 44.8 Cg_endo -71.82 162.3 42.4 Favored 'Trans proline' 0 C--N 1.311 -1.442 0 O-C-N 123.727 1.383 . . . . 0.0 110.528 -179.82 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo -70.14 -26.4 25.81 Favored 'Trans proline' 0 C--N 1.311 -1.44 0 O-C-N 123.803 1.423 . . . . 0.0 110.142 179.828 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 9.6 m-20 -139.15 112.22 8.0 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.361 -0.837 . . . . 0.0 109.726 179.588 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 3.5 tp -74.7 -33.49 62.44 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.32 -0.862 . . . . 0.0 110.29 -179.7 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 43.2 t -50.78 -54.66 9.12 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.714 0 O-C-N 121.275 -0.89 . . . . 0.0 110.112 179.812 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -66.19 -44.18 84.7 Favored 'General case' 0 C--N 1.301 -1.533 0 O-C-N 121.565 -0.709 . . . . 0.0 110.148 179.911 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 36.7 t80 -58.18 -50.3 74.0 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.082 -1.011 . . . . 0.0 109.756 179.532 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -49.22 -39.48 30.04 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.42 -0.8 . . . . 0.0 110.515 179.891 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 90.3 t -73.88 -38.85 51.01 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.366 0 O-C-N 121.221 -0.924 . . . . 0.0 110.423 -179.883 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -74.17 -20.56 60.17 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.201 -0.937 . . . . 0.0 110.548 -179.661 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 26.6 t80 -75.65 -59.61 2.67 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.191 -0.943 . . . . 0.0 110.466 -179.899 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 23.6 m-85 -67.44 -48.69 66.5 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.225 -0.922 . . . . 0.0 110.51 -179.824 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 94.8 m -50.42 -41.56 52.62 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.174 -0.954 . . . . 0.0 110.29 -179.943 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 1.5 ttt180 -70.25 -25.2 63.26 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.177 -0.952 . . . . 0.0 110.13 179.697 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -62.54 -34.23 76.5 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.258 -0.901 . . . . 0.0 109.954 179.888 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.64 -37.49 65.73 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.352 -0.843 . . . . 0.0 110.275 179.92 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -84.01 -25.53 29.87 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.217 -0.927 . . . . 0.0 110.4 -179.887 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.645 0 O-C-N 121.169 -0.957 . . . . 0.0 110.345 -179.983 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 47.7 Cg_endo . . . . . 0 N--CA 1.483 0.892 0 N-CA-C 110.349 -0.673 . . . . 0.0 110.349 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' B' B ' 9' ' ' PRO . . . . . . . . . . . . . 45.3 Cg_endo -72.53 177.8 7.01 Favored 'Trans proline' 0 C--N 1.313 -1.34 0 O-C-N 123.522 1.275 . . . . 0.0 110.49 179.967 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 99.28 -40.28 2.49 Favored Glycine 0 N--CA 1.491 2.3 0 N-CA-C 109.473 -1.451 . . . . 0.0 109.473 -179.943 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.22 -23.94 67.65 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.306 -1.114 . . . . 0.0 110.26 179.994 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 95.5 m -62.94 -61.38 2.43 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.223 -0.923 . . . . 0.0 110.214 179.929 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 -52.3 -32.81 39.38 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.342 -0.849 . . . . 0.0 110.248 -179.979 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 14.1 mt -66.59 -56.94 8.41 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.285 -0.884 . . . . 0.0 110.429 -179.852 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 14.3 mt -66.03 -48.95 69.41 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.218 -0.926 . . . . 0.0 110.27 -179.943 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -52.02 -47.49 64.98 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.139 -0.976 . . . . 0.0 110.028 179.826 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 17' ' ' GLY . . . . . . . . . . . . . . . -55.14 -42.54 82.04 Favored Glycine 0 N--CA 1.49 2.3 0 N-CA-C 109.066 -1.614 . . . . 0.0 109.066 179.508 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 18' ' ' TYR . . . . . 0.45 ' CE1' ' CD2' ' B' ' 33' ' ' PHE . 19.0 t80 -64.87 -45.27 86.73 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.323 -1.104 . . . . 0.0 109.561 179.365 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 6.6 m -58.28 -24.08 58.36 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.424 -0.798 . . . . 0.0 110.022 179.675 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 51.2 t -78.07 -74.07 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.608 0 O-C-N 121.351 -0.843 . . . . 0.0 110.413 -179.828 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -45.28 -44.62 11.52 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.464 -0.772 . . . . 0.0 111.194 -179.305 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 22' ' ' VAL . . . . . . . . . . . . . 86.0 t -59.24 -47.17 91.25 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.6 0 O-C-N 120.947 -1.096 . . . . 0.0 109.737 179.808 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 3.0 tp -72.65 -19.45 61.44 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.293 -0.879 . . . . 0.0 110.038 179.594 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -81.5 -59.07 2.75 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.297 -0.877 . . . . 0.0 110.33 -179.913 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 25' ' ' GLN . . . . . 0.44 ' HG3' ' N ' ' B' ' 26' ' ' GLN . 0.0 OUTLIER -89.82 -23.01 21.82 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.206 -0.934 . . . . 0.0 110.586 -179.653 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 26' ' ' GLN . . . . . 0.44 ' N ' ' HG3' ' B' ' 25' ' ' GLN . 7.6 mt-30 47.96 81.78 0.25 Allowed Pre-proline 0 N--CA 1.494 1.76 0 O-C-N 121.159 -0.963 . . . . 0.0 110.674 179.752 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 27' ' ' PRO . . . . . . . . . . . . . 44.9 Cg_endo -73.09 166.55 29.71 Favored 'Trans proline' 0 C--N 1.31 -1.483 0 O-C-N 123.615 1.324 . . . . 0.0 110.598 -179.815 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 44.3 Cg_endo -70.52 -49.17 0.47 Allowed 'Trans proline' 0 C--N 1.311 -1.41 0 O-C-N 123.749 1.394 . . . . 0.0 110.176 179.785 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 10.0 m-20 -119.37 116.87 27.08 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.237 -0.914 . . . . 0.0 110.081 179.718 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -71.46 -29.26 64.65 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.27 -0.894 . . . . 0.0 110.444 -179.708 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 43.4 t -49.9 -65.39 0.24 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.784 0 O-C-N 121.189 -0.945 . . . . 0.0 110.054 179.83 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 4.3 t0 -56.54 -46.54 80.59 Favored 'General case' 0 C--N 1.302 -1.492 0 O-C-N 121.466 -0.771 . . . . 0.0 109.961 179.679 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 33' ' ' PHE . . . . . 0.45 ' CD2' ' CE1' ' B' ' 18' ' ' TYR . 67.7 t80 -54.83 -47.35 74.21 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.174 -0.954 . . . . 0.0 109.832 179.68 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -56.1 -40.19 73.31 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.324 -0.86 . . . . 0.0 109.935 179.74 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 35' ' ' VAL . . . . . 0.424 ' O ' ' CB ' ' B' ' 39' ' ' THR . 76.9 t -77.32 -45.65 29.31 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.323 0 O-C-N 121.306 -0.871 . . . . 0.0 109.82 179.77 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -61.23 -36.26 79.48 Favored 'General case' 0 N--CA 1.487 1.403 0 O-C-N 121.3 -0.875 . . . . 0.0 109.329 179.495 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 37' ' ' TYR . . . . . . . . . . . . . 61.6 t80 -68.9 -59.34 3.13 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.295 -0.878 . . . . 0.0 110.141 179.872 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 12.1 m-85 -64.19 -49.57 71.52 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.257 -0.902 . . . . 0.0 110.576 -179.65 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 39' ' ' THR . . . . . 0.424 ' CB ' ' O ' ' B' ' 35' ' ' VAL . 94.2 m -51.53 -27.7 11.54 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.1 -1.0 . . . . 0.0 110.056 179.953 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -75.49 -35.65 60.76 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.295 -0.878 . . . . 0.0 109.77 179.528 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.02 -27.83 68.61 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.389 -0.82 . . . . 0.0 110.301 179.926 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.26 -28.28 63.02 Favored 'General case' 0 N--CA 1.486 1.343 0 O-C-N 121.263 -0.898 . . . . 0.0 110.04 -179.922 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 43' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 . . . . . 0 N--CA 1.492 1.639 0 O-C-N 121.125 -0.984 . . . . 0.0 110.565 179.937 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' C' C ' 2' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.498 1.972 0 CA-C-O 121.164 0.506 . . . . 0.0 110.553 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 3' ' ' ILE . . . . . . . . . . . . . 2.9 mp -55.48 -23.37 13.97 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.61 0 O-C-N 121.083 -1.011 . . . . 0.0 110.321 -179.888 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 4' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -103.62 20.49 17.87 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.278 -0.889 . . . . 0.0 110.306 -179.883 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' C' C ' 5' ' ' THR . . . . . . . . . . . . . 78.7 m -138.34 -47.93 0.53 Allowed 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.189 -0.944 . . . . 0.0 110.078 179.825 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 6' ' ' ALA . . . . . . . . . . . . . . . -61.39 -36.18 79.55 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.235 -0.916 . . . . 0.0 110.065 179.877 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 7' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -60.79 -45.43 94.4 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.28 -0.888 . . . . 0.0 110.117 179.884 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' C' C ' 8' ' ' SER . . . . . . . . . . . . . 6.3 t -70.92 -29.62 65.72 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.276 -0.89 . . . . 0.0 110.095 179.8 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 9' ' ' LEU . . . . . . . . . . . . . 3.2 tp -68.68 -62.8 1.23 Allowed 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.277 -0.89 . . . . 0.0 110.158 179.945 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 10' ' ' VAL . . . . . . . . . . . . . 35.2 m -53.85 -27.78 16.07 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.628 0 O-C-N 121.314 -0.866 . . . . 0.0 110.173 -179.94 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 11' ' ' LYS . . . . . . . . . . . . . 1.8 tppt? -70.37 -38.72 74.8 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.291 -0.881 . . . . 0.0 110.255 -179.951 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' C' C ' 12' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 . . . . . 0 N--CA 1.492 1.652 0 O-C-N 121.241 -0.912 . . . . 0.0 110.139 179.937 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.414 0 N-CA-C 109.615 -1.394 . . . . 0.0 109.615 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 22.3 tp -64.36 -23.15 67.19 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.239 -1.154 . . . . 0.0 110.338 -179.904 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 7.5 m -63.25 -62.81 1.45 Allowed 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.218 -0.926 . . . . 0.0 110.231 -179.987 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 31.6 tt0 -54.77 -30.49 56.79 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.352 -0.843 . . . . 0.0 110.223 -179.99 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -72.65 -49.82 29.22 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.205 -0.935 . . . . 0.0 110.222 179.93 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -70.7 -56.58 6.08 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.141 -0.974 . . . . 0.0 110.113 179.944 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -54.38 -41.67 69.49 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.147 -0.971 . . . . 0.0 109.646 179.607 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -55.57 -41.03 80.53 Favored Glycine 0 N--CA 1.489 2.205 0 N-CA-C 109.248 -1.541 . . . . 0.0 109.248 179.554 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . 0.415 ' OH ' ' CD1' ' A' ' 30' ' ' LEU . 63.7 t80 -67.08 -43.15 83.35 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.296 -1.12 . . . . 0.0 109.736 179.624 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 1.6 m -54.41 -29.19 48.16 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.198 -0.939 . . . . 0.0 109.88 179.557 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 45.0 t -76.86 -71.68 0.26 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.593 0 O-C-N 121.407 -0.808 . . . . 0.0 110.238 -179.955 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 -45.31 -43.09 10.43 Favored 'General case' 0 N--CA 1.497 1.903 0 O-C-N 121.447 -0.783 . . . . 0.0 111.094 -179.489 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 71.2 t -55.94 -54.07 31.06 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.581 0 O-C-N 121.001 -1.062 . . . . 0.0 109.596 179.706 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 4.0 mt -66.73 -23.79 66.15 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.311 -0.868 . . . . 0.0 109.976 179.713 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -81.34 -71.15 0.49 Allowed 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.258 -0.901 . . . . 0.0 109.944 179.899 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -55.18 -35.26 64.63 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.381 -0.824 . . . . 0.0 110.199 179.907 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER 51.25 64.61 7.77 Favored Pre-proline 0 N--CA 1.491 1.612 0 O-C-N 121.173 -0.954 . . . . 0.0 110.272 -179.944 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 46.2 Cg_endo -70.69 159.44 52.7 Favored 'Trans proline' 0 C--N 1.31 -1.452 0 O-C-N 123.76 1.4 . . . . 0.0 110.475 -179.953 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 43.7 Cg_endo -70.63 -23.03 27.29 Favored 'Trans proline' 0 C--N 1.31 -1.461 0 O-C-N 123.713 1.375 . . . . 0.0 110.149 179.876 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . 0.425 ' OD2' ' CB ' ' A' ' 32' ' ' ASP . 32.8 p-10 -142.4 115.26 8.7 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.384 -0.823 . . . . 0.0 109.917 179.697 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.415 ' CD1' ' OH ' ' A' ' 18' ' ' TYR . 10.8 tp -70.61 -34.93 72.66 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.273 -0.892 . . . . 0.0 110.318 -179.691 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 42.4 t -49.83 -59.9 0.92 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.832 0 O-C-N 121.261 -0.899 . . . . 0.0 109.925 179.714 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . 0.425 ' CB ' ' OD2' ' A' ' 29' ' ' ASP . 6.4 t0 -60.1 -46.1 90.72 Favored 'General case' 0 C--N 1.301 -1.503 0 O-C-N 121.619 -0.675 . . . . 0.0 109.972 179.801 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 53.3 t80 -56.56 -48.79 76.57 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.169 -0.957 . . . . 0.0 109.568 179.524 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -55.06 -43.45 73.85 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.329 -0.857 . . . . 0.0 109.659 179.579 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 69.2 t -72.34 -23.42 21.34 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.36 0 O-C-N 121.486 -0.759 . . . . 0.0 109.878 179.712 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -81.7 -44.07 17.61 Favored 'General case' 0 C--N 1.303 -1.418 0 O-C-N 121.23 -0.919 . . . . 0.0 109.782 -179.749 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 51.5 t80 -62.71 -61.47 2.39 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.182 -0.949 . . . . 0.0 110.752 -179.63 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 29.7 m-85 -57.51 -52.95 63.32 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.241 -0.912 . . . . 0.0 111.123 -179.321 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' THR . . . . . 0.406 ' OG1' ' CG1' ' B' ' 35' ' ' VAL . 22.8 m -49.73 -41.79 44.55 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 121.065 -1.022 . . . . 0.0 110.195 -179.656 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 34.4 ttt-85 -71.59 -20.87 61.94 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.187 -0.946 . . . . 0.0 109.843 179.473 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -63.49 -43.21 97.91 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.302 -0.874 . . . . 0.0 110.242 179.998 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . 0.401 ' NH1' ' HB2' ' B' ' 32' ' ' ASP . 0.0 OUTLIER -49.44 -25.71 2.77 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.198 -0.939 . . . . 0.0 110.22 179.771 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -106.29 -58.26 1.94 Allowed 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.433 -0.792 . . . . 0.0 109.777 179.611 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.501 2.098 0 O-C-N 121.624 -0.672 . . . . 0.0 110.73 179.835 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_endo . . . . . 0 N--CA 1.484 0.918 0 N-CA-C 110.518 -0.608 . . . . 0.0 110.518 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' B' B ' 9' ' ' PRO . . . . . . . . . . . . . 49.3 Cg_endo -78.61 2.17 8.39 Favored 'Trans proline' 0 C--N 1.313 -1.294 0 O-C-N 123.661 1.348 . . . . 0.0 111.418 -179.943 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . -72.03 -20.2 78.82 Favored Glycine 0 N--CA 1.491 2.3 0 N-CA-C 109.664 -1.374 . . . . 0.0 109.664 179.982 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -81.12 -16.92 51.66 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.272 -1.134 . . . . 0.0 110.519 -179.891 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 78.4 m -73.12 -36.21 66.68 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.074 -1.016 . . . . 0.0 110.374 -179.881 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -75.06 -25.23 58.49 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.277 -0.889 . . . . 0.0 110.156 179.999 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -74.02 -47.56 36.14 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.277 -0.89 . . . . 0.0 110.166 179.922 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 84.5 mt -64.08 -49.78 70.94 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.224 -0.922 . . . . 0.0 110.021 179.882 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -56.04 -42.35 76.43 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.264 -0.898 . . . . 0.0 109.871 179.764 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 17' ' ' GLY . . . . . 0.406 ' O ' ' CG ' ' B' ' 21' ' ' GLU . . . -57.92 -46.47 92.42 Favored Glycine 0 N--CA 1.49 2.257 0 N-CA-C 109.271 -1.532 . . . . 0.0 109.271 179.774 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 18' ' ' TYR . . . . . 0.411 ' HA ' ' HG3' ' B' ' 21' ' ' GLU . 39.4 t80 -63.38 -30.64 71.74 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.313 -1.11 . . . . 0.0 109.957 179.726 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 62.4 m -74.85 -27.69 60.37 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.343 -0.848 . . . . 0.0 110.237 179.993 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 87.1 t -78.1 -19.56 13.63 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.616 0 O-C-N 121.166 -0.958 . . . . 0.0 110.28 179.941 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 21' ' ' GLU . . . . . 0.447 ' OE2' ' CE1' ' B' ' 37' ' ' TYR . 0.6 OUTLIER -86.38 -45.79 10.86 Favored 'General case' 0 N--CA 1.499 1.991 0 O-C-N 121.138 -0.976 . . . . 0.0 108.895 179.605 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 22' ' ' VAL . . . . . . . . . . . . . 78.2 t -63.31 -25.67 39.0 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.541 0 CA-C-O 121.308 0.575 . . . . 0.0 110.056 179.978 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 4.4 mt -84.22 -31.6 24.95 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.26 -0.9 . . . . 0.0 110.09 179.777 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -87.6 -40.27 14.36 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.26 -0.9 . . . . 0.0 110.442 -179.847 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 1.8 tt0 -88.44 -40.85 13.17 Favored 'General case' 0 C--N 1.306 -1.303 0 O-C-N 121.28 -0.887 . . . . 0.0 110.298 -179.711 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 52.8 67.36 3.94 Favored Pre-proline 0 N--CA 1.492 1.628 0 O-C-N 121.318 -0.864 . . . . 0.0 110.211 179.945 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 27' ' ' PRO . . . . . . . . . . . . . 45.1 Cg_endo -70.94 167.45 25.95 Favored 'Trans proline' 0 C--N 1.312 -1.383 0 O-C-N 123.571 1.301 . . . . 0.0 110.558 -179.955 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 44.3 Cg_endo -71.26 -41.89 2.28 Favored 'Trans proline' 0 C--N 1.312 -1.359 0 O-C-N 123.734 1.386 . . . . 0.0 110.38 179.826 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 10.9 m-20 -123.22 120.88 34.45 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.222 -0.924 . . . . 0.0 110.164 179.935 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 2.7 tp -78.65 -31.55 46.86 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.289 -0.882 . . . . 0.0 109.898 179.747 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 46.8 t -52.63 -67.38 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.678 0 O-C-N 121.278 -0.889 . . . . 0.0 109.967 179.787 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 32' ' ' ASP . . . . . 0.401 ' HB2' ' NH1' ' A' ' 42' ' ' ARG . 1.6 t0 -55.5 -41.53 73.18 Favored 'General case' 0 C--N 1.303 -1.456 0 O-C-N 121.39 -0.819 . . . . 0.0 109.764 179.709 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 33' ' ' PHE . . . . . . . . . . . . . 59.4 t80 -58.2 -47.72 82.57 Favored 'General case' 0 N--CA 1.488 1.446 0 O-C-N 121.169 -0.957 . . . . 0.0 109.369 179.32 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -58.54 -36.92 74.63 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.346 -0.846 . . . . 0.0 109.512 179.313 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 35' ' ' VAL . . . . . 0.406 ' CG1' ' OG1' ' A' ' 39' ' ' THR . 89.1 t -75.2 -51.43 21.38 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.32 0 O-C-N 121.471 -0.768 . . . . 0.0 109.994 179.704 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 -58.96 -35.79 73.74 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.268 -0.895 . . . . 0.0 110.116 179.995 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 37' ' ' TYR . . . . . 0.447 ' CE1' ' OE2' ' B' ' 21' ' ' GLU . 43.2 t80 -62.29 -73.64 0.1 Allowed 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.295 -0.878 . . . . 0.0 110.107 179.957 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 20.9 m-85 -51.88 -45.36 64.09 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.242 -0.911 . . . . 0.0 110.521 -179.888 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 39' ' ' THR . . . . . . . . . . . . . 45.2 m -53.16 -28.53 26.67 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.174 -0.954 . . . . 0.0 110.032 179.835 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.57 -30.61 29.52 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.292 -0.88 . . . . 0.0 109.953 179.686 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.69 -36.14 75.88 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.311 -0.868 . . . . 0.0 110.123 179.922 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 42' ' ' ARG . . . . . 0.415 ' NH1' ' OD2' ' A' ' 32' ' ' ASP . 0.0 OUTLIER -52.11 -38.0 55.94 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.221 -0.924 . . . . 0.0 110.194 179.934 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 43' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 . . . . . 0 N--CA 1.49 1.561 0 O-C-N 121.272 -0.893 . . . . 0.0 110.276 179.896 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' C' C ' 2' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.491 1.605 0 CA-C-O 121.26 0.553 . . . . 0.0 110.392 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 3' ' ' ILE . . . . . . . . . . . . . 10.5 mt -63.44 -28.86 45.86 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.651 0 O-C-N 121.294 -0.879 . . . . 0.0 110.316 -179.918 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 4' ' ' GLU . . . . . . . . . . . . . 26.2 mt-10 -94.92 -20.23 19.58 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.175 -0.953 . . . . 0.0 110.352 -179.921 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 5' ' ' THR . . . . . . . . . . . . . 9.2 m -98.56 -19.67 17.47 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.29 -0.881 . . . . 0.0 110.448 -179.83 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 6' ' ' ALA . . . . . . . . . . . . . . . -77.27 -58.95 2.99 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.088 -1.007 . . . . 0.0 110.445 -179.826 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 7' ' ' SER . . . . . . . . . . . . . 2.9 t -62.19 -36.24 81.29 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.179 -0.951 . . . . 0.0 110.537 -179.718 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 8' ' ' SER . . . . . . . . . . . . . 4.2 t -65.17 -42.35 93.75 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.134 -0.978 . . . . 0.0 110.341 -179.863 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 9' ' ' LEU . . . . . . . . . . . . . 3.3 tt -70.03 -48.56 57.46 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.205 -0.934 . . . . 0.0 110.236 179.991 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 10' ' ' VAL . . . . . . . . . . . . . 87.7 t -58.77 -56.34 17.31 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.669 0 O-C-N 121.221 -0.925 . . . . 0.0 110.317 -179.923 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' C' C ' 11' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -52.2 -40.02 60.98 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.28 -0.887 . . . . 0.0 110.474 -179.795 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' C' C ' 12' ' ' ASN . . . . . . . . . . . . . 28.7 t30 . . . . . 0 N--CA 1.492 1.63 0 O-C-N 121.174 -0.954 . . . . 0.0 110.381 -179.895 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.333 0 N-CA-C 109.65 -1.38 . . . . 0.0 109.65 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 49.0 tp -58.52 -27.2 64.3 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.294 -1.121 . . . . 0.0 110.538 -179.889 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 86.6 m -68.37 -30.78 69.8 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.218 -0.926 . . . . 0.0 110.74 -179.658 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -76.8 -39.74 50.42 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.119 -0.988 . . . . 0.0 110.507 -179.66 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 7.7 tt -71.46 -36.76 71.31 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.13 -0.981 . . . . 0.0 110.511 -179.741 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 2.0 tp -65.55 -57.43 8.22 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.182 -0.949 . . . . 0.0 110.587 -179.708 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -50.58 -34.88 27.48 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.129 -0.982 . . . . 0.0 110.242 -179.901 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -62.89 -50.13 66.42 Favored Glycine 0 N--CA 1.49 2.236 0 N-CA-C 109.245 -1.542 . . . . 0.0 109.245 179.651 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 30.6 t80 -56.12 -41.46 75.33 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.244 -1.15 . . . . 0.0 110.119 179.807 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 57.6 m -61.52 -37.67 84.57 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.321 -0.862 . . . . 0.0 110.59 -179.803 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 98.5 t -69.12 -22.09 25.82 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.72 0 O-C-N 121.264 -0.897 . . . . 0.0 110.437 -179.705 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.419 ' OE2' ' CE1' ' A' ' 37' ' ' TYR . 1.2 mt-10 -88.18 -48.48 7.67 Favored 'General case' 0 N--CA 1.499 2.016 0 O-C-N 121.209 -0.932 . . . . 0.0 108.818 179.666 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 64.7 t -48.98 -31.63 4.2 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.473 0 O-C-N 121.75 -0.594 . . . . 0.0 110.339 179.936 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.403 ' CD1' ' CD1' ' C' ' 2' ' ' LEU . 0.1 OUTLIER -85.76 -40.15 16.38 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.268 -0.895 . . . . 0.0 110.158 -179.956 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -74.81 -52.66 10.83 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.169 -0.957 . . . . 0.0 110.289 179.933 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . 0.434 ' O ' ' CG ' ' A' ' 26' ' ' GLN . 3.8 mp0 -73.89 -19.4 60.72 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.225 -0.922 . . . . 0.0 110.603 -179.914 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . 0.434 ' CG ' ' O ' ' A' ' 25' ' ' GLN . 21.5 pt20 36.64 61.38 3.31 Favored Pre-proline 0 N--CA 1.506 2.343 0 O-C-N 121.937 -0.477 . . . . 0.0 111.912 -179.936 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . 0.474 ' HG3' ' CD2' ' A' ' 33' ' ' PHE . 44.1 Cg_endo -71.08 154.69 62.32 Favored 'Trans proline' 0 C--N 1.311 -1.4 0 O-C-N 123.564 1.297 . . . . 0.0 110.537 -179.957 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 46.2 Cg_endo -72.77 -42.69 1.05 Allowed 'Trans proline' 0 C--N 1.312 -1.387 0 O-C-N 123.734 1.386 . . . . 0.0 110.37 179.876 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 14.2 m-20 -113.85 122.89 48.4 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.31 -0.868 . . . . 0.0 110.14 179.887 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -75.48 -47.11 28.57 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.169 -0.957 . . . . 0.0 110.195 179.971 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 39.9 t -50.28 -60.98 0.69 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.786 0 O-C-N 121.177 -0.952 . . . . 0.0 109.797 179.702 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 5.1 t0 -58.86 -39.51 81.56 Favored 'General case' 0 C--N 1.302 -1.49 0 O-C-N 121.653 -0.655 . . . . 0.0 109.808 179.526 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . 0.474 ' CD2' ' HG3' ' A' ' 27' ' ' PRO . 36.9 t80 -62.54 -46.58 87.74 Favored 'General case' 0 N--CA 1.488 1.436 0 O-C-N 121.163 -0.961 . . . . 0.0 109.526 179.44 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . 0.452 ' HB2' ' CD2' ' B' ' 38' ' ' PHE . . . -56.13 -40.94 74.56 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.388 -0.82 . . . . 0.0 110.123 179.79 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 97.9 t -64.74 -43.95 96.51 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.337 0 O-C-N 121.151 -0.968 . . . . 0.0 110.146 -179.979 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -63.04 -35.0 78.77 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.28 -0.887 . . . . 0.0 110.103 179.859 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . 0.419 ' CE1' ' OE2' ' A' ' 21' ' ' GLU . 20.4 t80 -69.08 -60.42 2.37 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.233 -0.917 . . . . 0.0 110.367 -179.841 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 28.5 m-85 -61.68 -49.2 77.43 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.282 -0.886 . . . . 0.0 110.322 -179.791 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 55.7 m -51.79 -41.39 61.65 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.195 -0.941 . . . . 0.0 110.22 179.965 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 2.9 mtp180 -72.61 -30.22 64.17 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.235 -0.916 . . . . 0.0 109.963 179.766 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 1.4 tt -56.73 -40.89 76.51 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.353 -0.842 . . . . 0.0 110.085 179.914 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -51.54 -29.02 15.4 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.227 -0.92 . . . . 0.0 110.438 179.999 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 -106.86 -2.93 20.86 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.232 -0.917 . . . . 0.0 110.88 -179.931 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 1.684 0 O-C-N 120.947 -1.095 . . . . 0.0 110.28 179.928 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 46.0 Cg_endo . . . . . 0 N--CA 1.484 0.925 0 N-CA-C 110.417 -0.647 . . . . 0.0 110.417 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' B' B ' 9' ' ' PRO . . . . . . . . . . . . . 48.2 Cg_endo -72.81 -174.88 1.65 Allowed 'Trans proline' 0 C--N 1.312 -1.345 0 O-C-N 123.559 1.294 . . . . 0.0 110.273 179.931 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 102.59 -38.28 3.28 Favored Glycine 0 N--CA 1.491 2.328 0 N-CA-C 109.296 -1.522 . . . . 0.0 109.296 -179.985 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -59.03 -36.49 75.08 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.327 -1.102 . . . . 0.0 110.09 179.962 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 22.1 m -51.93 -63.04 1.27 Allowed 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.234 -0.916 . . . . 0.0 110.302 179.895 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -57.6 -23.34 50.37 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.324 -0.86 . . . . 0.0 110.19 179.943 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -78.97 -33.74 44.86 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.234 -0.916 . . . . 0.0 110.087 179.965 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 4.9 mp -80.27 -47.13 15.05 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.237 -0.914 . . . . 0.0 110.122 179.963 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -53.73 -45.87 70.66 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.268 -0.895 . . . . 0.0 109.818 179.648 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 17' ' ' GLY . . . . . 0.412 ' O ' ' CG ' ' B' ' 21' ' ' GLU . . . -60.93 -50.96 61.78 Favored Glycine 0 N--CA 1.49 2.247 0 N-CA-C 109.293 -1.523 . . . . 0.0 109.293 179.632 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 18' ' ' TYR . . . . . . . . . . . . . 25.8 t80 -53.72 -31.95 50.19 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.322 -1.104 . . . . 0.0 110.103 179.809 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 88.8 m -75.83 -29.31 58.58 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.37 -0.831 . . . . 0.0 110.13 179.949 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 39.9 t -78.5 -19.58 13.3 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.664 0 O-C-N 121.327 -0.858 . . . . 0.0 110.252 -179.982 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 21' ' ' GLU . . . . . 0.448 ' OE1' ' CE1' ' B' ' 37' ' ' TYR . 1.3 mt-10 -87.07 -42.62 12.93 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.243 -0.911 . . . . 0.0 108.868 179.851 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 22' ' ' VAL . . . . . . . . . . . . . 51.9 t -64.52 -29.37 47.16 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.508 0 O-C-N 121.743 -0.598 . . . . 0.0 110.13 -179.918 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 1.4 mt -75.78 -48.13 22.96 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.315 -0.866 . . . . 0.0 110.064 179.798 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 7.1 mpt_? -69.3 -70.68 0.26 Allowed 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.249 -0.907 . . . . 0.0 110.113 179.898 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -51.83 -41.02 61.47 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.237 -0.914 . . . . 0.0 110.408 179.94 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER 52.15 66.21 5.34 Favored Pre-proline 0 N--CA 1.491 1.601 0 O-C-N 121.408 -0.808 . . . . 0.0 110.381 179.945 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 27' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_endo -71.35 159.99 50.05 Favored 'Trans proline' 0 C--N 1.311 -1.44 0 O-C-N 123.638 1.336 . . . . 0.0 110.531 179.873 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 44.7 Cg_endo -71.49 -35.23 8.39 Favored 'Trans proline' 0 C--N 1.311 -1.445 0 O-C-N 123.742 1.39 . . . . 0.0 110.27 179.771 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 29' ' ' ASP . . . . . 0.418 ' N ' ' OD1' ' B' ' 29' ' ' ASP . 38.2 p-10 -132.5 114.53 14.39 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.357 -0.839 . . . . 0.0 110.256 179.722 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 4.2 tp -67.91 -31.34 71.05 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.325 -0.86 . . . . 0.0 110.444 -179.829 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 44.6 t -49.77 -56.51 3.21 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.751 0 O-C-N 121.174 -0.954 . . . . 0.0 110.088 179.718 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -64.0 -45.63 88.12 Favored 'General case' 0 C--N 1.302 -1.482 0 O-C-N 121.577 -0.702 . . . . 0.0 110.102 179.919 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 33' ' ' PHE . . . . . . . . . . . . . 74.8 t80 -57.56 -40.07 78.1 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.045 -1.034 . . . . 0.0 109.628 179.519 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -60.99 -43.67 98.51 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.338 -0.851 . . . . 0.0 109.992 179.668 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 35' ' ' VAL . . . . . . . . . . . . . 58.9 t -70.53 -40.79 77.75 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.289 0 O-C-N 121.251 -0.906 . . . . 0.0 110.072 179.77 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -74.03 -21.58 59.9 Favored 'General case' 0 N--CA 1.487 1.404 0 O-C-N 121.293 -0.879 . . . . 0.0 109.712 179.961 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 37' ' ' TYR . . . . . 0.448 ' CE1' ' OE1' ' B' ' 21' ' ' GLU . 28.3 t80 -79.58 -64.46 1.18 Allowed 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.119 -0.988 . . . . 0.0 110.515 -179.864 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 38' ' ' PHE . . . . . 0.452 ' CD2' ' HB2' ' A' ' 34' ' ' ALA . 22.8 m-85 -60.04 -46.88 88.06 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.265 -0.897 . . . . 0.0 110.656 -179.613 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 39' ' ' THR . . . . . . . . . . . . . 72.9 m -53.68 -54.89 31.47 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.096 -1.002 . . . . 0.0 110.152 179.952 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 41.8 ttt180 -62.7 -22.62 66.63 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.225 -0.922 . . . . 0.0 110.019 179.688 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -59.67 -51.01 71.63 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.317 -0.864 . . . . 0.0 110.063 179.943 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -50.41 -24.93 3.39 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.22 -0.925 . . . . 0.0 110.545 179.969 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 43' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.624 0 O-C-N 121.248 -0.907 . . . . 0.0 110.872 -179.669 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 2' ' ' LEU . . . . . 0.403 ' CD1' ' CD1' ' A' ' 23' ' ' LEU . 67.7 tp . . . . . 0 N--CA 1.492 1.637 0 CA-C-O 121.238 0.542 . . . . 0.0 110.162 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 3' ' ' ILE . . . . . . . . . . . . . 47.2 mm -75.71 -36.73 34.42 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.576 0 O-C-N 121.213 -0.929 . . . . 0.0 110.19 -179.969 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 4' ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 -74.98 -3.91 35.12 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.34 -0.85 . . . . 0.0 110.747 -179.971 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 5' ' ' THR . . . . . . . . . . . . . 2.3 p -105.72 -66.58 0.98 Allowed 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.051 -1.03 . . . . 0.0 110.209 -179.915 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 6' ' ' ALA . . . . . . . . . . . . . . . -54.26 -43.78 71.27 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.318 -0.864 . . . . 0.0 110.205 -179.928 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 7' ' ' SER . . . . . 0.414 ' O ' ' CG1' ' C' ' 10' ' ' VAL . 8.5 t -57.64 -25.31 59.98 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.202 -0.936 . . . . 0.0 110.106 179.951 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' C' C ' 8' ' ' SER . . . . . . . . . . . . . 47.4 t -83.27 -24.5 32.23 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.268 -0.895 . . . . 0.0 110.051 179.84 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 9' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -75.97 -34.61 59.79 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.352 -0.843 . . . . 0.0 110.098 179.993 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' C' C ' 10' ' ' VAL . . . . . 0.414 ' CG1' ' O ' ' C' ' 7' ' ' SER . 6.4 p -67.7 -24.21 30.63 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.56 0 O-C-N 121.311 -0.868 . . . . 0.0 110.072 179.916 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' C' C ' 11' ' ' LYS . . . . . . . . . . . . . 1.2 ttmt -76.17 -47.01 25.79 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.264 -0.898 . . . . 0.0 110.039 179.776 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' C' C ' 12' ' ' ASN . . . . . . . . . . . . . 96.2 m-20 . . . . . 0 N--CA 1.492 1.632 0 O-C-N 121.286 -0.884 . . . . 0.0 110.407 179.68 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.269 0 N-CA-C 109.34 -1.504 . . . . 0.0 109.34 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 7.1 tt -66.23 -26.6 67.45 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.219 -1.165 . . . . 0.0 110.095 179.924 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 63.4 m -74.24 -28.98 61.49 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.293 -0.879 . . . . 0.0 110.055 179.868 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -71.51 -41.32 69.38 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.358 -0.839 . . . . 0.0 110.008 179.864 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 28.1 tp -72.72 -41.76 64.86 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.31 -0.869 . . . . 0.0 110.071 179.902 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -58.03 -50.02 74.85 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.2 -0.937 . . . . 0.0 110.116 179.902 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 3.3 mt-30 -55.04 -43.3 73.64 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.207 -0.933 . . . . 0.0 109.698 179.731 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -53.24 -36.69 53.24 Favored Glycine 0 N--CA 1.493 2.486 0 N-CA-C 109.185 -1.566 . . . . 0.0 109.185 179.486 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . 0.403 ' O ' ' CG2' ' A' ' 22' ' ' VAL . 28.2 t80 -69.91 -54.63 12.54 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.441 -1.034 . . . . 0.0 109.363 179.307 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' THR . . . . . 0.402 ' O ' ' CD1' ' A' ' 23' ' ' LEU . 47.8 m -52.47 -27.65 17.06 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.373 -0.829 . . . . 0.0 109.982 179.373 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 43.9 t -71.54 -74.9 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.61 0 O-C-N 121.419 -0.801 . . . . 0.0 109.83 179.812 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.433 ' O ' ' CG ' ' A' ' 25' ' ' GLN . 21.8 pt-20 -48.54 -42.93 34.83 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.378 -0.826 . . . . 0.0 110.77 -179.665 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.414 ' N ' ' HG3' ' A' ' 21' ' ' GLU . 97.1 t -55.2 -39.0 49.24 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.649 0 O-C-N 121.145 -0.972 . . . . 0.0 110.38 -179.815 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.402 ' CD1' ' O ' ' A' ' 19' ' ' THR . 30.7 mt -88.65 -22.71 23.3 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.211 -0.931 . . . . 0.0 110.295 -179.88 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -81.24 -37.63 28.25 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.189 -0.945 . . . . 0.0 110.264 179.994 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . 0.508 ' NE2' ' CE1' ' A' ' 33' ' ' PHE . 0.0 OUTLIER -105.72 -20.19 13.53 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.18 -0.95 . . . . 0.0 110.34 179.84 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . 0.426 ' N ' ' HG3' ' A' ' 25' ' ' GLN . 0.9 OUTLIER 47.82 83.23 0.22 Allowed Pre-proline 0 N--CA 1.494 1.735 0 O-C-N 121.197 -0.939 . . . . 0.0 110.655 -179.983 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 46.1 Cg_endo -72.91 160.83 45.13 Favored 'Trans proline' 0 C--N 1.311 -1.416 0 O-C-N 123.749 1.394 . . . . 0.0 110.446 179.957 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 43.0 Cg_endo -69.52 -25.39 29.77 Favored 'Trans proline' 0 C--N 1.312 -1.367 0 O-C-N 123.653 1.344 . . . . 0.0 110.256 179.936 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 33.3 m-20 -148.9 114.03 5.49 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.418 -0.801 . . . . 0.0 109.935 179.851 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -57.38 -52.2 66.31 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.33 -0.856 . . . . 0.0 110.11 -179.866 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 60.8 t -49.01 -62.14 0.49 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.699 0 O-C-N 121.291 -0.881 . . . . 0.0 110.15 179.742 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -55.91 -36.49 67.74 Favored 'General case' 0 C--N 1.3 -1.565 0 O-C-N 121.548 -0.72 . . . . 0.0 109.658 179.491 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . 0.508 ' CE1' ' NE2' ' A' ' 25' ' ' GLN . 55.5 t80 -66.1 -50.53 63.73 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.269 -0.895 . . . . 0.0 109.537 179.393 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -56.27 -38.51 71.29 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.397 -0.814 . . . . 0.0 109.798 179.535 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 91.2 t -73.03 -34.57 46.05 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.339 0 O-C-N 121.373 -0.829 . . . . 0.0 109.993 179.782 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -80.43 -31.69 37.48 Favored 'General case' 0 C--N 1.303 -1.447 0 O-C-N 121.308 -0.87 . . . . 0.0 109.675 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 78.3 t80 -75.01 -65.3 0.89 Allowed 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.129 -0.982 . . . . 0.0 110.386 -179.859 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 12.9 m-85 -52.9 -49.56 65.69 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.228 -0.92 . . . . 0.0 110.626 -179.523 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 35.9 m -52.88 -37.71 60.81 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 120.989 -1.07 . . . . 0.0 110.037 179.944 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -72.35 -27.25 62.28 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.171 -0.955 . . . . 0.0 110.056 179.646 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 1.1 tt -65.35 -34.0 77.3 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.277 -0.89 . . . . 0.0 110.04 179.892 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.16 -24.15 62.8 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.299 -0.875 . . . . 0.0 109.894 179.72 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -76.7 -56.78 4.3 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.317 -0.864 . . . . 0.0 110.118 179.939 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.599 0 O-C-N 121.326 -0.859 . . . . 0.0 110.172 179.813 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 49.0 Cg_endo . . . . . 0 N--CA 1.485 1.013 0 N-CA-C 110.317 -0.686 . . . . 0.0 110.317 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' B' B ' 9' ' ' PRO . . . . . . . . . . . . . 49.5 Cg_endo -74.43 153.97 45.11 Favored 'Trans proline' 0 C--N 1.311 -1.397 0 O-C-N 123.497 1.261 . . . . 0.0 110.477 -179.968 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 111.58 -25.05 14.04 Favored Glycine 0 N--CA 1.49 2.292 0 N-CA-C 109.553 -1.419 . . . . 0.0 109.553 179.889 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -69.05 -22.91 64.0 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.224 -1.162 . . . . 0.0 110.214 -179.986 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 91.6 m -78.96 -35.11 43.65 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.159 -0.963 . . . . 0.0 110.281 -179.956 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 28.1 mt-10 -65.88 -44.25 85.88 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.191 -0.943 . . . . 0.0 110.389 -179.928 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -67.89 -32.87 73.65 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.239 -0.913 . . . . 0.0 110.545 -179.803 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 2.5 mp -77.76 -42.32 34.51 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.192 -0.943 . . . . 0.0 110.559 -179.733 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -53.16 -44.03 67.5 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.035 -1.041 . . . . 0.0 110.011 179.93 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 17' ' ' GLY . . . . . . . . . . . . . . . -62.26 -51.42 56.72 Favored Glycine 0 N--CA 1.489 2.2 0 N-CA-C 109.346 -1.502 . . . . 0.0 109.346 179.902 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 18' ' ' TYR . . . . . 0.432 ' CD1' ' CD2' ' B' ' 37' ' ' TYR . 16.3 t80 -56.12 -33.78 65.46 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.341 -1.093 . . . . 0.0 110.279 179.895 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 62.6 m -71.55 -31.76 67.36 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.26 -0.9 . . . . 0.0 110.354 -179.887 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 48.6 t -75.14 -17.47 16.07 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.645 0 O-C-N 121.271 -0.893 . . . . 0.0 110.487 -179.885 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 21' ' ' GLU . . . . . 0.416 ' OE1' ' CE1' ' B' ' 37' ' ' TYR . 0.8 OUTLIER -89.15 -50.31 6.23 Favored 'General case' 0 N--CA 1.497 1.92 0 O-C-N 121.137 -0.977 . . . . 0.0 109.281 179.906 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 22' ' ' VAL . . . . . . . . . . . . . 23.8 t -60.79 -24.59 32.81 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.515 0 O-C-N 121.776 -0.577 . . . . 0.0 110.323 -179.637 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 6.8 mt -90.15 -31.65 16.99 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.214 -0.929 . . . . 0.0 110.492 -179.835 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -87.4 -51.71 5.79 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.189 -0.944 . . . . 0.0 110.591 -179.643 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 25' ' ' GLN . . . . . 0.407 ' O ' ' CG ' ' B' ' 26' ' ' GLN . 14.0 tp60 -85.15 -19.77 31.26 Favored 'General case' 0 N--CA 1.486 1.335 0 O-C-N 121.146 -0.971 . . . . 0.0 110.477 -179.557 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 26' ' ' GLN . . . . . 0.407 ' CG ' ' O ' ' B' ' 25' ' ' GLN . 9.0 pt20 36.26 74.82 0.55 Allowed Pre-proline 0 N--CA 1.507 2.376 0 O-C-N 121.81 -0.556 . . . . 0.0 111.893 -179.92 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 27' ' ' PRO . . . . . . . . . . . . . 44.4 Cg_endo -70.04 166.94 26.26 Favored 'Trans proline' 0 C--N 1.311 -1.429 0 O-C-N 123.532 1.28 . . . . 0.0 110.565 179.887 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 45.4 Cg_endo -71.79 -52.96 0.18 Allowed 'Trans proline' 0 C--N 1.313 -1.317 0 O-C-N 123.611 1.322 . . . . 0.0 110.551 -179.969 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -114.66 122.26 45.92 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.225 -0.922 . . . . 0.0 110.195 -179.899 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 3.8 tp -74.59 -39.44 62.2 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.194 -0.941 . . . . 0.0 110.264 179.957 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 86.2 t -49.73 -66.81 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.711 0 O-C-N 121.169 -0.957 . . . . 0.0 110.097 179.726 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 1.5 t0 -56.28 -38.44 71.19 Favored 'General case' 0 C--N 1.301 -1.536 0 O-C-N 121.626 -0.671 . . . . 0.0 110.101 179.744 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 33' ' ' PHE . . . . . . . . . . . . . 69.5 t80 -62.95 -44.38 96.22 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.215 -0.928 . . . . 0.0 109.845 179.747 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -56.44 -31.93 64.42 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.206 -0.934 . . . . 0.0 109.78 179.65 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 35' ' ' VAL . . . . . . . . . . . . . 89.9 t -73.91 -53.57 17.27 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.37 0 O-C-N 121.303 -0.873 . . . . 0.0 110.097 179.8 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -59.55 -24.75 63.97 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.342 -0.849 . . . . 0.0 110.491 -179.779 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 37' ' ' TYR . . . . . 0.432 ' CD2' ' CD1' ' B' ' 18' ' ' TYR . 14.2 t80 -78.66 -69.03 0.59 Allowed 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.191 -0.943 . . . . 0.0 110.54 -179.751 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 26.0 m-85 -53.53 -39.24 64.53 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.2 -0.937 . . . . 0.0 110.165 -179.832 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 39' ' ' THR . . . . . . . . . . . . . 55.2 m -57.71 -49.91 74.97 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.145 -0.972 . . . . 0.0 109.901 179.835 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.0 -24.1 65.08 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.222 -0.924 . . . . 0.0 109.936 179.873 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -69.52 -31.48 69.74 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.352 -0.843 . . . . 0.0 110.128 179.807 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -74.26 -40.73 62.16 Favored 'General case' 0 C--N 1.305 -1.352 0 O-C-N 121.329 -0.857 . . . . 0.0 109.688 179.916 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 43' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 . . . . . 0 N--CA 1.492 1.627 0 O-C-N 121.329 -0.857 . . . . 0.0 110.36 179.838 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' C' C ' 2' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.492 1.654 0 CA-C-O 121.256 0.551 . . . . 0.0 110.159 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 3' ' ' ILE . . . . . . . . . . . . . 1.5 tt -70.09 -18.07 21.44 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.66 0 O-C-N 121.319 -0.863 . . . . 0.0 110.462 -179.878 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 4' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -78.95 -44.13 23.12 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.112 -0.993 . . . . 0.0 110.32 -179.861 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 5' ' ' THR . . . . . 0.449 ' CG2' ' N ' ' C' ' 6' ' ' ALA . 13.5 t -83.17 -41.83 18.01 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.269 -0.894 . . . . 0.0 110.211 -179.754 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' C' C ' 6' ' ' ALA . . . . . 0.449 ' N ' ' CG2' ' C' ' 5' ' ' THR . . . -54.58 -45.63 73.61 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.441 -0.787 . . . . 0.0 110.295 -179.998 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' C' C ' 7' ' ' SER . . . . . . . . . . . . . 61.4 p -75.69 -28.42 58.64 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.211 -0.931 . . . . 0.0 110.337 -179.944 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 8' ' ' SER . . . . . . . . . . . . . 12.6 t -79.5 -33.31 42.24 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.309 -0.869 . . . . 0.0 110.363 -179.953 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 9' ' ' LEU . . . . . . . . . . . . . 7.1 tt -66.52 -53.0 39.78 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.191 -0.943 . . . . 0.0 110.361 -179.83 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 10' ' ' VAL . . . . . . . . . . . . . 25.8 m -58.62 -26.15 30.48 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.693 0 O-C-N 121.282 -0.887 . . . . 0.0 110.291 -179.795 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 11' ' ' LYS . . . . . . . . . . . . . 1.2 ttmm -68.94 -52.39 29.72 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.328 -0.857 . . . . 0.0 110.311 -179.806 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' C' C ' 12' ' ' ASN . . . . . . . . . . . . . 13.8 t30 . . . . . 0 N--CA 1.491 1.622 0 O-C-N 121.195 -0.941 . . . . 0.0 110.513 -179.979 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.325 0 N-CA-C 109.63 -1.388 . . . . 0.0 109.63 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -66.66 -32.48 73.83 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.218 -1.166 . . . . 0.0 110.242 179.997 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 65.9 m -57.42 -63.18 1.32 Allowed 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.268 -0.895 . . . . 0.0 110.355 -179.806 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -51.0 -41.15 59.58 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.295 -0.878 . . . . 0.0 110.533 -179.86 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -64.32 -42.79 96.15 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.317 -0.865 . . . . 0.0 110.28 -179.891 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 59.8 mt -70.24 -47.4 61.53 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.195 -0.941 . . . . 0.0 110.14 -179.934 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -54.49 -39.91 68.0 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.158 -0.964 . . . . 0.0 109.947 179.882 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -57.04 -49.81 68.93 Favored Glycine 0 N--CA 1.49 2.266 0 N-CA-C 109.202 -1.559 . . . . 0.0 109.202 179.671 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 23.7 t80 -58.65 -21.39 53.88 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.358 -1.083 . . . . 0.0 110.109 179.729 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 1.3 m -82.77 -28.57 30.26 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.285 -0.884 . . . . 0.0 110.077 -179.992 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 61.6 t -79.92 -18.1 12.6 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.701 0 O-C-N 121.356 -0.84 . . . . 0.0 110.294 179.997 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -90.79 -46.99 7.9 Favored 'General case' 0 N--CA 1.499 1.986 0 O-C-N 121.131 -0.981 . . . . 0.0 109.09 179.939 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 86.1 t -59.71 -38.52 76.25 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.512 0 O-C-N 121.669 -0.644 . . . . 0.0 110.029 -179.976 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -75.87 -36.28 59.61 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.347 -0.846 . . . . 0.0 109.959 179.701 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.98 -26.12 53.54 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.288 -0.883 . . . . 0.0 110.233 179.928 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 73.4 mm-40 -97.96 -38.58 9.34 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.257 -0.902 . . . . 0.0 110.409 -179.856 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 1.7 mt-30 53.35 56.54 13.93 Favored Pre-proline 0 N--CA 1.492 1.634 0 O-C-N 121.247 -0.908 . . . . 0.0 110.028 -179.834 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 45.0 Cg_endo -71.09 156.9 58.96 Favored 'Trans proline' 0 C--N 1.312 -1.387 0 O-C-N 123.757 1.399 . . . . 0.0 110.606 -179.798 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 44.6 Cg_endo -70.93 -21.31 28.22 Favored 'Trans proline' 0 C--N 1.312 -1.371 0 O-C-N 123.768 1.404 . . . . 0.0 110.469 179.9 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 4.4 p-10 -139.36 123.61 18.03 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.28 -0.888 . . . . 0.0 110.204 179.987 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 5.3 tp -88.82 -31.04 18.52 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.2 -0.938 . . . . 0.0 110.125 179.851 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 42.9 t -50.71 -58.4 1.83 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.769 0 O-C-N 121.27 -0.894 . . . . 0.0 110.124 179.865 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 8.0 t0 -64.23 -42.88 96.36 Favored 'General case' 0 C--N 1.302 -1.487 0 O-C-N 121.509 -0.745 . . . . 0.0 110.12 179.87 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 89.4 t80 -61.57 -40.32 94.31 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.212 -0.93 . . . . 0.0 109.904 179.722 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -56.72 -37.28 70.74 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.279 -0.888 . . . . 0.0 110.204 179.905 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . 0.405 ' O ' ' CB ' ' A' ' 39' ' ' THR . 90.1 t -74.18 -37.79 46.93 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.346 0 O-C-N 121.277 -0.889 . . . . 0.0 110.403 -179.798 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -68.76 -37.95 79.74 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.187 -0.945 . . . . 0.0 110.507 -179.819 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 33.0 t80 -63.99 -56.76 12.74 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.222 -0.924 . . . . 0.0 110.592 -179.691 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 20.0 m-85 -68.15 -48.75 64.52 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.252 -0.905 . . . . 0.0 110.908 -179.391 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' THR . . . . . 0.405 ' CB ' ' O ' ' A' ' 35' ' ' VAL . 55.5 m -52.17 -46.73 65.61 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.048 -1.033 . . . . 0.0 110.209 -179.786 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 7.1 ttt-85 -64.13 -29.0 70.15 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.199 -0.938 . . . . 0.0 110.018 179.83 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -64.82 -28.27 69.45 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.338 -0.851 . . . . 0.0 110.279 179.982 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.07 -22.02 62.17 Favored 'General case' 0 C--N 1.306 -1.307 0 O-C-N 121.212 -0.93 . . . . 0.0 109.853 179.871 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -106.8 -12.52 15.49 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.228 -0.92 . . . . 0.0 110.549 179.9 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.668 0 O-C-N 121.08 -1.012 . . . . 0.0 110.705 -179.782 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 48.8 Cg_endo . . . . . 0 N--CA 1.486 1.033 0 N-CA-C 110.614 -0.572 . . . . 0.0 110.614 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' B' B ' 9' ' ' PRO . . . . . . . . . . . . . 48.3 Cg_endo -75.14 -172.91 1.4 Allowed 'Trans proline' 0 C--N 1.312 -1.355 0 O-C-N 123.551 1.29 . . . . 0.0 110.33 179.797 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 94.37 -18.88 56.07 Favored Glycine 0 N--CA 1.491 2.335 0 N-CA-C 109.822 -1.311 . . . . 0.0 109.822 -179.963 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 3.3 tt -88.53 -19.32 26.53 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.183 -1.186 . . . . 0.0 110.367 -180.0 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 64.8 m -63.55 -50.55 69.05 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.193 -0.942 . . . . 0.0 110.398 -179.88 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -51.53 -34.52 36.67 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.302 -0.874 . . . . 0.0 110.34 -179.892 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -69.14 -55.69 9.92 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.294 -0.879 . . . . 0.0 110.145 179.983 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -55.35 -41.2 72.19 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.214 -0.929 . . . . 0.0 109.919 179.872 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 1.7 tt0 -59.29 -39.23 82.34 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.233 -0.917 . . . . 0.0 109.734 179.679 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 17' ' ' GLY . . . . . . . . . . . . . . . -62.39 -39.67 98.07 Favored Glycine 0 N--CA 1.489 2.225 0 N-CA-C 109.152 -1.579 . . . . 0.0 109.152 179.621 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 18' ' ' TYR . . . . . . . . . . . . . 16.8 t80 -71.56 -43.91 65.5 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.261 -1.14 . . . . 0.0 109.935 179.676 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 10.3 m -53.55 -35.42 60.72 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.346 -0.846 . . . . 0.0 109.919 179.683 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 42.2 t -69.76 -73.62 0.1 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.614 0 O-C-N 121.364 -0.835 . . . . 0.0 109.904 179.769 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 7.8 pt-20 -46.75 -42.96 17.66 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.449 -0.782 . . . . 0.0 110.912 -179.752 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 22' ' ' VAL . . . . . . . . . . . . . 55.1 t -57.47 -36.25 52.71 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.622 0 O-C-N 121.108 -0.995 . . . . 0.0 109.506 179.445 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 8.2 tp -89.47 -22.32 22.54 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.347 -0.846 . . . . 0.0 109.964 179.612 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -86.85 -61.89 1.63 Allowed 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.268 -0.895 . . . . 0.0 110.139 179.782 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 29.5 mm-40 -58.84 -33.09 70.03 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.313 -0.867 . . . . 0.0 110.271 179.968 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER 49.7 59.92 16.05 Favored Pre-proline 0 N--CA 1.492 1.656 0 O-C-N 121.326 -0.859 . . . . 0.0 110.411 -179.903 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 27' ' ' PRO . . . . . . . . . . . . . 45.3 Cg_endo -71.52 158.52 53.67 Favored 'Trans proline' 0 C--N 1.311 -1.446 0 O-C-N 123.81 1.427 . . . . 0.0 110.523 -179.859 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 44.0 Cg_endo -70.16 -37.9 7.6 Favored 'Trans proline' 0 C--N 1.311 -1.435 0 O-C-N 123.704 1.371 . . . . 0.0 110.113 179.769 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -127.47 119.35 25.9 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.286 -0.884 . . . . 0.0 109.924 179.677 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 5.0 tp -73.49 -29.85 62.77 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.249 -0.907 . . . . 0.0 110.299 -179.731 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 42.0 t -52.19 -64.79 0.34 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.664 0 O-C-N 121.177 -0.952 . . . . 0.0 110.052 179.749 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 11.8 t0 -56.7 -42.6 79.41 Favored 'General case' 0 C--N 1.302 -1.458 0 O-C-N 121.444 -0.785 . . . . 0.0 110.171 179.806 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 33' ' ' PHE . . . . . . . . . . . . . 22.9 t80 -60.06 -53.58 56.1 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.163 -0.96 . . . . 0.0 109.783 179.497 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -51.01 -33.31 24.39 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.369 -0.832 . . . . 0.0 110.296 179.679 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 35' ' ' VAL . . . . . . . . . . . . . 88.9 t -79.44 -41.54 22.51 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.406 0 O-C-N 121.166 -0.959 . . . . 0.0 110.222 179.946 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -66.51 -39.04 88.47 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.307 -0.871 . . . . 0.0 110.548 -179.783 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 37' ' ' TYR . . . . . . . . . . . . . 61.1 t80 -67.14 -66.72 0.52 Allowed 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.136 -0.978 . . . . 0.0 110.423 -179.691 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 10.6 m-85 -51.26 -48.84 62.08 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.142 -0.974 . . . . 0.0 110.519 -179.586 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 39' ' ' THR . . . . . . . . . . . . . 45.6 m -53.75 -32.44 52.27 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.096 -1.003 . . . . 0.0 109.905 179.961 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -76.14 -30.5 58.18 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.174 -0.954 . . . . 0.0 109.775 179.589 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -61.9 -28.64 69.65 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.318 -0.864 . . . . 0.0 109.823 179.563 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.43 -22.11 65.53 Favored 'General case' 0 C--N 1.304 -1.391 0 O-C-N 121.363 -0.836 . . . . 0.0 109.91 179.793 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 43' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.491 1.608 0 O-C-N 121.27 -0.894 . . . . 0.0 110.198 -179.884 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 2' ' ' LEU . . . . . . . . . . . . . 1.1 pp . . . . . 0 N--CA 1.492 1.633 0 CA-C-O 121.31 0.576 . . . . 0.0 110.155 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' C' C ' 3' ' ' ILE . . . . . . . . . . . . . 5.3 mt -58.28 -58.05 8.17 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.64 0 O-C-N 121.295 -0.878 . . . . 0.0 110.176 179.912 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 4' ' ' GLU . . . . . . . . . . . . . 6.8 tm-20 -53.36 -41.18 65.56 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.204 -0.935 . . . . 0.0 109.968 179.976 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 5' ' ' THR . . . . . . . . . . . . . 1.3 m -63.32 -34.08 76.91 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.289 -0.882 . . . . 0.0 109.892 179.886 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 6' ' ' ALA . . . . . . . . . . . . . . . -75.77 -32.62 60.02 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.281 -0.887 . . . . 0.0 110.101 179.934 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 7' ' ' SER . . . . . . . . . . . . . 27.8 t -68.6 -34.53 75.93 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.192 -0.943 . . . . 0.0 110.187 179.899 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 8' ' ' SER . . . . . . . . . . . . . 46.7 t -67.94 -32.96 73.77 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.341 -0.85 . . . . 0.0 110.285 179.89 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 9' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -68.35 -36.02 78.62 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.176 -0.952 . . . . 0.0 110.17 179.919 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' C' C ' 10' ' ' VAL . . . . . . . . . . . . . 95.0 t -57.53 -44.25 84.59 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 O-C-N 121.293 -0.879 . . . . 0.0 110.125 -179.978 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' C' C ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.18 -55.38 34.54 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.377 -0.827 . . . . 0.0 110.192 179.951 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' C' C ' 12' ' ' ASN . . . . . . . . . . . . . 1.2 m-80 . . . . . 0 N--CA 1.491 1.599 0 O-C-N 121.289 -0.882 . . . . 0.0 110.384 -179.877 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.294 0 N-CA-C 109.528 -1.429 . . . . 0.0 109.528 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 11.6 tp -52.88 -46.39 67.9 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.282 -1.128 . . . . 0.0 110.066 179.869 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 98.2 m -59.19 -47.07 86.68 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.193 -0.942 . . . . 0.0 110.151 179.864 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.6 tm-20 -57.47 -29.23 64.07 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.232 -0.917 . . . . 0.0 110.057 179.846 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 4.0 tt -78.41 -44.56 24.51 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.267 -0.895 . . . . 0.0 110.242 179.924 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 98.4 mt -70.39 -50.53 37.78 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.288 -0.883 . . . . 0.0 110.271 -179.859 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -53.3 -46.81 69.53 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.164 -0.96 . . . . 0.0 110.052 179.959 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -56.89 -40.35 90.08 Favored Glycine 0 N--CA 1.491 2.301 0 N-CA-C 109.137 -1.585 . . . . 0.0 109.137 179.613 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 22.8 t80 -66.64 -44.74 81.16 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.309 -1.113 . . . . 0.0 109.812 179.668 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 52.4 m -57.3 -26.85 61.54 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.366 -0.834 . . . . 0.0 109.902 179.632 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 44.2 t -73.53 -72.27 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.569 0 O-C-N 121.381 -0.824 . . . . 0.0 110.258 179.995 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.443 ' OE2' ' CD1' ' A' ' 37' ' ' TYR . 10.1 pt-20 -46.42 -43.56 16.5 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.39 -0.819 . . . . 0.0 111.144 -179.476 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 99.6 t -58.52 -37.34 64.08 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.657 0 O-C-N 120.914 -1.116 . . . . 0.0 110.004 179.955 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -78.57 -20.63 50.12 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.362 -0.836 . . . . 0.0 110.298 179.939 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -95.23 -58.33 2.17 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.284 -0.885 . . . . 0.0 110.462 -179.736 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . 0.43 ' O ' ' CG ' ' A' ' 26' ' ' GLN . 7.9 mp0 -63.11 -22.34 66.79 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.218 -0.926 . . . . 0.0 110.531 -179.73 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . 0.43 ' CG ' ' O ' ' A' ' 25' ' ' GLN . 3.4 pt20 36.49 59.24 3.46 Favored Pre-proline 0 N--CA 1.505 2.279 0 O-C-N 122.013 -0.429 . . . . 0.0 111.589 -179.9 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo -69.95 161.22 46.78 Favored 'Trans proline' 0 C--N 1.31 -1.459 0 O-C-N 123.796 1.419 . . . . 0.0 110.763 -179.735 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 43.4 Cg_endo -69.81 -46.34 1.24 Allowed 'Trans proline' 0 C--N 1.311 -1.398 0 O-C-N 123.84 1.442 . . . . 0.0 110.33 179.975 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -120.54 116.45 25.4 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.355 -0.84 . . . . 0.0 110.048 179.86 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 6.7 tp -70.22 -30.8 67.98 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.391 -0.818 . . . . 0.0 110.273 -179.992 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 41.5 t -51.3 -64.8 0.31 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.663 0 O-C-N 121.239 -0.913 . . . . 0.0 109.956 179.929 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 1.4 t0 -55.3 -39.36 69.8 Favored 'General case' 0 C--N 1.302 -1.467 0 O-C-N 121.429 -0.794 . . . . 0.0 110.022 179.654 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . 0.401 ' CZ ' ' OE2' ' A' ' 21' ' ' GLU . 66.4 t80 -62.35 -44.69 95.89 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.267 -0.896 . . . . 0.0 109.876 179.63 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -59.34 -42.9 92.58 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.31 -0.868 . . . . 0.0 110.116 179.887 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . 0.44 ' CG2' ' HB3' ' B' ' 38' ' ' PHE . 71.9 t -73.09 -24.39 20.8 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.382 0 O-C-N 121.209 -0.932 . . . . 0.0 109.977 179.903 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -80.98 -36.64 30.51 Favored 'General case' 0 C--N 1.304 -1.398 0 O-C-N 121.288 -0.883 . . . . 0.0 109.793 -179.911 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . 0.443 ' CD1' ' OE2' ' A' ' 21' ' ' GLU . 61.4 t80 -74.94 -61.28 1.94 Allowed 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.15 -0.969 . . . . 0.0 110.318 -179.826 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . 0.426 ' HB3' ' CG2' ' B' ' 35' ' ' VAL . 14.9 m-85 -52.15 -51.36 58.47 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.316 -0.865 . . . . 0.0 110.415 -179.925 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 21.2 m -51.91 -43.25 63.32 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.189 -0.944 . . . . 0.0 110.069 179.914 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.73 -30.52 70.03 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.232 -0.918 . . . . 0.0 110.14 179.829 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -57.86 -36.5 72.44 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.235 -0.916 . . . . 0.0 109.966 179.917 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 8.4 mtm180 -50.61 -26.86 5.86 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.321 -0.862 . . . . 0.0 109.933 179.563 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -104.16 -61.22 1.47 Allowed 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.501 -0.749 . . . . 0.0 109.855 179.679 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.501 2.104 0 O-C-N 121.525 -0.734 . . . . 0.0 110.78 179.816 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 48.8 Cg_endo . . . . . 0 N--CA 1.482 0.806 0 N-CA-C 110.32 -0.684 . . . . 0.0 110.32 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' B' B ' 9' ' ' PRO . . . . . . . . . . . . . 46.1 Cg_endo -73.27 153.83 51.18 Favored 'Trans proline' 0 C--N 1.312 -1.36 0 O-C-N 123.535 1.282 . . . . 0.0 110.396 -179.854 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 117.76 -23.38 9.5 Favored Glycine 0 N--CA 1.49 2.282 0 N-CA-C 109.508 -1.437 . . . . 0.0 109.508 -179.863 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -73.5 -46.74 46.11 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.229 -1.16 . . . . 0.0 110.215 -179.961 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 95.6 m -54.78 -30.0 55.72 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.156 -0.965 . . . . 0.0 110.138 -179.955 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 4.4 tt0 -64.59 -48.77 73.71 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.314 -0.866 . . . . 0.0 110.18 179.999 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -68.82 -31.02 69.7 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.3 -0.875 . . . . 0.0 110.23 179.901 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -65.27 -55.38 18.69 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.223 -0.923 . . . . 0.0 110.254 -179.978 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -53.11 -45.16 68.16 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.26 -0.9 . . . . 0.0 110.177 179.837 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 17' ' ' GLY . . . . . . . . . . . . . . . -56.35 -36.88 71.22 Favored Glycine 0 N--CA 1.49 2.285 0 N-CA-C 109.256 -1.538 . . . . 0.0 109.256 179.733 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 18' ' ' TYR . . . . . . . . . . . . . 38.5 t80 -73.41 -44.88 57.47 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.386 -1.067 . . . . 0.0 110.063 179.811 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 52.2 m -57.28 -23.31 47.55 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.239 -0.913 . . . . 0.0 110.05 179.923 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 37.6 t -78.58 -70.34 0.38 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.649 0 O-C-N 121.409 -0.807 . . . . 0.0 110.143 -179.982 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 21' ' ' GLU . . . . . 0.429 ' OE1' ' CZ ' ' B' ' 37' ' ' TYR . 10.2 pt-20 -44.58 -42.81 7.63 Favored 'General case' 0 N--CA 1.497 1.906 0 O-C-N 121.514 -0.741 . . . . 0.0 111.065 -179.507 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 22' ' ' VAL . . . . . . . . . . . . . 84.7 t -66.23 -34.59 71.21 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.551 0 O-C-N 121.051 -1.031 . . . . 0.0 109.64 179.556 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -75.47 -28.72 59.36 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.342 -0.849 . . . . 0.0 109.923 179.802 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -90.58 -65.2 1.04 Allowed 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.377 -0.827 . . . . 0.0 110.187 -179.876 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 25' ' ' GLN . . . . . 0.446 ' O ' ' CG ' ' B' ' 25' ' ' GLN . 1.9 tt0 -85.29 56.56 4.0 Favored 'General case' 0 C--N 1.305 -1.35 0 O-C-N 121.114 -0.991 . . . . 0.0 109.845 179.911 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 10.1 mt-30 -38.29 98.8 0.17 Allowed Pre-proline 0 N--CA 1.499 1.986 0 O-C-N 121.896 -0.503 . . . . 0.0 111.56 -179.717 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 27' ' ' PRO . . . . . 0.411 ' HD3' ' O ' ' B' ' 25' ' ' GLN . 47.3 Cg_endo -74.26 160.05 42.86 Favored 'Trans proline' 0 C--N 1.311 -1.421 0 O-C-N 123.909 1.478 . . . . 0.0 110.41 -179.909 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 44.4 Cg_endo -71.39 -28.16 18.41 Favored 'Trans proline' 0 C--N 1.312 -1.363 0 O-C-N 123.677 1.356 . . . . 0.0 109.967 179.691 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -146.59 112.38 5.67 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.392 -0.818 . . . . 0.0 109.926 179.695 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 1.7 tp -57.09 -33.74 67.61 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.226 -0.921 . . . . 0.0 109.882 -179.994 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 47.5 t -53.55 -55.9 11.13 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.653 0 O-C-N 121.353 -0.842 . . . . 0.0 109.898 179.59 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -65.21 -40.35 94.03 Favored 'General case' 0 C--N 1.301 -1.506 0 O-C-N 121.58 -0.7 . . . . 0.0 110.191 -179.93 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 33' ' ' PHE . . . . . . . . . . . . . 79.3 t80 -63.83 -43.29 96.64 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.214 -0.928 . . . . 0.0 109.757 179.642 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -59.01 -38.69 79.8 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.31 -0.868 . . . . 0.0 110.109 179.846 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 35' ' ' VAL . . . . . 0.426 ' CG2' ' HB3' ' A' ' 38' ' ' PHE . 70.7 t -79.84 -25.57 12.1 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.358 0 O-C-N 121.245 -0.909 . . . . 0.0 109.901 179.791 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -81.88 -36.83 27.76 Favored 'General case' 0 C--N 1.304 -1.391 0 O-C-N 121.297 -0.877 . . . . 0.0 110.112 -179.791 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 37' ' ' TYR . . . . . 0.429 ' CZ ' ' OE1' ' B' ' 21' ' ' GLU . 87.5 t80 -76.1 -59.52 2.73 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.043 -1.036 . . . . 0.0 110.629 -179.658 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 38' ' ' PHE . . . . . 0.44 ' HB3' ' CG2' ' A' ' 35' ' ' VAL . 4.3 m-85 -55.48 -46.38 76.87 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.232 -0.917 . . . . 0.0 110.655 -179.554 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 39' ' ' THR . . . . . . . . . . . . . 8.7 m -53.23 -48.73 67.94 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 120.939 -1.101 . . . . 0.0 109.975 179.993 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -55.74 -42.46 75.43 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.222 -0.924 . . . . 0.0 110.255 179.989 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 1.6 mt -54.56 -40.96 69.25 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.206 -0.934 . . . . 0.0 109.913 179.75 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.16 -25.46 67.77 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.233 -0.917 . . . . 0.0 109.907 179.79 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 43' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 . . . . . 0 N--CA 1.491 1.614 0 O-C-N 121.364 -0.835 . . . . 0.0 110.103 179.798 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' C' C ' 2' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.501 2.111 0 CA-C-O 121.191 0.519 . . . . 0.0 110.419 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 3' ' ' ILE . . . . . . . . . . . . . 49.3 mm -66.3 -53.93 31.57 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.636 0 O-C-N 121.078 -1.014 . . . . 0.0 110.254 -179.895 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 4' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -51.77 -38.03 53.85 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.248 -0.908 . . . . 0.0 110.327 -179.981 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' C' C ' 5' ' ' THR . . . . . . . . . . . . . 93.1 m -72.62 -48.42 39.75 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.387 -0.821 . . . . 0.0 110.364 -179.921 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 6' ' ' ALA . . . . . . . . . . . . . . . -56.35 -25.65 49.99 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.254 -0.903 . . . . 0.0 110.477 -179.781 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 7' ' ' SER . . . . . . . . . . . . . 63.1 m -83.79 -39.12 20.41 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.124 -0.985 . . . . 0.0 110.267 -179.897 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 8' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -75.39 -37.43 60.52 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.18 -0.95 . . . . 0.0 110.107 179.923 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' C' C ' 9' ' ' LEU . . . . . . . . . . . . . 2.6 tp -66.34 -56.68 9.96 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.246 -0.909 . . . . 0.0 110.065 179.85 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 10' ' ' VAL . . . . . . . . . . . . . 10.9 p -51.64 -28.38 8.9 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.597 0 O-C-N 121.309 -0.869 . . . . 0.0 110.405 179.966 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 11' ' ' LYS . . . . . . . . . . . . . 8.9 mttm -67.98 -49.0 64.25 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.266 -0.897 . . . . 0.0 110.269 179.969 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' C' C ' 12' ' ' ASN . . . . . . . . . . . . . 28.4 m-20 . . . . . 0 N--CA 1.492 1.65 0 O-C-N 121.269 -0.895 . . . . 0.0 110.761 179.985 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.314 0 N-CA-C 109.807 -1.317 . . . . 0.0 109.807 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 1.7 mp -84.36 -24.36 29.74 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.152 -1.205 . . . . 0.0 110.492 -179.739 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 71.5 m -54.8 -57.14 12.77 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.153 -0.967 . . . . 0.0 110.589 -179.754 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -56.94 -48.71 77.65 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.276 -0.89 . . . . 0.0 110.631 -179.593 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.5 tp -50.75 -58.13 6.66 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.277 -0.889 . . . . 0.0 110.692 -179.489 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 2.4 mp -56.36 -49.41 74.49 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.199 -0.938 . . . . 0.0 110.389 -179.752 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -50.41 -49.15 55.44 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.185 -0.947 . . . . 0.0 110.324 179.981 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -55.25 -38.84 69.24 Favored Glycine 0 N--CA 1.491 2.333 0 N-CA-C 109.055 -1.618 . . . . 0.0 109.055 179.658 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . 0.409 ' O ' ' CG2' ' A' ' 22' ' ' VAL . 24.7 t80 -67.42 -50.65 58.53 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.407 -1.055 . . . . 0.0 109.708 179.492 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 70.9 m -57.01 -32.83 66.54 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.282 -0.886 . . . . 0.0 109.807 179.621 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 44.8 t -63.46 -73.76 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.545 0 O-C-N 121.357 -0.839 . . . . 0.0 110.22 179.959 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.414 ' OE1' ' CE1' ' A' ' 37' ' ' TYR . 10.3 pt-20 -45.06 -43.26 9.3 Favored 'General case' 0 N--CA 1.498 1.931 0 O-C-N 121.461 -0.774 . . . . 0.0 111.035 -179.575 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.409 ' CG2' ' O ' ' A' ' 18' ' ' TYR . 94.6 t -51.92 -53.84 15.99 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.713 0 O-C-N 121.1 -1.0 . . . . 0.0 110.144 179.888 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -56.81 -35.27 68.57 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.271 -0.893 . . . . 0.0 110.115 179.874 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 1.4 mmt180 -77.34 -62.9 1.5 Allowed 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.31 -0.869 . . . . 0.0 110.331 -179.925 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 34.9 mm-40 -57.84 -39.34 77.45 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.218 -0.926 . . . . 0.0 110.26 -179.955 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 51.79 56.93 16.34 Favored Pre-proline 0 N--CA 1.492 1.661 0 O-C-N 121.235 -0.916 . . . . 0.0 110.102 -179.794 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 43.8 Cg_endo -70.06 161.06 47.39 Favored 'Trans proline' 0 C--N 1.311 -1.403 0 O-C-N 123.735 1.387 . . . . 0.0 110.51 -179.996 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 45.4 Cg_endo -71.5 -34.04 10.0 Favored 'Trans proline' 0 C--N 1.311 -1.401 0 O-C-N 123.694 1.365 . . . . 0.0 110.23 -179.976 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -130.12 119.45 23.04 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.325 -0.859 . . . . 0.0 110.264 -179.847 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 5.3 tp -75.28 -35.57 61.29 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.342 -0.848 . . . . 0.0 109.816 179.802 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.436 ' CG1' ' HD2' ' B' ' 42' ' ' ARG . 44.9 t -51.55 -59.18 1.46 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.695 0 O-C-N 121.279 -0.888 . . . . 0.0 109.855 179.564 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 6.0 t0 -58.55 -40.1 82.08 Favored 'General case' 0 C--N 1.301 -1.529 0 O-C-N 121.683 -0.636 . . . . 0.0 109.932 179.753 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 42.4 t80 -62.05 -48.78 78.7 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.157 -0.965 . . . . 0.0 109.511 179.448 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -52.97 -38.2 61.94 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.389 -0.819 . . . . 0.0 110.121 179.716 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 97.1 t -70.06 -35.73 65.24 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.367 0 O-C-N 121.25 -0.906 . . . . 0.0 110.174 -179.958 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -83.14 -20.17 35.28 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.294 -0.879 . . . . 0.0 110.444 -179.989 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . 0.414 ' CE1' ' OE1' ' A' ' 21' ' ' GLU . 33.7 t80 -73.31 -62.21 1.55 Allowed 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.205 -0.935 . . . . 0.0 110.565 -179.665 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 29.3 m-85 -67.18 -45.21 77.63 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.204 -0.935 . . . . 0.0 110.644 -179.571 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 42.7 m -52.53 -39.28 61.21 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.156 -0.965 . . . . 0.0 110.252 -179.939 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 3.6 mtp85 -74.37 -34.59 63.41 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.204 -0.935 . . . . 0.0 110.008 179.773 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 10.5 tp -65.97 -19.95 66.04 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.38 -0.825 . . . . 0.0 110.396 -179.939 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -82.69 -21.91 34.73 Favored 'General case' 0 C--N 1.305 -1.367 0 O-C-N 121.139 -0.976 . . . . 0.0 109.915 179.977 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 12.2 mt-10 -104.21 -4.99 22.35 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.194 -0.941 . . . . 0.0 110.816 -179.983 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.652 0 O-C-N 120.933 -1.104 . . . . 0.0 110.318 179.93 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 45.0 Cg_endo . . . . . 0 N--CA 1.485 1.027 0 N-CA-C 110.628 -0.566 . . . . 0.0 110.628 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' B' B ' 9' ' ' PRO . . . . . . . . . . . . . 47.9 Cg_endo -73.72 156.82 48.68 Favored 'Trans proline' 0 C--N 1.312 -1.369 0 O-C-N 123.654 1.344 . . . . 0.0 110.248 179.675 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 135.25 -31.27 2.71 Favored Glycine 0 N--CA 1.49 2.28 0 N-CA-C 109.606 -1.398 . . . . 0.0 109.606 179.884 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 1.8 mp -78.32 -22.96 47.32 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.276 -1.132 . . . . 0.0 110.151 179.941 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 89.3 m -54.4 -42.15 70.08 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.378 -0.826 . . . . 0.0 110.302 179.985 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -79.4 -36.09 39.68 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.282 -0.886 . . . . 0.0 110.274 179.976 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 2.8 tp -65.2 -49.95 67.78 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.235 -0.916 . . . . 0.0 110.151 -179.994 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 6.0 mp -62.78 -50.29 71.62 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.319 -0.863 . . . . 0.0 110.391 -179.971 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 1.1 mt-30 -52.04 -40.5 61.18 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.153 -0.967 . . . . 0.0 110.139 179.972 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 17' ' ' GLY . . . . . . . . . . . . . . . -57.6 -51.67 56.51 Favored Glycine 0 N--CA 1.491 2.301 0 N-CA-C 109.169 -1.572 . . . . 0.0 109.169 179.649 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 18' ' ' TYR . . . . . 0.45 ' CZ ' ' HB3' ' B' ' 34' ' ' ALA . 12.0 t80 -54.04 -38.99 65.8 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.369 -1.077 . . . . 0.0 110.19 179.891 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 51.9 m -71.03 -32.94 69.84 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.391 -0.818 . . . . 0.0 110.307 -179.862 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 90.3 t -70.1 -17.38 20.91 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.625 0 O-C-N 121.216 -0.927 . . . . 0.0 110.473 -179.892 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 21' ' ' GLU . . . . . 0.472 ' OE1' ' CD1' ' B' ' 37' ' ' TYR . 0.7 OUTLIER -92.23 -57.79 2.59 Favored 'General case' 0 N--CA 1.497 1.905 0 O-C-N 121.09 -1.006 . . . . 0.0 109.439 -179.927 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 22' ' ' VAL . . . . . . . . . . . . . 96.5 t -49.85 -26.34 2.76 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.528 0 O-C-N 121.565 -0.71 . . . . 0.0 110.476 -179.952 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 1.2 mt -84.78 -47.34 10.49 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.214 -0.929 . . . . 0.0 110.076 179.722 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.47 -66.6 0.64 Allowed 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.205 -0.934 . . . . 0.0 110.178 179.82 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 25' ' ' GLN . . . . . 0.429 ' O ' ' CG ' ' B' ' 25' ' ' GLN . 0.2 OUTLIER -91.68 59.69 3.8 Favored 'General case' 0 C--N 1.306 -1.292 0 O-C-N 121.039 -1.038 . . . . 0.0 109.917 179.903 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 21.2 mt-30 -38.42 98.63 0.17 Allowed Pre-proline 0 N--CA 1.5 2.056 0 O-C-N 122.042 -0.411 . . . . 0.0 111.676 -179.646 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 27' ' ' PRO . . . . . 0.486 ' HG3' ' CD2' ' B' ' 33' ' ' PHE . 49.4 Cg_endo -77.42 163.66 29.57 Favored 'Trans proline' 0 C--N 1.311 -1.422 0 O-C-N 123.821 1.432 . . . . 0.0 110.55 -179.986 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 45.1 Cg_endo -71.84 -52.65 0.19 Allowed 'Trans proline' 0 C--N 1.313 -1.34 0 O-C-N 123.679 1.357 . . . . 0.0 110.745 -179.946 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 58.0 m-20 -117.53 116.83 27.89 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.12 -0.988 . . . . 0.0 110.31 -179.826 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -60.5 -45.49 93.59 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.28 -0.888 . . . . 0.0 110.169 179.991 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 43.5 t -50.6 -63.05 0.44 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.761 0 O-C-N 121.233 -0.917 . . . . 0.0 109.964 179.737 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 4.8 t0 -57.92 -33.37 68.72 Favored 'General case' 0 C--N 1.303 -1.43 0 O-C-N 121.477 -0.764 . . . . 0.0 109.855 179.711 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 33' ' ' PHE . . . . . 0.486 ' CD2' ' HG3' ' B' ' 27' ' ' PRO . 32.7 t80 -67.24 -51.32 54.56 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.316 -0.865 . . . . 0.0 109.477 179.38 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 34' ' ' ALA . . . . . 0.45 ' HB3' ' CZ ' ' B' ' 18' ' ' TYR . . . -54.05 -32.14 53.67 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.399 -0.813 . . . . 0.0 109.961 179.698 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 35' ' ' VAL . . . . . . . . . . . . . 87.5 t -71.8 -38.19 64.69 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.355 0 O-C-N 121.277 -0.889 . . . . 0.0 110.117 -179.981 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -73.45 -34.36 65.36 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.182 -0.949 . . . . 0.0 110.23 179.922 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 37' ' ' TYR . . . . . 0.472 ' CD1' ' OE1' ' B' ' 21' ' ' GLU . 19.1 t80 -70.57 -66.62 0.58 Allowed 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.24 -0.913 . . . . 0.0 110.328 -179.945 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 24.8 m-85 -51.36 -53.49 35.78 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.24 -0.912 . . . . 0.0 110.428 -179.877 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 39' ' ' THR . . . . . . . . . . . . . 51.6 m -51.27 -30.88 19.25 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.152 -0.968 . . . . 0.0 110.006 179.79 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -82.83 -28.19 30.33 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.306 -0.871 . . . . 0.0 109.799 179.642 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -54.09 -43.87 70.71 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.4 -0.813 . . . . 0.0 110.094 179.817 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 42' ' ' ARG . . . . . 0.436 ' HD2' ' CG1' ' A' ' 31' ' ' VAL . 0.0 OUTLIER -51.9 -30.3 23.62 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.27 -0.894 . . . . 0.0 110.645 -179.733 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 43' ' ' GLU . . . . . . . . . . . . . 18.4 mm-40 . . . . . 0 N--CA 1.493 1.687 0 O-C-N 121.126 -0.984 . . . . 0.0 110.803 -179.738 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' C' C ' 2' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.499 2.013 0 CA-C-O 121.086 0.47 . . . . 0.0 110.528 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 3' ' ' ILE . . . . . . . . . . . . . 15.1 tt -55.03 -22.97 12.05 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.68 0 O-C-N 121.235 -0.916 . . . . 0.0 110.684 -179.78 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 4' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -86.34 -0.23 55.42 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.121 -0.987 . . . . 0.0 110.841 -179.769 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 5' ' ' THR . . . . . . . . . . . . . 86.2 m -125.01 -34.84 2.73 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.043 -1.036 . . . . 0.0 110.369 -179.913 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 6' ' ' ALA . . . . . . . . . . . . . . . -72.28 -38.06 68.88 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.154 -0.966 . . . . 0.0 110.383 -179.811 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 7' ' ' SER . . . . . . . . . . . . . 16.2 m -62.42 -45.84 91.28 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.216 -0.927 . . . . 0.0 110.479 -179.794 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 8' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -72.63 -25.2 61.21 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.2 -0.938 . . . . 0.0 110.37 -179.742 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 9' ' ' LEU . . . . . . . . . . . . . 1.7 tp -61.88 -51.21 69.13 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.296 -0.878 . . . . 0.0 110.194 179.978 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 10' ' ' VAL . . . . . . . . . . . . . 88.5 t -54.31 -47.97 68.3 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.645 0 O-C-N 121.232 -0.918 . . . . 0.0 110.162 179.881 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' C' C ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.98 -46.14 68.13 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.309 -0.869 . . . . 0.0 110.328 179.996 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' C' C ' 12' ' ' ASN . . . . . . . . . . . . . 48.6 t-20 . . . . . 0 N--CA 1.49 1.547 0 O-C-N 121.221 -0.924 . . . . 0.0 110.424 -179.86 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.321 0 N-CA-C 109.729 -1.348 . . . . 0.0 109.729 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -70.37 -29.68 66.41 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.2 -1.176 . . . . 0.0 110.352 -179.898 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 21.9 m -62.14 -60.65 3.28 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.229 -0.919 . . . . 0.0 110.317 -179.885 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . 0.421 ' HG3' ' N ' ' A' ' 14' ' ' LEU . 4.5 pt-20 -52.24 -25.22 8.75 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.278 -0.889 . . . . 0.0 110.391 -179.857 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.421 ' N ' ' HG3' ' A' ' 13' ' ' GLU . 9.0 mt -79.48 -50.1 11.27 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.235 -0.916 . . . . 0.0 110.508 -179.889 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -70.75 -50.0 40.72 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.212 -0.93 . . . . 0.0 110.269 -179.853 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 1.2 tt0 -57.42 -42.49 82.44 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.274 -0.891 . . . . 0.0 109.949 179.929 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -59.04 -41.49 96.49 Favored Glycine 0 N--CA 1.492 2.371 0 N-CA-C 109.592 -1.403 . . . . 0.0 109.592 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . 0.421 ' CE1' ' CE2' ' A' ' 33' ' ' PHE . 60.4 t80 -68.99 -43.74 74.26 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.159 -1.201 . . . . 0.0 109.959 179.868 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 86.0 m -58.69 -28.27 65.6 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.361 -0.837 . . . . 0.0 110.136 179.883 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 25.4 t -75.4 -70.89 0.28 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.653 0 O-C-N 121.265 -0.897 . . . . 0.0 110.031 179.961 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -47.08 -45.59 21.97 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.341 -0.849 . . . . 0.0 111.032 -179.433 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.407 ' CG2' ' O ' ' A' ' 18' ' ' TYR . 81.8 t -54.8 -57.63 6.17 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.586 0 O-C-N 120.912 -1.118 . . . . 0.0 110.13 179.96 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 8.4 mt -68.07 -15.15 63.47 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.369 -0.832 . . . . 0.0 110.686 -179.799 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 5.5 tpt180 -80.37 -58.85 2.94 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.088 -1.008 . . . . 0.0 110.47 -179.832 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 5.9 pt20 -81.65 -22.18 37.71 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.241 -0.912 . . . . 0.0 110.443 -179.738 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER 53.22 75.65 0.61 Allowed Pre-proline 0 N--CA 1.491 1.582 0 O-C-N 121.165 -0.959 . . . . 0.0 110.162 -179.837 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 45.0 Cg_endo -71.95 156.86 55.78 Favored 'Trans proline' 0 C--N 1.312 -1.369 0 O-C-N 123.563 1.296 . . . . 0.0 110.415 -179.899 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 43.2 Cg_endo -69.74 -24.36 29.87 Favored 'Trans proline' 0 C--N 1.311 -1.43 0 O-C-N 123.712 1.375 . . . . 0.0 110.043 179.693 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -143.44 117.71 9.59 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.353 -0.842 . . . . 0.0 109.902 179.585 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.41 ' CD1' ' OH ' ' A' ' 18' ' ' TYR . 17.4 tp -72.67 -39.11 67.34 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.269 -0.894 . . . . 0.0 110.307 -179.851 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 45.0 t -49.74 -61.71 0.57 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.767 0 O-C-N 121.242 -0.911 . . . . 0.0 110.22 179.933 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . 0.408 ' OD2' ' NH2' ' B' ' 42' ' ' ARG . 7.1 t0 -58.07 -34.73 70.45 Favored 'General case' 0 C--N 1.302 -1.459 0 O-C-N 121.454 -0.779 . . . . 0.0 110.206 -179.906 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . 0.421 ' CE2' ' CE1' ' A' ' 18' ' ' TYR . 68.6 t80 -66.64 -44.19 82.64 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.173 -0.954 . . . . 0.0 109.557 179.533 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -56.62 -40.53 75.53 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.429 -0.794 . . . . 0.0 110.257 179.685 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 90.5 t -75.7 -26.67 18.17 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.423 0 O-C-N 121.232 -0.917 . . . . 0.0 110.164 -179.999 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . 0.428 ' OE1' ' CA ' ' A' ' 36' ' ' GLU . 1.5 tp10 -81.73 -41.94 20.54 Favored 'General case' 0 C--N 1.303 -1.452 0 O-C-N 121.336 -0.853 . . . . 0.0 109.759 -179.88 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 88.4 t80 -69.39 -59.35 3.05 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.211 -0.931 . . . . 0.0 110.356 -179.836 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . 0.419 ' CG ' ' HB1' ' B' ' 34' ' ' ALA . 6.1 m-85 -54.1 -52.42 61.07 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.231 -0.918 . . . . 0.0 110.451 -179.789 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 24.3 m -52.82 -27.51 18.55 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.135 -0.978 . . . . 0.0 109.988 179.973 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.97 -26.53 60.53 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.21 -0.931 . . . . 0.0 109.986 179.758 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -77.67 -34.75 52.88 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.232 -0.917 . . . . 0.0 110.064 179.82 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -55.7 -28.99 58.61 Favored 'General case' 0 C--N 1.306 -1.297 0 O-C-N 121.226 -0.921 . . . . 0.0 109.271 179.484 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . 0.402 ' O ' ' CB ' ' A' ' 44' ' ' ALA . 0.6 OUTLIER -99.32 -59.56 1.7 Allowed 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.522 -0.736 . . . . 0.0 109.638 179.417 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . 0.402 ' CB ' ' O ' ' A' ' 43' ' ' GLU . . . . . . . . 0 N--CA 1.497 1.88 0 CA-C-O 121.734 0.778 . . . . 0.0 110.275 179.822 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 8' ' ' PRO . . . . . 0.449 ' HB2' ' CB ' ' B' ' 11' ' ' LEU . 44.1 Cg_endo . . . . . 0 N--CA 1.487 1.132 0 N-CA-C 110.662 -0.553 . . . . 0.0 110.662 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 9' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_endo -86.27 123.38 2.26 Favored 'Trans proline' 0 C--N 1.313 -1.322 0 O-C-N 123.597 1.314 . . . . 0.0 111.246 -179.619 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 73.74 2.27 60.49 Favored Glycine 0 N--CA 1.492 2.411 0 C-N-CA 120.262 -0.97 . . . . 0.0 110.887 179.055 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 11' ' ' LEU . . . . . 0.449 ' CB ' ' HB2' ' B' ' 8' ' ' PRO . 0.1 OUTLIER -90.38 -28.86 18.4 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 120.728 -1.454 . . . . 0.0 110.44 -179.935 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 82.0 m -58.13 -39.87 79.83 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.139 -0.976 . . . . 0.0 110.202 179.891 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -60.64 -40.07 90.6 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.351 -0.843 . . . . 0.0 110.106 179.969 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -60.19 -42.15 94.44 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.254 -0.903 . . . . 0.0 110.252 -179.975 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 65.1 mt -74.64 -44.21 51.6 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.241 -0.912 . . . . 0.0 109.963 179.956 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -54.09 -37.7 64.54 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.308 -0.87 . . . . 0.0 109.956 179.837 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 17' ' ' GLY . . . . . . . . . . . . . . . -67.99 -49.64 46.34 Favored Glycine 0 N--CA 1.49 2.264 0 N-CA-C 109.397 -1.481 . . . . 0.0 109.397 179.862 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 18' ' ' TYR . . . . . 0.4 ' HA ' ' HG3' ' B' ' 21' ' ' GLU . 18.4 t80 -60.02 -34.89 73.98 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.345 -1.091 . . . . 0.0 110.181 179.895 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 95.4 m -63.87 -33.64 76.14 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.18 -0.95 . . . . 0.0 110.525 -179.912 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 59.4 t -75.46 -22.68 16.53 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.751 0 O-C-N 121.147 -0.971 . . . . 0.0 110.29 -179.811 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 21' ' ' GLU . . . . . 0.4 ' HG3' ' HA ' ' B' ' 18' ' ' TYR . 0.6 OUTLIER -88.92 -52.89 4.86 Favored 'General case' 0 N--CA 1.497 1.915 0 O-C-N 121.153 -0.967 . . . . 0.0 108.702 179.685 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 22' ' ' VAL . . . . . . . . . . . . . 57.0 t -50.38 -31.8 8.98 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.5 0 O-C-N 121.665 -0.647 . . . . 0.0 110.07 179.498 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -86.34 -39.26 16.64 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.275 -0.891 . . . . 0.0 110.057 179.758 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 1.8 tpt180 -75.86 -52.23 10.8 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.278 -0.889 . . . . 0.0 110.271 -179.95 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 1.9 mm100 -64.04 -40.58 96.61 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.247 -0.908 . . . . 0.0 110.28 -179.961 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 26' ' ' GLN . . . . . 0.401 ' N ' ' CD ' ' B' ' 27' ' ' PRO . 0.2 OUTLIER 51.83 55.71 15.55 Favored Pre-proline 0 N--CA 1.491 1.624 0 O-C-N 121.278 -0.888 . . . . 0.0 110.026 -179.856 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 27' ' ' PRO . . . . . 0.401 ' CD ' ' N ' ' B' ' 26' ' ' GLN . 43.3 Cg_endo -69.6 158.97 55.28 Favored 'Trans proline' 0 C--N 1.313 -1.336 0 O-C-N 123.789 1.415 . . . . 0.0 110.687 -179.629 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_endo -70.0 -22.35 31.11 Favored 'Trans proline' 0 C--N 1.311 -1.406 0 O-C-N 123.724 1.381 . . . . 0.0 110.182 179.811 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 10.4 m-20 -140.2 115.56 9.95 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.369 -0.832 . . . . 0.0 110.123 179.709 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 7.0 tp -72.2 -32.95 67.25 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.297 -0.877 . . . . 0.0 110.008 179.886 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 33.2 t -57.05 -65.3 0.42 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.715 0 O-C-N 121.316 -0.865 . . . . 0.0 109.879 179.656 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -56.25 -31.74 63.85 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.477 -0.764 . . . . 0.0 109.984 179.868 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 33' ' ' PHE . . . . . . . . . . . . . 47.8 t80 -68.88 -45.48 70.88 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.305 -0.872 . . . . 0.0 109.691 179.462 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 34' ' ' ALA . . . . . 0.419 ' HB1' ' CG ' ' A' ' 38' ' ' PHE . . . -58.49 -37.1 74.84 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.495 -0.753 . . . . 0.0 110.124 179.772 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 35' ' ' VAL . . . . . 0.407 ' O ' ' CB ' ' B' ' 39' ' ' THR . 98.3 t -73.2 -46.7 49.7 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.399 0 O-C-N 121.161 -0.962 . . . . 0.0 110.311 179.975 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -60.14 -44.37 94.99 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.165 -0.959 . . . . 0.0 110.416 -179.85 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 37' ' ' TYR . . . . . . . . . . . . . 28.1 t80 -64.45 -67.94 0.39 Allowed 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.209 -0.932 . . . . 0.0 110.606 -179.72 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 13.1 m-85 -51.12 -48.78 61.69 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.279 -0.888 . . . . 0.0 110.776 -179.552 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 39' ' ' THR . . . . . 0.407 ' CB ' ' O ' ' B' ' 35' ' ' VAL . 35.7 m -52.35 -32.86 40.34 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 120.959 -1.088 . . . . 0.0 110.002 -179.816 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -68.59 -41.65 79.33 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.266 -0.896 . . . . 0.0 109.848 179.651 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -55.39 -28.31 53.2 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.261 -0.9 . . . . 0.0 109.818 179.658 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 42' ' ' ARG . . . . . 0.408 ' NH2' ' OD2' ' A' ' 32' ' ' ASP . 7.2 mmm180 -78.63 -19.85 51.71 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.276 -0.89 . . . . 0.0 110.297 179.843 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 43' ' ' GLU . . . . . . . . . . . . . 7.3 mm-40 . . . . . 0 N--CA 1.492 1.665 0 O-C-N 121.136 -0.978 . . . . 0.0 110.649 -179.95 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' C' C ' 2' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.491 1.62 0 CA-C-O 121.16 0.505 . . . . 0.0 110.276 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 3' ' ' ILE . . . . . . . . . . . . . 97.0 mt -63.67 -38.53 82.53 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.629 0 O-C-N 121.19 -0.944 . . . . 0.0 110.3 -179.946 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 4' ' ' GLU . . . . . . . . . . . . . 6.5 mt-10 -66.38 -36.9 84.03 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.229 -0.919 . . . . 0.0 110.397 -179.873 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 5' ' ' THR . . . . . . . . . . . . . 99.0 m -76.46 -56.05 4.98 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.207 -0.933 . . . . 0.0 110.24 -179.956 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 6' ' ' ALA . . . . . . . . . . . . . . . -54.42 -35.25 62.71 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.284 -0.885 . . . . 0.0 110.187 -179.983 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 7' ' ' SER . . . . . . . . . . . . . 84.0 p -69.78 -30.25 67.76 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.28 -0.887 . . . . 0.0 110.18 -179.992 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 8' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -96.68 -21.08 17.82 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.29 -0.882 . . . . 0.0 110.215 179.97 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' C' C ' 9' ' ' LEU . . . . . . . . . . . . . 9.3 tt -69.56 -47.47 63.53 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.32 -0.862 . . . . 0.0 110.179 -179.938 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 10' ' ' VAL . . . . . . . . . . . . . 33.6 m -57.63 -40.61 76.18 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.66 0 O-C-N 121.184 -0.948 . . . . 0.0 110.038 179.996 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 11' ' ' LYS . . . . . . . . . . . . . 18.4 mttt -59.46 -38.61 81.23 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.299 -0.875 . . . . 0.0 110.038 179.817 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' C' C ' 12' ' ' ASN . . . . . . . . . . . . . 8.0 m-20 . . . . . 0 N--CA 1.491 1.613 0 O-C-N 121.31 -0.869 . . . . 0.0 110.053 179.861 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.338 0 N-CA-C 109.748 -1.341 . . . . 0.0 109.748 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 6.8 tp -53.58 -55.58 24.48 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.131 -1.217 . . . . 0.0 110.211 -179.932 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 57.0 m -53.53 -56.33 17.92 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.259 -0.901 . . . . 0.0 110.411 -179.851 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -53.75 -41.09 66.75 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.302 -0.874 . . . . 0.0 110.498 -179.698 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -75.19 -27.67 59.73 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.179 -0.951 . . . . 0.0 110.419 -179.761 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 5.3 mp -86.44 -55.38 3.92 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.1 -1.0 . . . . 0.0 110.307 -179.967 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 1.6 mt-30 -51.48 -37.73 50.43 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.14 -0.975 . . . . 0.0 109.877 179.694 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . 0.421 ' O ' ' CG ' ' A' ' 21' ' ' GLU . . . -69.18 -55.5 10.35 Favored Glycine 0 N--CA 1.489 2.232 0 N-CA-C 108.988 -1.645 . . . . 0.0 108.988 179.45 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 21.5 t80 -50.48 -32.12 17.18 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.349 -1.089 . . . . 0.0 110.088 179.673 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 94.4 m -76.25 -32.45 58.87 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.465 -0.772 . . . . 0.0 110.053 179.936 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 95.1 t -78.5 -18.78 13.4 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.62 0 O-C-N 121.296 -0.877 . . . . 0.0 110.673 -179.858 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.421 ' CG ' ' O ' ' A' ' 17' ' ' GLY . 1.3 mt-10 -84.87 -57.99 2.88 Favored 'General case' 0 N--CA 1.498 1.933 0 O-C-N 121.008 -1.057 . . . . 0.0 109.036 179.91 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 39.8 t -51.65 -34.25 15.92 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.477 0 O-C-N 121.643 -0.661 . . . . 0.0 109.94 179.821 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 2.4 mp -76.53 -37.94 55.9 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.389 -0.82 . . . . 0.0 109.774 179.51 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -66.36 -24.67 66.54 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.37 -0.831 . . . . 0.0 110.002 179.874 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' GLN . . . . . 0.421 ' O ' ' HD3' ' A' ' 27' ' ' PRO . 0.8 OUTLIER -143.81 59.45 1.37 Allowed 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.265 -0.897 . . . . 0.0 110.212 -179.991 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . 0.407 ' HG3' ' O ' ' A' ' 26' ' ' GLN . 6.2 pt20 -34.72 95.56 0.09 OUTLIER Pre-proline 0 N--CA 1.505 2.28 0 CA-C-O 120.959 0.409 . . . . 0.0 111.741 -179.75 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' PRO . . . . . 0.421 ' HD3' ' O ' ' A' ' 25' ' ' GLN . 46.7 Cg_endo -73.72 161.01 42.77 Favored 'Trans proline' 0 C--N 1.312 -1.348 0 O-C-N 123.876 1.461 . . . . 0.0 110.515 -179.614 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 43.5 Cg_endo -70.18 -29.54 21.73 Favored 'Trans proline' 0 C--N 1.31 -1.451 0 O-C-N 123.689 1.363 . . . . 0.0 110.224 179.79 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -142.83 118.46 10.42 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.207 -0.933 . . . . 0.0 110.086 179.712 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 4.9 tp -76.79 -24.58 52.86 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.264 -0.897 . . . . 0.0 109.937 179.934 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 43.7 t -52.83 -62.96 0.53 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.61 0 O-C-N 121.313 -0.867 . . . . 0.0 110.05 179.791 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -60.82 -43.03 98.78 Favored 'General case' 0 C--N 1.302 -1.457 0 O-C-N 121.504 -0.748 . . . . 0.0 110.02 179.826 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 90.7 t80 -59.79 -43.71 94.27 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.128 -0.983 . . . . 0.0 109.678 179.502 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' ALA . . . . . 0.43 ' HB1' ' CD2' ' B' ' 38' ' ' PHE . . . -54.68 -43.99 72.96 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.311 -0.868 . . . . 0.0 109.735 179.626 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . 0.402 ' CG2' ' HB3' ' B' ' 38' ' ' PHE . 54.5 t -71.77 -49.28 46.58 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.335 0 O-C-N 121.309 -0.87 . . . . 0.0 109.94 179.741 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -62.04 -27.65 69.03 Favored 'General case' 0 N--CA 1.487 1.38 0 O-C-N 121.276 -0.89 . . . . 0.0 109.812 179.829 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 73.7 t80 -72.67 -72.04 0.26 Allowed 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.215 -0.928 . . . . 0.0 110.414 -179.734 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . 0.467 ' CD2' ' HB3' ' B' ' 34' ' ' ALA . 27.3 m-85 -54.63 -47.79 73.04 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.209 -0.932 . . . . 0.0 110.446 -179.796 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 99.1 m -52.39 -34.19 46.94 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.102 -0.999 . . . . 0.0 109.94 179.84 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 1.9 tpt85 -75.92 -23.05 55.46 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.312 -0.867 . . . . 0.0 109.902 179.645 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -65.54 -40.7 93.21 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.253 -0.904 . . . . 0.0 110.189 179.967 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.78 -22.29 34.81 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.321 -0.862 . . . . 0.0 110.431 -179.847 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 -83.25 -31.87 26.74 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.252 -0.905 . . . . 0.0 110.457 -179.725 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 1.682 0 O-C-N 121.213 -0.929 . . . . 0.0 110.764 -179.782 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 46.5 Cg_endo . . . . . 0 N--CA 1.485 0.975 0 N-CA-C 110.626 -0.567 . . . . 0.0 110.626 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' B' B ' 9' ' ' PRO . . . . . . . . . . . . . 45.9 Cg_endo -72.93 -176.61 2.45 Favored 'Trans proline' 0 C--N 1.313 -1.339 0 O-C-N 123.592 1.311 . . . . 0.0 110.386 179.986 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 118.51 -26.97 7.46 Favored Glycine 0 N--CA 1.491 2.337 0 N-CA-C 109.573 -1.411 . . . . 0.0 109.573 179.969 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 4.5 tt -73.64 -24.07 59.96 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.279 -1.13 . . . . 0.0 110.314 -179.921 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 23.4 m -57.94 -58.75 7.03 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.227 -0.921 . . . . 0.0 110.119 -179.989 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 4.5 mt-10 -53.9 -44.7 70.74 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.415 -0.803 . . . . 0.0 110.195 -179.975 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 6.5 mt -55.71 -57.94 9.92 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.209 -0.932 . . . . 0.0 110.124 179.967 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -60.86 -37.94 83.86 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.315 -0.866 . . . . 0.0 110.122 179.92 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 2.3 tt0 -51.94 -52.01 53.09 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.241 -0.912 . . . . 0.0 110.314 179.899 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 17' ' ' GLY . . . . . . . . . . . . . . . -56.14 -51.53 55.21 Favored Glycine 0 N--CA 1.49 2.249 0 N-CA-C 109.142 -1.583 . . . . 0.0 109.142 179.665 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 18' ' ' TYR . . . . . 0.421 ' HA ' ' HG3' ' B' ' 21' ' ' GLU . 14.8 t80 -53.98 -40.16 66.67 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.332 -1.099 . . . . 0.0 110.083 179.684 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 54.1 m -62.75 -41.4 99.19 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.435 -0.79 . . . . 0.0 110.386 -179.844 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 48.9 t -65.42 -18.81 24.54 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.66 0 O-C-N 121.148 -0.97 . . . . 0.0 110.378 -179.938 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 21' ' ' GLU . . . . . 0.468 ' OE1' ' CE1' ' B' ' 37' ' ' TYR . 1.4 mt-10 -93.32 -49.84 5.75 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.126 -0.984 . . . . 0.0 109.051 179.793 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 22' ' ' VAL . . . . . . . . . . . . . 85.7 t -58.92 -28.4 38.15 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.461 0 O-C-N 121.719 -0.613 . . . . 0.0 110.02 179.962 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 8.5 tp -85.18 -43.47 13.79 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.26 -0.9 . . . . 0.0 109.891 179.583 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -78.34 -64.16 1.23 Allowed 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.36 -0.838 . . . . 0.0 110.1 179.874 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -55.06 -37.88 67.3 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.323 -0.86 . . . . 0.0 110.127 179.824 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 2.0 tt0 52.16 60.54 13.31 Favored Pre-proline 0 N--CA 1.491 1.61 0 O-C-N 121.246 -0.908 . . . . 0.0 110.306 -179.947 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 27' ' ' PRO . . . . . . . . . . . . . 45.2 Cg_endo -71.35 151.5 60.01 Favored 'Trans proline' 0 C--N 1.313 -1.341 0 O-C-N 123.586 1.308 . . . . 0.0 110.505 -179.973 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 45.2 Cg_endo -70.62 -33.25 13.62 Favored 'Trans proline' 0 C--N 1.311 -1.421 0 O-C-N 123.637 1.335 . . . . 0.0 110.392 179.873 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -118.35 117.13 28.24 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.304 -0.873 . . . . 0.0 110.207 -179.998 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -82.3 -46.49 13.58 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.296 -0.877 . . . . 0.0 110.013 179.9 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 40.7 t -53.62 -51.83 39.39 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.695 0 O-C-N 121.384 -0.823 . . . . 0.0 109.608 179.569 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 7.9 t0 -67.95 -35.78 78.98 Favored 'General case' 0 C--N 1.303 -1.45 0 O-C-N 121.648 -0.657 . . . . 0.0 109.782 179.812 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 33' ' ' PHE . . . . . . . . . . . . . 44.0 t80 -67.03 -44.69 79.58 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.23 -0.919 . . . . 0.0 109.396 179.359 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 34' ' ' ALA . . . . . 0.467 ' HB3' ' CD2' ' A' ' 38' ' ' PHE . . . -57.49 -36.89 72.07 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.363 -0.835 . . . . 0.0 109.777 179.604 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 35' ' ' VAL . . . . . . . . . . . . . 99.4 t -69.5 -43.91 80.28 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.301 0 O-C-N 121.298 -0.876 . . . . 0.0 110.018 179.79 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -67.28 -30.47 70.35 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.244 -0.91 . . . . 0.0 110.046 179.755 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 37' ' ' TYR . . . . . 0.468 ' CE1' ' OE1' ' B' ' 21' ' ' GLU . 82.9 t80 -73.67 -63.39 1.21 Allowed 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.349 -0.844 . . . . 0.0 110.185 179.977 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 38' ' ' PHE . . . . . 0.43 ' CD2' ' HB1' ' A' ' 34' ' ' ALA . 9.3 m-85 -57.04 -48.7 77.9 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.259 -0.901 . . . . 0.0 110.413 -179.976 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 39' ' ' THR . . . . . . . . . . . . . 57.4 m -53.93 -36.63 62.98 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.139 -0.976 . . . . 0.0 110.013 179.848 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.36 -25.85 61.68 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.292 -0.88 . . . . 0.0 109.923 179.706 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 4.7 mt -72.79 -28.87 62.85 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.254 -0.904 . . . . 0.0 110.025 179.879 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -76.5 -23.46 53.73 Favored 'General case' 0 C--N 1.306 -1.284 0 O-C-N 121.302 -0.874 . . . . 0.0 109.717 179.882 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 43' ' ' GLU . . . . . . . . . . . . . 26.3 mt-10 . . . . . 0 N--CA 1.491 1.599 0 O-C-N 121.297 -0.877 . . . . 0.0 110.188 179.907 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' C' C ' 2' ' ' LEU . . . . . . . . . . . . . 5.5 mp . . . . . 0 N--CA 1.493 1.688 0 CA-C-O 121.192 0.52 . . . . 0.0 110.585 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' C' C ' 3' ' ' ILE . . . . . . . . . . . . . 19.3 tt -88.27 -18.87 7.92 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.636 0 O-C-N 121.165 -0.96 . . . . 0.0 110.295 179.894 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 4' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -98.35 -9.22 25.68 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.179 -0.951 . . . . 0.0 110.785 -179.892 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 5' ' ' THR . . . . . . . . . . . . . 65.9 m -113.29 -54.12 2.64 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 120.983 -1.073 . . . . 0.0 110.511 -179.807 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 6' ' ' ALA . . . . . . . . . . . . . . . -61.76 -56.95 14.14 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.124 -0.985 . . . . 0.0 110.316 -179.785 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 7' ' ' SER . . . . . . . . . . . . . 47.4 m -65.4 -25.2 67.44 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.224 -0.923 . . . . 0.0 110.339 -179.857 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 8' ' ' SER . . . . . . . . . . . . . 1.1 t -82.87 -39.49 21.54 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.206 -0.934 . . . . 0.0 110.403 -179.916 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 9' ' ' LEU . . . . . . . . . . . . . 29.7 mt -61.06 -55.39 33.17 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.207 -0.933 . . . . 0.0 110.399 -179.891 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 10' ' ' VAL . . . . . . . . . . . . . 12.3 p -58.17 -38.97 71.19 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.601 0 O-C-N 121.163 -0.961 . . . . 0.0 110.213 -179.941 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 11' ' ' LYS . . . . . . . . . . . . . 5.2 tttm -54.76 -57.79 10.13 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.239 -0.913 . . . . 0.0 110.211 -179.927 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' C' C ' 12' ' ' ASN . . . . . . . . . . . . . 2.8 m-20 . . . . . 0 N--CA 1.49 1.567 0 O-C-N 121.161 -0.962 . . . . 0.0 110.064 179.917 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 2.1 t-160 . . . . . 0 N--CA 1.492 1.633 0 CA-C-O 121.288 0.566 . . . . 0.0 110.29 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -151.22 121.42 7.24 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.287 -0.883 . . . . 0.0 110.128 179.947 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 108.91 59.06 0.53 Allowed Glycine 0 N--CA 1.491 2.308 0 N-CA-C 109.577 -1.409 . . . . 0.0 109.577 -179.983 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -162.49 158.42 23.63 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.254 -1.145 . . . . 0.0 110.091 179.932 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 5.8 tp -102.2 155.25 4.98 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.621 0 O-C-N 121.291 -0.881 . . . . 0.0 110.075 179.985 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -135.24 105.75 6.43 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.297 -0.877 . . . . 0.0 110.338 -179.981 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 31.2 mm -101.34 108.72 56.39 Favored Pre-proline 0 N--CA 1.49 1.561 0 O-C-N 121.283 -0.886 . . . . 0.0 109.986 179.849 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 44.5 Cg_endo -70.4 131.01 19.49 Favored 'Trans proline' 0 C--N 1.312 -1.355 0 O-C-N 123.484 1.255 . . . . 0.0 110.467 -179.948 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 48.1 Cg_endo -74.73 155.41 44.25 Favored 'Trans proline' 0 C--N 1.313 -1.332 0 O-C-N 123.531 1.279 . . . . 0.0 110.401 -179.979 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 121.68 -23.99 7.3 Favored Glycine 0 N--CA 1.49 2.238 0 N-CA-C 109.498 -1.441 . . . . 0.0 109.498 -179.922 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -76.0 -21.98 56.32 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.232 -1.158 . . . . 0.0 110.099 179.937 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 92.6 m -74.07 -37.35 64.26 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.236 -0.915 . . . . 0.0 110.213 -179.97 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -82.04 -47.46 12.6 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.367 -0.833 . . . . 0.0 110.208 179.986 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -53.45 -41.72 66.41 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.177 -0.952 . . . . 0.0 110.115 179.86 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 71.0 mt -71.48 -37.53 71.29 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.191 -0.943 . . . . 0.0 109.989 179.789 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.38 -34.13 77.46 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.275 -0.891 . . . . 0.0 110.137 179.893 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -67.43 -45.23 80.38 Favored Glycine 0 N--CA 1.491 2.315 0 N-CA-C 109.218 -1.553 . . . . 0.0 109.218 179.721 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 20.4 t80 -63.6 -47.22 82.33 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.346 -1.091 . . . . 0.0 109.697 179.581 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 59.4 m -57.42 -27.1 62.1 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.329 -0.857 . . . . 0.0 110.139 179.715 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 46.1 t -74.74 -73.91 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.59 0 O-C-N 121.396 -0.815 . . . . 0.0 110.316 -179.959 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.469 ' OE1' ' CE1' ' A' ' 37' ' ' TYR . 10.3 pt-20 -44.7 -44.32 9.05 Favored 'General case' 0 N--CA 1.497 1.898 0 O-C-N 121.482 -0.761 . . . . 0.0 111.319 -179.443 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 89.6 t -55.21 -50.84 61.08 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.638 0 O-C-N 120.96 -1.087 . . . . 0.0 110.188 179.969 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 88.8 mt -77.34 -3.64 41.05 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.319 -0.863 . . . . 0.0 110.892 -179.734 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -106.72 -52.78 2.72 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 120.923 -1.111 . . . . 0.0 110.388 -179.919 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 3.3 tp-100 -78.89 -24.98 43.83 Favored 'General case' 0 C--N 1.306 -1.322 0 O-C-N 121.278 -0.889 . . . . 0.0 109.831 -179.999 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 2.7 mt-30 52.77 70.85 1.64 Allowed Pre-proline 0 N--CA 1.491 1.59 0 O-C-N 121.192 -0.942 . . . . 0.0 110.091 179.996 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 45.4 Cg_endo -70.3 159.7 52.08 Favored 'Trans proline' 0 C--N 1.31 -1.485 0 O-C-N 123.67 1.353 . . . . 0.0 110.5 -179.95 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 44.4 Cg_endo -71.22 -30.4 15.95 Favored 'Trans proline' 0 C--N 1.311 -1.402 0 O-C-N 123.761 1.4 . . . . 0.0 110.278 179.96 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -140.26 116.01 10.23 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.267 -0.896 . . . . 0.0 110.17 179.864 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 16.7 tp -67.45 -38.73 84.92 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.221 -0.924 . . . . 0.0 109.955 179.972 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 42.6 t -55.06 -66.55 0.26 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.632 0 O-C-N 121.379 -0.825 . . . . 0.0 109.837 179.796 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -56.78 -34.63 67.81 Favored 'General case' 0 N--CA 1.487 1.406 0 O-C-N 121.48 -0.763 . . . . 0.0 109.819 179.735 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 46.1 t80 -64.18 -47.71 78.76 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.269 -0.895 . . . . 0.0 109.609 179.337 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . 0.471 ' O ' ' CD2' ' A' ' 38' ' ' PHE . . . -52.53 -32.07 38.7 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.369 -0.832 . . . . 0.0 110.132 179.762 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 58.5 t -74.86 -39.04 45.0 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.388 0 O-C-N 121.379 -0.826 . . . . 0.0 110.356 -179.963 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 39.5 mm-40 -72.23 -32.0 66.33 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.148 -0.97 . . . . 0.0 110.479 -179.763 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . 0.469 ' CE1' ' OE1' ' A' ' 21' ' ' GLU . 34.1 t80 -73.37 -68.88 0.46 Allowed 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.256 -0.902 . . . . 0.0 110.594 -179.686 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . 0.471 ' CD2' ' O ' ' A' ' 34' ' ' ALA . 24.1 m-85 -50.28 -49.51 53.16 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.207 -0.933 . . . . 0.0 110.665 -179.565 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 45.5 m -52.35 -40.51 62.05 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.151 -0.968 . . . . 0.0 109.941 179.912 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 12.0 mtt85 -74.93 -27.0 60.03 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.253 -0.904 . . . . 0.0 109.717 179.562 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -58.23 -32.38 68.27 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.317 -0.865 . . . . 0.0 109.745 179.655 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.417 ' NH2' ' OD1' ' B' ' 32' ' ' ASP . 5.0 ttp180 -53.09 -43.42 66.77 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.385 -0.822 . . . . 0.0 110.158 179.945 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 5.5 mt-10 -75.32 -30.88 60.46 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.327 -0.858 . . . . 0.0 110.468 -179.748 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -56.86 -75.99 0.04 OUTLIER 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.185 -0.947 . . . . 0.0 110.663 -179.787 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -49.54 157.51 0.52 Allowed 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.404 -0.81 . . . . 0.0 110.731 -179.118 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.493 1.678 0 CA-C-O 117.88 -1.057 . . . . 0.0 110.22 -179.948 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 1' ' ' HIS . . . . . . . . . . . . . 3.7 m170 . . . . . 0 N--CA 1.492 1.644 0 CA-C-O 121.085 0.469 . . . . 0.0 110.263 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 2' ' ' MET . . . . . . . . . . . . . 2.5 ttm -62.62 155.95 24.68 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.278 -0.888 . . . . 0.0 110.206 -179.996 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 3' ' ' GLY . . . . . . . . . . . . . . . 108.11 -122.85 6.87 Favored Glycine 0 N--CA 1.491 2.304 0 N-CA-C 109.51 -1.436 . . . . 0.0 109.51 179.985 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 4' ' ' HIS . . . . . . . . . . . . . 1.2 t-80 -165.16 -65.72 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.218 -1.166 . . . . 0.0 110.222 -179.951 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 5' ' ' ILE . . . . . . . . . . . . . 35.5 mm -117.22 148.89 19.67 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.622 0 O-C-N 121.253 -0.904 . . . . 0.0 110.206 179.929 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 6' ' ' GLN . . . . . . . . . . . . . 5.2 mt-30 -137.19 179.93 6.1 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.232 -0.918 . . . . 0.0 110.338 179.998 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 7' ' ' ILE . . . . . . . . . . . . . 38.6 mm -53.16 109.36 1.44 Allowed Pre-proline 0 N--CA 1.492 1.66 0 O-C-N 121.285 -0.884 . . . . 0.0 110.394 -179.839 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 47.8 Cg_endo -72.6 134.94 23.11 Favored 'Trans proline' 0 C--N 1.313 -1.315 0 O-C-N 123.562 1.296 . . . . 0.0 110.671 179.997 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 9' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_endo -76.82 165.21 28.95 Favored 'Trans proline' 0 C--N 1.313 -1.34 0 O-C-N 123.594 1.312 . . . . 0.0 110.378 179.848 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 108.65 -26.09 17.21 Favored Glycine 0 N--CA 1.491 2.33 0 N-CA-C 109.93 -1.268 . . . . 0.0 109.93 179.64 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -80.2 -26.8 39.04 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.16 -1.2 . . . . 0.0 110.267 -179.89 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 88.8 m -68.53 -36.99 79.61 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.194 -0.941 . . . . 0.0 110.344 179.993 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -74.27 -40.48 62.3 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.28 -0.888 . . . . 0.0 110.111 179.923 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 3.2 mt -62.68 -37.6 87.1 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.183 -0.948 . . . . 0.0 110.055 179.786 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -72.84 -49.07 32.45 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.324 -0.86 . . . . 0.0 110.054 179.859 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 16' ' ' GLN . . . . . 0.42 ' O ' ' CG2' ' B' ' 20' ' ' VAL . 2.5 mt-30 -55.52 -37.54 68.04 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.282 -0.886 . . . . 0.0 110.013 179.789 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 17' ' ' GLY . . . . . . . . . . . . . . . -62.59 -40.29 98.95 Favored Glycine 0 N--CA 1.489 2.224 0 N-CA-C 109.0 -1.64 . . . . 0.0 109.0 179.769 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 18' ' ' TYR . . . . . 0.427 ' O ' ' CG2' ' B' ' 22' ' ' VAL . 34.1 t80 -71.17 -53.71 13.53 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.304 -1.116 . . . . 0.0 109.722 179.572 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 90.6 m -51.1 -27.07 7.48 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.239 -0.913 . . . . 0.0 110.185 179.721 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 20' ' ' VAL . . . . . 0.42 ' CG2' ' O ' ' B' ' 16' ' ' GLN . 55.7 t -73.88 -75.44 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.651 0 O-C-N 121.316 -0.865 . . . . 0.0 109.829 179.669 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 21' ' ' GLU . . . . . 0.427 ' HG3' ' N ' ' B' ' 22' ' ' VAL . 11.0 pt-20 -47.09 -41.5 17.28 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.459 -0.775 . . . . 0.0 110.793 -179.849 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 22' ' ' VAL . . . . . 0.427 ' CG2' ' O ' ' B' ' 18' ' ' TYR . 78.7 t -55.94 -44.9 79.59 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.575 0 O-C-N 121.176 -0.953 . . . . 0.0 110.116 179.912 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -73.22 -26.18 61.03 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.196 -0.94 . . . . 0.0 110.4 -179.86 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.55 -55.47 4.11 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.113 -0.992 . . . . 0.0 110.425 -179.868 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 25' ' ' GLN . . . . . 0.437 ' O ' ' CG ' ' B' ' 26' ' ' GLN . 5.6 mp0 -65.67 -20.35 66.26 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.147 -0.97 . . . . 0.0 110.657 -179.708 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 26' ' ' GLN . . . . . 0.437 ' CG ' ' O ' ' B' ' 25' ' ' GLN . 12.7 pt20 36.45 55.22 2.91 Favored Pre-proline 0 N--CA 1.507 2.38 0 O-C-N 122.058 -0.401 . . . . 0.0 111.534 -179.791 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 27' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_endo -68.09 152.02 76.82 Favored 'Trans proline' 0 C--N 1.31 -1.488 0 O-C-N 123.678 1.357 . . . . 0.0 110.526 -179.798 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 44.3 Cg_endo -71.06 -14.41 31.96 Favored 'Trans proline' 0 C--N 1.312 -1.392 0 O-C-N 123.755 1.397 . . . . 0.0 110.503 -179.958 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 12.5 m-20 -137.46 111.2 8.16 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.066 -1.021 . . . . 0.0 110.282 179.915 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -76.73 -34.19 58.11 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.345 -0.847 . . . . 0.0 109.492 179.641 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 21.6 t -61.93 -50.8 78.65 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.603 0 CA-C-O 121.658 0.742 . . . . 0.0 109.468 179.484 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 32' ' ' ASP . . . . . 0.417 ' OD1' ' NH2' ' A' ' 42' ' ' ARG . 10.5 t70 -67.61 -30.25 69.78 Favored 'General case' 0 C--N 1.303 -1.456 0 O-C-N 121.643 -0.661 . . . . 0.0 109.97 179.775 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 33' ' ' PHE . . . . . . . . . . . . . 83.5 t80 -72.68 -39.48 67.03 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.273 -0.892 . . . . 0.0 109.501 179.284 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -65.83 -38.35 88.67 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.376 -0.827 . . . . 0.0 109.938 179.633 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 35' ' ' VAL . . . . . . . . . . . . . 96.8 t -73.8 -32.58 35.01 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.325 0 O-C-N 121.309 -0.87 . . . . 0.0 110.195 179.886 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -80.13 -30.18 38.98 Favored 'General case' 0 N--CA 1.487 1.42 0 O-C-N 121.262 -0.899 . . . . 0.0 109.592 179.892 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 37' ' ' TYR . . . . . . . . . . . . . 16.5 t80 -76.96 -64.14 1.2 Allowed 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.18 -0.95 . . . . 0.0 110.205 -179.957 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 12.7 m-85 -51.95 -50.27 61.54 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.255 -0.903 . . . . 0.0 110.444 -179.845 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 39' ' ' THR . . . . . . . . . . . . . 43.1 m -53.19 -40.98 64.82 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.2 -0.938 . . . . 0.0 110.031 179.853 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 16.6 ttt85 -72.13 -25.27 61.66 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.266 -0.896 . . . . 0.0 110.076 179.766 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -57.68 -55.27 37.02 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.262 -0.899 . . . . 0.0 110.089 179.856 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.93 -36.22 26.95 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.16 -0.963 . . . . 0.0 110.633 -179.958 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 43' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -75.77 -21.01 57.83 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.211 -0.931 . . . . 0.0 110.371 -179.844 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -71.18 -69.3 0.38 Allowed 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.171 -0.956 . . . . 0.0 110.28 179.949 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 45' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.16 -30.68 7.1 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.56 -0.713 . . . . 0.0 110.684 -179.233 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.491 1.617 0 CA-C-O 118.024 -0.988 . . . . 0.0 110.174 -179.979 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 1' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.618 0 CA-C-O 121.331 0.586 . . . . 0.0 110.185 . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 2' ' ' LEU . . . . . . . . . . . . . 4.0 tp -130.03 -43.87 1.19 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.237 -0.914 . . . . 0.0 110.222 179.933 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 3' ' ' ILE . . . . . . . . . . . . . 1.8 pp -63.09 -23.16 32.55 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.591 0 O-C-N 121.339 -0.851 . . . . 0.0 110.239 -179.977 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 4' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 -78.6 -32.35 47.54 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.235 -0.916 . . . . 0.0 110.329 -179.918 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 5' ' ' THR . . . . . . . . . . . . . 93.1 m -74.82 -34.57 62.38 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.221 -0.924 . . . . 0.0 110.262 -179.958 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 6' ' ' ALA . . . . . . . . . . . . . . . -77.7 -37.92 48.48 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.243 -0.911 . . . . 0.0 110.306 -179.895 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 7' ' ' SER . . . . . . . . . . . . . 31.9 m -52.44 -69.85 0.1 Allowed 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.157 -0.964 . . . . 0.0 110.204 -179.885 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 8' ' ' SER . . . . . . . . . . . . . 1.9 m -58.68 -24.54 61.52 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.262 -0.899 . . . . 0.0 110.265 179.908 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 9' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -52.24 -43.14 64.15 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.248 -0.907 . . . . 0.0 110.301 -179.923 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 10' ' ' VAL . . . . . . . . . . . . . 71.1 t -71.95 -30.11 35.73 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.595 0 O-C-N 121.166 -0.959 . . . . 0.0 110.309 -179.887 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 11' ' ' LYS . . . . . . . . . . . . . 34.4 mmtm -66.05 -48.6 70.51 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.19 -0.944 . . . . 0.0 110.361 -179.901 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 12' ' ' ASN . . . . . . . . . . . . . 28.7 m-80 -65.89 -27.11 67.96 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.288 -0.882 . . . . 0.0 110.262 -179.918 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 13' ' ' ALA . . . . . . . . . . . . . . . -71.32 -41.17 70.22 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.192 -0.943 . . . . 0.0 110.284 -179.958 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 14' ' ' ILE . . . . . . . . . . . . . 91.7 mt -66.86 -46.6 84.86 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.658 0 O-C-N 121.232 -0.917 . . . . 0.0 110.202 -179.943 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 15' ' ' GLN . . . . . 0.42 ' O ' ' N ' ' C' ' 17' ' ' SER . 2.1 mm-40 -58.61 -58.32 9.08 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.153 -0.967 . . . . 0.0 110.249 179.944 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 16' ' ' LEU . . . . . . . . . . . . . 1.4 tp -68.81 65.5 0.13 Allowed 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.415 -0.803 . . . . 0.0 110.175 179.939 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 17' ' ' SER . . . . . 0.42 ' N ' ' O ' ' C' ' 15' ' ' GLN . 7.5 t -175.06 -57.74 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.178 -0.952 . . . . 0.0 110.144 -179.864 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 18' ' ' ILE . . . . . . . . . . . . . 1.3 pp -80.84 -20.45 11.4 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.615 0 O-C-N 121.288 -0.882 . . . . 0.0 110.381 -179.909 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 19' ' ' GLU . . . . . . . . . . . . . 14.2 tt0 -70.68 64.41 0.3 Allowed 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.247 -0.908 . . . . 0.0 109.251 179.409 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 20' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER 55.53 25.99 8.54 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.257 -0.902 . . . . 0.0 109.135 -179.003 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 21' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER 56.18 47.97 18.35 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.526 -0.734 . . . . 0.0 109.818 -179.599 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 22' ' ' VAL . . . . . . . . . . . . . 69.5 t . . . . . 0 N--CA 1.491 1.622 0 CA-C-O 118.005 -0.998 . . . . 0.0 110.002 -179.987 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 2.6 t60 . . . . . 0 N--CA 1.492 1.629 0 CA-C-O 121.232 0.539 . . . . 0.0 110.2 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 3.2 mtt -99.47 40.55 1.21 Allowed 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.279 -0.888 . . . . 0.0 110.075 179.862 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 76.19 109.9 0.12 Allowed Glycine 0 N--CA 1.49 2.284 0 N-CA-C 109.506 -1.437 . . . . 0.0 109.506 -179.903 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 8.9 p-80 -119.96 27.52 8.63 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.248 -1.148 . . . . 0.0 110.295 -179.959 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -128.1 151.52 35.02 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.591 0 O-C-N 121.179 -0.951 . . . . 0.0 110.491 -179.79 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 16.2 tt0 -146.65 63.52 1.2 Allowed 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.262 -0.899 . . . . 0.0 110.185 179.845 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 8.2 mt -114.19 104.16 54.86 Favored Pre-proline 0 N--CA 1.491 1.591 0 O-C-N 121.266 -0.896 . . . . 0.0 110.3 179.994 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 46.7 Cg_endo -72.19 124.2 9.81 Favored 'Trans proline' 0 C--N 1.311 -1.421 0 O-C-N 123.633 1.333 . . . . 0.0 110.52 179.996 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 47.4 Cg_endo -72.78 157.25 52.17 Favored 'Trans proline' 0 C--N 1.314 -1.254 0 O-C-N 123.522 1.275 . . . . 0.0 110.465 179.88 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 109.48 -26.33 15.03 Favored Glycine 0 N--CA 1.492 2.396 0 N-CA-C 109.608 -1.397 . . . . 0.0 109.608 179.924 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -69.06 -23.14 64.0 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.236 -1.156 . . . . 0.0 110.35 -179.881 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 31.9 m -76.91 -51.15 11.72 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.221 -0.925 . . . . 0.0 110.259 -179.96 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -57.77 -31.71 66.79 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.262 -0.899 . . . . 0.0 110.272 -179.923 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.1 mp -72.29 -40.35 67.64 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.357 -0.84 . . . . 0.0 110.282 -179.882 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 5.8 mp -77.79 -52.76 8.4 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.284 -0.885 . . . . 0.0 110.246 -179.94 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -51.79 -44.27 63.38 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.185 -0.947 . . . . 0.0 110.257 179.956 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -58.38 -47.76 87.82 Favored Glycine 0 N--CA 1.49 2.297 0 N-CA-C 109.149 -1.58 . . . . 0.0 109.149 179.729 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . 0.418 ' O ' ' CG2' ' A' ' 22' ' ' VAL . 46.8 t80 -61.15 -47.19 87.37 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.271 -1.135 . . . . 0.0 109.629 179.466 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 7.9 m -56.58 -36.11 68.97 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.361 -0.837 . . . . 0.0 110.147 179.743 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 41.6 t -67.15 -71.95 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.674 0 O-C-N 121.293 -0.879 . . . . 0.0 110.216 -179.981 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 5.4 pt-20 -46.58 -49.11 19.33 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.357 -0.839 . . . . 0.0 111.425 -179.392 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.418 ' CG2' ' O ' ' A' ' 18' ' ' TYR . 93.5 t -50.8 -44.28 26.16 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.717 0 O-C-N 120.774 -1.204 . . . . 0.0 110.529 -179.777 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -73.26 -25.1 60.56 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.218 -0.926 . . . . 0.0 110.252 -179.987 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -76.49 -69.39 0.51 Allowed 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.255 -0.903 . . . . 0.0 110.417 -179.929 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 2.7 pt20 -71.94 -33.67 68.42 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.126 -0.984 . . . . 0.0 110.285 -179.845 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 52.13 81.38 0.26 Allowed Pre-proline 0 N--CA 1.492 1.662 0 O-C-N 121.275 -0.891 . . . . 0.0 110.18 179.965 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 44.8 Cg_endo -71.82 162.3 42.4 Favored 'Trans proline' 0 C--N 1.311 -1.442 0 O-C-N 123.727 1.383 . . . . 0.0 110.528 -179.82 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo -70.14 -26.4 25.81 Favored 'Trans proline' 0 C--N 1.311 -1.44 0 O-C-N 123.803 1.423 . . . . 0.0 110.142 179.828 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 9.6 m-20 -139.15 112.22 8.0 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.361 -0.837 . . . . 0.0 109.726 179.588 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 3.5 tp -74.7 -33.49 62.44 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.32 -0.862 . . . . 0.0 110.29 -179.7 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 43.2 t -50.78 -54.66 9.12 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.714 0 O-C-N 121.275 -0.89 . . . . 0.0 110.112 179.812 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -66.19 -44.18 84.7 Favored 'General case' 0 C--N 1.301 -1.533 0 O-C-N 121.565 -0.709 . . . . 0.0 110.148 179.911 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 36.7 t80 -58.18 -50.3 74.0 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.082 -1.011 . . . . 0.0 109.756 179.532 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -49.22 -39.48 30.04 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.42 -0.8 . . . . 0.0 110.515 179.891 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 90.3 t -73.88 -38.85 51.01 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.366 0 O-C-N 121.221 -0.924 . . . . 0.0 110.423 -179.883 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -74.17 -20.56 60.17 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.201 -0.937 . . . . 0.0 110.548 -179.661 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 26.6 t80 -75.65 -59.61 2.67 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.191 -0.943 . . . . 0.0 110.466 -179.899 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 23.6 m-85 -67.44 -48.69 66.5 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.225 -0.922 . . . . 0.0 110.51 -179.824 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 94.8 m -50.42 -41.56 52.62 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.174 -0.954 . . . . 0.0 110.29 -179.943 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 1.5 ttt180 -70.25 -25.2 63.26 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.177 -0.952 . . . . 0.0 110.13 179.697 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -62.54 -34.23 76.5 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.258 -0.901 . . . . 0.0 109.954 179.888 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.64 -37.49 65.73 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.352 -0.843 . . . . 0.0 110.275 179.92 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -84.01 -25.53 29.87 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.217 -0.927 . . . . 0.0 110.4 -179.887 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -57.66 -78.52 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.169 -0.957 . . . . 0.0 110.345 -179.983 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER 45.33 -152.78 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.68 -0.637 . . . . 0.0 111.013 -179.695 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 3.2 ptt180 . . . . . 0 N--CA 1.492 1.635 0 CA-C-O 118.062 -0.971 . . . . 0.0 110.175 179.945 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 1' ' ' HIS . . . . . 0.44 ' CD2' ' N ' ' B' ' 1' ' ' HIS . 6.1 p80 . . . . . 0 N--CA 1.492 1.671 0 CA-C-O 121.189 0.518 . . . . 0.0 110.24 . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 2' ' ' MET . . . . . . . . . . . . . 3.9 ttt -134.67 -62.21 0.74 Allowed 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.276 -0.89 . . . . 0.0 110.388 -179.834 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 3' ' ' GLY . . . . . . . . . . . . . . . -103.96 -164.88 24.97 Favored Glycine 0 N--CA 1.49 2.286 0 N-CA-C 109.684 -1.367 . . . . 0.0 109.684 -179.833 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 4' ' ' HIS . . . . . . . . . . . . . 9.8 p-80 -169.01 -172.38 1.54 Allowed 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.364 -1.08 . . . . 0.0 110.205 -179.99 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 5' ' ' ILE . . . . . . . . . . . . . 9.8 tp -124.57 164.79 22.53 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.548 0 O-C-N 121.237 -0.914 . . . . 0.0 110.26 -179.936 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 6' ' ' GLN . . . . . . . . . . . . . 12.0 tp60 -139.14 79.42 1.72 Allowed 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.225 -0.922 . . . . 0.0 110.198 -179.983 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 7' ' ' ILE . . . . . . . . . . . . . 14.4 mt -146.69 108.59 4.08 Favored Pre-proline 0 N--CA 1.491 1.601 0 O-C-N 121.239 -0.913 . . . . 0.0 110.198 -179.983 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 47.7 Cg_endo -72.44 127.32 12.43 Favored 'Trans proline' 0 C--N 1.311 -1.409 0 O-C-N 123.591 1.311 . . . . 0.0 110.349 179.927 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 9' ' ' PRO . . . . . . . . . . . . . 45.3 Cg_endo -72.53 177.8 7.01 Favored 'Trans proline' 0 C--N 1.313 -1.34 0 O-C-N 123.522 1.275 . . . . 0.0 110.49 179.967 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 99.28 -40.28 2.49 Favored Glycine 0 N--CA 1.491 2.3 0 N-CA-C 109.473 -1.451 . . . . 0.0 109.473 -179.943 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.22 -23.94 67.65 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.306 -1.114 . . . . 0.0 110.26 179.994 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 95.5 m -62.94 -61.38 2.43 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.223 -0.923 . . . . 0.0 110.214 179.929 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 -52.3 -32.81 39.38 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.342 -0.849 . . . . 0.0 110.248 -179.979 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 14.1 mt -66.59 -56.94 8.41 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.285 -0.884 . . . . 0.0 110.429 -179.852 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 14.3 mt -66.03 -48.95 69.41 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.218 -0.926 . . . . 0.0 110.27 -179.943 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -52.02 -47.49 64.98 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.139 -0.976 . . . . 0.0 110.028 179.826 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 17' ' ' GLY . . . . . . . . . . . . . . . -55.14 -42.54 82.04 Favored Glycine 0 N--CA 1.49 2.3 0 N-CA-C 109.066 -1.614 . . . . 0.0 109.066 179.508 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 18' ' ' TYR . . . . . 0.45 ' CE1' ' CD2' ' B' ' 33' ' ' PHE . 19.0 t80 -64.87 -45.27 86.73 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.323 -1.104 . . . . 0.0 109.561 179.365 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 6.6 m -58.28 -24.08 58.36 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.424 -0.798 . . . . 0.0 110.022 179.675 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 51.2 t -78.07 -74.07 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.608 0 O-C-N 121.351 -0.843 . . . . 0.0 110.413 -179.828 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -45.28 -44.62 11.52 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.464 -0.772 . . . . 0.0 111.194 -179.305 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 22' ' ' VAL . . . . . . . . . . . . . 86.0 t -59.24 -47.17 91.25 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.6 0 O-C-N 120.947 -1.096 . . . . 0.0 109.737 179.808 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 3.0 tp -72.65 -19.45 61.44 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.293 -0.879 . . . . 0.0 110.038 179.594 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -81.5 -59.07 2.75 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.297 -0.877 . . . . 0.0 110.33 -179.913 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 25' ' ' GLN . . . . . 0.44 ' HG3' ' N ' ' B' ' 26' ' ' GLN . 0.0 OUTLIER -89.82 -23.01 21.82 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.206 -0.934 . . . . 0.0 110.586 -179.653 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 26' ' ' GLN . . . . . 0.44 ' N ' ' HG3' ' B' ' 25' ' ' GLN . 7.6 mt-30 47.96 81.78 0.25 Allowed Pre-proline 0 N--CA 1.494 1.76 0 O-C-N 121.159 -0.963 . . . . 0.0 110.674 179.752 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 27' ' ' PRO . . . . . . . . . . . . . 44.9 Cg_endo -73.09 166.55 29.71 Favored 'Trans proline' 0 C--N 1.31 -1.483 0 O-C-N 123.615 1.324 . . . . 0.0 110.598 -179.815 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 44.3 Cg_endo -70.52 -49.17 0.47 Allowed 'Trans proline' 0 C--N 1.311 -1.41 0 O-C-N 123.749 1.394 . . . . 0.0 110.176 179.785 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 10.0 m-20 -119.37 116.87 27.08 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.237 -0.914 . . . . 0.0 110.081 179.718 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -71.46 -29.26 64.65 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.27 -0.894 . . . . 0.0 110.444 -179.708 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 43.4 t -49.9 -65.39 0.24 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.784 0 O-C-N 121.189 -0.945 . . . . 0.0 110.054 179.83 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 4.3 t0 -56.54 -46.54 80.59 Favored 'General case' 0 C--N 1.302 -1.492 0 O-C-N 121.466 -0.771 . . . . 0.0 109.961 179.679 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 33' ' ' PHE . . . . . 0.45 ' CD2' ' CE1' ' B' ' 18' ' ' TYR . 67.7 t80 -54.83 -47.35 74.21 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.174 -0.954 . . . . 0.0 109.832 179.68 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -56.1 -40.19 73.31 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.324 -0.86 . . . . 0.0 109.935 179.74 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 35' ' ' VAL . . . . . 0.424 ' O ' ' CB ' ' B' ' 39' ' ' THR . 76.9 t -77.32 -45.65 29.31 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.323 0 O-C-N 121.306 -0.871 . . . . 0.0 109.82 179.77 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -61.23 -36.26 79.48 Favored 'General case' 0 N--CA 1.487 1.403 0 O-C-N 121.3 -0.875 . . . . 0.0 109.329 179.495 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 37' ' ' TYR . . . . . . . . . . . . . 61.6 t80 -68.9 -59.34 3.13 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.295 -0.878 . . . . 0.0 110.141 179.872 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 12.1 m-85 -64.19 -49.57 71.52 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.257 -0.902 . . . . 0.0 110.576 -179.65 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 39' ' ' THR . . . . . 0.424 ' CB ' ' O ' ' B' ' 35' ' ' VAL . 94.2 m -51.53 -27.7 11.54 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.1 -1.0 . . . . 0.0 110.056 179.953 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -75.49 -35.65 60.76 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.295 -0.878 . . . . 0.0 109.77 179.528 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.02 -27.83 68.61 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.389 -0.82 . . . . 0.0 110.301 179.926 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.26 -28.28 63.02 Favored 'General case' 0 N--CA 1.486 1.343 0 O-C-N 121.263 -0.898 . . . . 0.0 110.04 -179.922 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 43' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -104.88 13.56 30.95 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.125 -0.984 . . . . 0.0 110.565 179.937 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -120.42 -70.44 0.79 Allowed 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.107 -0.996 . . . . 0.0 110.369 179.956 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 45' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -49.96 102.86 0.04 OUTLIER 'General case' 0 N--CA 1.488 1.435 0 O-C-N 121.525 -0.734 . . . . 0.0 110.608 -179.147 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.588 0 CA-C-O 117.948 -1.025 . . . . 0.0 110.226 -179.981 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 1' ' ' LEU . . . . . 0.436 ' O ' ' N ' ' C' ' 3' ' ' ILE . 0.8 OUTLIER . . . . . 0 N--CA 1.492 1.643 0 CA-C-O 120.906 0.384 . . . . 0.0 110.634 . . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 2' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER 63.96 -72.87 0.05 Allowed 'General case' 0 N--CA 1.498 1.972 0 O-C-N 121.346 -0.846 . . . . 0.0 110.553 -179.938 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 3' ' ' ILE . . . . . 0.436 ' N ' ' O ' ' C' ' 1' ' ' LEU . 2.9 mp -55.48 -23.37 13.97 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.61 0 O-C-N 121.083 -1.011 . . . . 0.0 110.321 -179.888 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 4' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -103.62 20.49 17.87 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.278 -0.889 . . . . 0.0 110.306 -179.883 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 5' ' ' THR . . . . . . . . . . . . . 78.7 m -138.34 -47.93 0.53 Allowed 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.189 -0.944 . . . . 0.0 110.078 179.825 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 6' ' ' ALA . . . . . . . . . . . . . . . -61.39 -36.18 79.55 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.235 -0.916 . . . . 0.0 110.065 179.877 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 7' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -60.79 -45.43 94.4 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.28 -0.888 . . . . 0.0 110.117 179.884 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 8' ' ' SER . . . . . . . . . . . . . 6.3 t -70.92 -29.62 65.72 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.276 -0.89 . . . . 0.0 110.095 179.8 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 9' ' ' LEU . . . . . . . . . . . . . 3.2 tp -68.68 -62.8 1.23 Allowed 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.277 -0.89 . . . . 0.0 110.158 179.945 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 10' ' ' VAL . . . . . 0.412 ' O ' ' CD1' ' C' ' 14' ' ' ILE . 35.2 m -53.85 -27.78 16.07 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.628 0 O-C-N 121.314 -0.866 . . . . 0.0 110.173 -179.94 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 11' ' ' LYS . . . . . . . . . . . . . 1.8 tppt? -70.37 -38.72 74.8 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.291 -0.881 . . . . 0.0 110.255 -179.951 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 12' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 -81.94 -25.83 34.54 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.241 -0.912 . . . . 0.0 110.139 179.937 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 13' ' ' ALA . . . . . . . . . . . . . . . -69.75 -29.88 67.34 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.255 -0.903 . . . . 0.0 110.176 179.868 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 14' ' ' ILE . . . . . 0.412 ' CD1' ' O ' ' C' ' 10' ' ' VAL . 19.6 mt -87.17 -42.26 15.19 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.616 0 O-C-N 121.289 -0.882 . . . . 0.0 110.127 179.988 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 15' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -65.87 -80.92 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.249 -0.907 . . . . 0.0 110.246 -179.969 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 16' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER 52.79 28.84 6.78 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.2 -0.937 . . . . 0.0 110.179 -179.948 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 17' ' ' SER . . . . . . . . . . . . . 6.2 t 53.08 62.11 2.84 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.135 -0.978 . . . . 0.0 110.061 -179.901 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 18' ' ' ILE . . . . . . . . . . . . . 55.1 mt 54.45 40.37 0.31 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.694 0 O-C-N 121.328 -0.858 . . . . 0.0 110.084 -179.737 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 19' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER 51.89 55.58 9.07 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 120.935 -1.103 . . . . 0.0 109.02 -179.194 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 20' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 54.84 24.79 6.03 Favored 'General case' 0 N--CA 1.49 1.57 0 N-CA-C 108.382 -0.97 . . . . 0.0 108.382 -177.811 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 21' ' ' LEU . . . . . 0.416 ' O ' ' CG ' ' C' ' 21' ' ' LEU . 1.6 tt 46.32 42.04 9.87 Favored 'General case' 0 N--CA 1.49 1.55 0 CA-C-O 121.887 0.851 . . . . 0.0 109.999 -179.238 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 22' ' ' VAL . . . . . . . . . . . . . 8.7 p . . . . . 0 N--CA 1.489 1.492 0 CA-C-O 117.993 -1.004 . . . . 0.0 110.676 -179.96 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 99.3 m-70 . . . . . 0 N--CA 1.492 1.673 0 CA-C-O 121.248 0.547 . . . . 0.0 110.172 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 7.3 ttp 52.96 69.82 0.65 Allowed 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.242 -0.911 . . . . 0.0 110.063 -179.847 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 90.4 21.3 38.27 Favored Glycine 0 N--CA 1.491 2.339 0 N-CA-C 109.588 -1.405 . . . . 0.0 109.588 -179.844 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 84.2 t60 -119.91 -34.15 3.8 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.276 -1.132 . . . . 0.0 109.936 179.912 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 8.8 tp -101.26 143.39 14.45 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.625 0 O-C-N 121.344 -0.847 . . . . 0.0 109.989 179.844 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -121.81 -150.35 0.45 Allowed 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.211 -0.931 . . . . 0.0 110.226 -179.845 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . 0.426 ' O ' ' CG2' ' A' ' 7' ' ' ILE . 0.2 OUTLIER -47.21 123.6 8.44 Favored Pre-proline 0 N--CA 1.489 1.508 0 O-C-N 121.357 -0.84 . . . . 0.0 110.579 -179.734 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 48.8 Cg_endo -74.13 136.42 22.33 Favored 'Trans proline' 0 C--N 1.314 -1.255 0 O-C-N 123.441 1.232 . . . . 0.0 110.448 -179.632 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 47.9 Cg_endo -76.08 152.2 35.61 Favored 'Trans proline' 0 C--N 1.312 -1.393 0 O-C-N 123.546 1.287 . . . . 0.0 110.357 179.885 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 120.57 -29.53 5.85 Favored Glycine 0 N--CA 1.492 2.414 0 N-CA-C 109.615 -1.394 . . . . 0.0 109.615 179.955 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 22.3 tp -64.36 -23.15 67.19 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.239 -1.154 . . . . 0.0 110.338 -179.904 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 7.5 m -63.25 -62.81 1.45 Allowed 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.218 -0.926 . . . . 0.0 110.231 -179.987 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 31.6 tt0 -54.77 -30.49 56.79 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.352 -0.843 . . . . 0.0 110.223 -179.99 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -72.65 -49.82 29.22 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.205 -0.935 . . . . 0.0 110.222 179.93 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -70.7 -56.58 6.08 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.141 -0.974 . . . . 0.0 110.113 179.944 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -54.38 -41.67 69.49 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.147 -0.971 . . . . 0.0 109.646 179.607 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -55.57 -41.03 80.53 Favored Glycine 0 N--CA 1.489 2.205 0 N-CA-C 109.248 -1.541 . . . . 0.0 109.248 179.554 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . 0.415 ' OH ' ' CD1' ' A' ' 30' ' ' LEU . 63.7 t80 -67.08 -43.15 83.35 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.296 -1.12 . . . . 0.0 109.736 179.624 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 1.6 m -54.41 -29.19 48.16 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.198 -0.939 . . . . 0.0 109.88 179.557 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 45.0 t -76.86 -71.68 0.26 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.593 0 O-C-N 121.407 -0.808 . . . . 0.0 110.238 -179.955 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 -45.31 -43.09 10.43 Favored 'General case' 0 N--CA 1.497 1.903 0 O-C-N 121.447 -0.783 . . . . 0.0 111.094 -179.489 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 71.2 t -55.94 -54.07 31.06 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.581 0 O-C-N 121.001 -1.062 . . . . 0.0 109.596 179.706 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 4.0 mt -66.73 -23.79 66.15 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.311 -0.868 . . . . 0.0 109.976 179.713 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -81.34 -71.15 0.49 Allowed 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.258 -0.901 . . . . 0.0 109.944 179.899 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -55.18 -35.26 64.63 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.381 -0.824 . . . . 0.0 110.199 179.907 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER 51.25 64.61 7.77 Favored Pre-proline 0 N--CA 1.491 1.612 0 O-C-N 121.173 -0.954 . . . . 0.0 110.272 -179.944 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 46.2 Cg_endo -70.69 159.44 52.7 Favored 'Trans proline' 0 C--N 1.31 -1.452 0 O-C-N 123.76 1.4 . . . . 0.0 110.475 -179.953 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 43.7 Cg_endo -70.63 -23.03 27.29 Favored 'Trans proline' 0 C--N 1.31 -1.461 0 O-C-N 123.713 1.375 . . . . 0.0 110.149 179.876 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . 0.425 ' OD2' ' CB ' ' A' ' 32' ' ' ASP . 32.8 p-10 -142.4 115.26 8.7 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.384 -0.823 . . . . 0.0 109.917 179.697 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.415 ' CD1' ' OH ' ' A' ' 18' ' ' TYR . 10.8 tp -70.61 -34.93 72.66 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.273 -0.892 . . . . 0.0 110.318 -179.691 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 42.4 t -49.83 -59.9 0.92 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.832 0 O-C-N 121.261 -0.899 . . . . 0.0 109.925 179.714 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . 0.425 ' CB ' ' OD2' ' A' ' 29' ' ' ASP . 6.4 t0 -60.1 -46.1 90.72 Favored 'General case' 0 C--N 1.301 -1.503 0 O-C-N 121.619 -0.675 . . . . 0.0 109.972 179.801 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 53.3 t80 -56.56 -48.79 76.57 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.169 -0.957 . . . . 0.0 109.568 179.524 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -55.06 -43.45 73.85 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.329 -0.857 . . . . 0.0 109.659 179.579 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 69.2 t -72.34 -23.42 21.34 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.36 0 O-C-N 121.486 -0.759 . . . . 0.0 109.878 179.712 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -81.7 -44.07 17.61 Favored 'General case' 0 C--N 1.303 -1.418 0 O-C-N 121.23 -0.919 . . . . 0.0 109.782 -179.749 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 51.5 t80 -62.71 -61.47 2.39 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.182 -0.949 . . . . 0.0 110.752 -179.63 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 29.7 m-85 -57.51 -52.95 63.32 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.241 -0.912 . . . . 0.0 111.123 -179.321 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' THR . . . . . 0.406 ' OG1' ' CG1' ' B' ' 35' ' ' VAL . 22.8 m -49.73 -41.79 44.55 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 121.065 -1.022 . . . . 0.0 110.195 -179.656 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 34.4 ttt-85 -71.59 -20.87 61.94 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.187 -0.946 . . . . 0.0 109.843 179.473 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -63.49 -43.21 97.91 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.302 -0.874 . . . . 0.0 110.242 179.998 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.401 ' NH1' ' HB2' ' B' ' 32' ' ' ASP . 0.0 OUTLIER -49.44 -25.71 2.77 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.198 -0.939 . . . . 0.0 110.22 179.771 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -106.29 -58.26 1.94 Allowed 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.433 -0.792 . . . . 0.0 109.777 179.611 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . 67.05 -61.52 0.33 Allowed 'General case' 0 N--CA 1.501 2.098 0 O-C-N 121.624 -0.672 . . . . 0.0 110.73 179.835 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.23 169.54 0.11 Allowed 'General case' 0 C--N 1.299 -1.616 0 O-C-N 121.512 -0.742 . . . . 0.0 110.51 -178.998 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.493 1.679 0 CA-C-O 118.036 -0.983 . . . . 0.0 110.286 179.975 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 1' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.491 1.614 0 CA-C-O 121.206 0.527 . . . . 0.0 110.262 . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 2' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -94.9 48.39 1.19 Allowed 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.274 -0.891 . . . . 0.0 110.117 179.949 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 3' ' ' GLY . . . . . . . . . . . . . . . 67.04 168.7 3.51 Favored Glycine 0 N--CA 1.49 2.258 0 N-CA-C 109.459 -1.456 . . . . 0.0 109.459 -179.923 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 4' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -101.84 -10.7 19.65 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.322 -1.104 . . . . 0.0 110.636 -179.906 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 5' ' ' ILE . . . . . . . . . . . . . 47.6 mm -111.64 158.12 12.22 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.612 0 O-C-N 121.044 -1.035 . . . . 0.0 110.368 -179.941 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 6' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -152.41 -167.46 2.76 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.247 -0.908 . . . . 0.0 110.28 179.954 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 7' ' ' ILE . . . . . . . . . . . . . 4.3 mp -80.18 114.56 47.89 Favored Pre-proline 0 N--CA 1.492 1.632 0 O-C-N 121.151 -0.968 . . . . 0.0 109.806 179.929 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_endo -70.99 136.61 30.12 Favored 'Trans proline' 0 C--N 1.313 -1.32 0 O-C-N 123.482 1.254 . . . . 0.0 110.518 -179.802 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 9' ' ' PRO . . . . . . . . . . . . . 49.3 Cg_endo -78.61 2.17 8.39 Favored 'Trans proline' 0 C--N 1.313 -1.294 0 O-C-N 123.661 1.348 . . . . 0.0 111.418 -179.943 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . -72.03 -20.2 78.82 Favored Glycine 0 N--CA 1.491 2.3 0 N-CA-C 109.664 -1.374 . . . . 0.0 109.664 179.982 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -81.12 -16.92 51.66 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.272 -1.134 . . . . 0.0 110.519 -179.891 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 78.4 m -73.12 -36.21 66.68 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.074 -1.016 . . . . 0.0 110.374 -179.881 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -75.06 -25.23 58.49 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.277 -0.889 . . . . 0.0 110.156 179.999 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -74.02 -47.56 36.14 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.277 -0.89 . . . . 0.0 110.166 179.922 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 84.5 mt -64.08 -49.78 70.94 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.224 -0.922 . . . . 0.0 110.021 179.882 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -56.04 -42.35 76.43 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.264 -0.898 . . . . 0.0 109.871 179.764 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 17' ' ' GLY . . . . . 0.406 ' O ' ' CG ' ' B' ' 21' ' ' GLU . . . -57.92 -46.47 92.42 Favored Glycine 0 N--CA 1.49 2.257 0 N-CA-C 109.271 -1.532 . . . . 0.0 109.271 179.774 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 18' ' ' TYR . . . . . 0.411 ' HA ' ' HG3' ' B' ' 21' ' ' GLU . 39.4 t80 -63.38 -30.64 71.74 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.313 -1.11 . . . . 0.0 109.957 179.726 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 62.4 m -74.85 -27.69 60.37 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.343 -0.848 . . . . 0.0 110.237 179.993 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 87.1 t -78.1 -19.56 13.63 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.616 0 O-C-N 121.166 -0.958 . . . . 0.0 110.28 179.941 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 21' ' ' GLU . . . . . 0.447 ' OE2' ' CE1' ' B' ' 37' ' ' TYR . 0.6 OUTLIER -86.38 -45.79 10.86 Favored 'General case' 0 N--CA 1.499 1.991 0 O-C-N 121.138 -0.976 . . . . 0.0 108.895 179.605 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 22' ' ' VAL . . . . . . . . . . . . . 78.2 t -63.31 -25.67 39.0 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.541 0 CA-C-O 121.308 0.575 . . . . 0.0 110.056 179.978 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 4.4 mt -84.22 -31.6 24.95 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.26 -0.9 . . . . 0.0 110.09 179.777 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -87.6 -40.27 14.36 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.26 -0.9 . . . . 0.0 110.442 -179.847 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 1.8 tt0 -88.44 -40.85 13.17 Favored 'General case' 0 C--N 1.306 -1.303 0 O-C-N 121.28 -0.887 . . . . 0.0 110.298 -179.711 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 52.8 67.36 3.94 Favored Pre-proline 0 N--CA 1.492 1.628 0 O-C-N 121.318 -0.864 . . . . 0.0 110.211 179.945 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 27' ' ' PRO . . . . . . . . . . . . . 45.1 Cg_endo -70.94 167.45 25.95 Favored 'Trans proline' 0 C--N 1.312 -1.383 0 O-C-N 123.571 1.301 . . . . 0.0 110.558 -179.955 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 44.3 Cg_endo -71.26 -41.89 2.28 Favored 'Trans proline' 0 C--N 1.312 -1.359 0 O-C-N 123.734 1.386 . . . . 0.0 110.38 179.826 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 10.9 m-20 -123.22 120.88 34.45 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.222 -0.924 . . . . 0.0 110.164 179.935 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 2.7 tp -78.65 -31.55 46.86 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.289 -0.882 . . . . 0.0 109.898 179.747 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 46.8 t -52.63 -67.38 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.678 0 O-C-N 121.278 -0.889 . . . . 0.0 109.967 179.787 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 32' ' ' ASP . . . . . 0.401 ' HB2' ' NH1' ' A' ' 42' ' ' ARG . 1.6 t0 -55.5 -41.53 73.18 Favored 'General case' 0 C--N 1.303 -1.456 0 O-C-N 121.39 -0.819 . . . . 0.0 109.764 179.709 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 33' ' ' PHE . . . . . . . . . . . . . 59.4 t80 -58.2 -47.72 82.57 Favored 'General case' 0 N--CA 1.488 1.446 0 O-C-N 121.169 -0.957 . . . . 0.0 109.369 179.32 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -58.54 -36.92 74.63 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.346 -0.846 . . . . 0.0 109.512 179.313 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 35' ' ' VAL . . . . . 0.406 ' CG1' ' OG1' ' A' ' 39' ' ' THR . 89.1 t -75.2 -51.43 21.38 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.32 0 O-C-N 121.471 -0.768 . . . . 0.0 109.994 179.704 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 -58.96 -35.79 73.74 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.268 -0.895 . . . . 0.0 110.116 179.995 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 37' ' ' TYR . . . . . 0.447 ' CE1' ' OE2' ' B' ' 21' ' ' GLU . 43.2 t80 -62.29 -73.64 0.1 Allowed 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.295 -0.878 . . . . 0.0 110.107 179.957 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 20.9 m-85 -51.88 -45.36 64.09 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.242 -0.911 . . . . 0.0 110.521 -179.888 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 39' ' ' THR . . . . . . . . . . . . . 45.2 m -53.16 -28.53 26.67 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.174 -0.954 . . . . 0.0 110.032 179.835 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.57 -30.61 29.52 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.292 -0.88 . . . . 0.0 109.953 179.686 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.69 -36.14 75.88 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.311 -0.868 . . . . 0.0 110.123 179.922 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 42' ' ' ARG . . . . . 0.415 ' NH1' ' OD2' ' A' ' 32' ' ' ASP . 0.0 OUTLIER -52.11 -38.0 55.94 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.221 -0.924 . . . . 0.0 110.194 179.934 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 43' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -80.05 -18.78 49.19 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.272 -0.893 . . . . 0.0 110.276 179.896 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -65.04 -72.19 0.16 Allowed 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.204 -0.935 . . . . 0.0 110.377 -179.958 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 45' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.62 113.54 0.85 Allowed 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.462 -0.774 . . . . 0.0 110.587 -179.348 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.616 0 CA-C-O 118.001 -1.0 . . . . 0.0 110.239 -179.905 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 1' ' ' LEU . . . . . 0.41 ' CD2' ' HB2' ' C' ' 4' ' ' GLU . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.657 0 CA-C-O 121.192 0.52 . . . . 0.0 110.248 . . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 2' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -174.43 -37.46 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.234 -0.916 . . . . 0.0 110.392 -179.881 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 3' ' ' ILE . . . . . . . . . . . . . 10.5 mt -63.44 -28.86 45.86 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.651 0 O-C-N 121.294 -0.879 . . . . 0.0 110.316 -179.918 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 4' ' ' GLU . . . . . 0.41 ' HB2' ' CD2' ' C' ' 1' ' ' LEU . 26.2 mt-10 -94.92 -20.23 19.58 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.175 -0.953 . . . . 0.0 110.352 -179.921 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 5' ' ' THR . . . . . . . . . . . . . 9.2 m -98.56 -19.67 17.47 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.29 -0.881 . . . . 0.0 110.448 -179.83 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 6' ' ' ALA . . . . . . . . . . . . . . . -77.27 -58.95 2.99 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.088 -1.007 . . . . 0.0 110.445 -179.826 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 7' ' ' SER . . . . . . . . . . . . . 2.9 t -62.19 -36.24 81.29 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.179 -0.951 . . . . 0.0 110.537 -179.718 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 8' ' ' SER . . . . . . . . . . . . . 4.2 t -65.17 -42.35 93.75 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.134 -0.978 . . . . 0.0 110.341 -179.863 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 9' ' ' LEU . . . . . . . . . . . . . 3.3 tt -70.03 -48.56 57.46 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.205 -0.934 . . . . 0.0 110.236 179.991 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 10' ' ' VAL . . . . . . . . . . . . . 87.7 t -58.77 -56.34 17.31 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.669 0 O-C-N 121.221 -0.925 . . . . 0.0 110.317 -179.923 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 11' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -52.2 -40.02 60.98 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.28 -0.887 . . . . 0.0 110.474 -179.795 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 12' ' ' ASN . . . . . . . . . . . . . 28.7 t30 -65.5 -29.32 69.96 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.174 -0.954 . . . . 0.0 110.381 -179.895 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 13' ' ' ALA . . . . . . . . . . . . . . . -79.57 -26.75 41.25 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.212 -0.93 . . . . 0.0 110.369 -179.915 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 14' ' ' ILE . . . . . . . . . . . . . 38.9 mm -89.21 -17.62 8.14 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.613 0 O-C-N 121.259 -0.901 . . . . 0.0 110.544 -179.995 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 15' ' ' GLN . . . . . . . . . . . . . 7.6 mm100 -94.21 -80.6 0.39 Allowed 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.048 -1.033 . . . . 0.0 110.348 -179.958 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 16' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER 52.11 -161.7 0.09 Allowed 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.264 -0.898 . . . . 0.0 110.149 -179.819 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 17' ' ' SER . . . . . . . . . . . . . 32.9 p -84.69 4.39 32.81 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.183 -0.948 . . . . 0.0 110.691 -179.889 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 18' ' ' ILE . . . . . . . . . . . . . 82.7 mt -81.35 -45.84 20.56 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.609 0 O-C-N 121.022 -1.049 . . . . 0.0 110.121 179.84 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 19' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -98.77 35.61 1.82 Allowed 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.313 -0.867 . . . . 0.0 110.26 -179.978 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 20' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -142.38 -42.48 0.33 Allowed 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.229 -0.919 . . . . 0.0 110.265 -179.999 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 21' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -79.51 -50.31 10.94 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.307 -0.871 . . . . 0.0 110.145 -179.959 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 22' ' ' VAL . . . . . . . . . . . . . 98.5 t . . . . . 0 N--CA 1.491 1.582 0 CA-C-O 117.975 -1.012 . . . . 0.0 110.25 -179.981 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 57.8 m80 . . . . . 0 N--CA 1.492 1.665 0 CA-C-O 121.216 0.531 . . . . 0.0 110.277 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 55.29 172.44 0.03 OUTLIER 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.282 -0.886 . . . . 0.0 110.432 179.804 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -64.27 147.75 50.89 Favored Glycine 0 N--CA 1.49 2.252 0 N-CA-C 109.646 -1.382 . . . . 0.0 109.646 -179.973 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -146.07 120.69 9.79 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.287 -1.125 . . . . 0.0 110.051 179.925 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 4.6 mp -143.5 110.37 1.58 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.526 0 O-C-N 121.214 -0.929 . . . . 0.0 110.445 -179.874 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 1.8 mt-30 -124.24 37.61 4.37 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.361 -0.837 . . . . 0.0 109.931 179.73 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 3.3 tp -106.64 93.05 7.98 Favored Pre-proline 0 N--CA 1.487 1.388 0 O-C-N 121.333 -0.854 . . . . 0.0 110.323 -179.789 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 47.6 Cg_endo -73.46 112.56 3.56 Favored 'Trans proline' 0 C--N 1.312 -1.353 0 O-C-N 123.558 1.294 . . . . 0.0 110.512 179.903 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 49.3 Cg_endo -76.5 160.36 35.27 Favored 'Trans proline' 0 C--N 1.313 -1.331 0 O-C-N 123.562 1.296 . . . . 0.0 110.638 -179.99 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 135.76 -25.49 3.23 Favored Glycine 0 N--CA 1.491 2.333 0 N-CA-C 109.65 -1.38 . . . . 0.0 109.65 179.795 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 49.0 tp -58.52 -27.2 64.3 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.294 -1.121 . . . . 0.0 110.538 -179.889 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 86.6 m -68.37 -30.78 69.8 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.218 -0.926 . . . . 0.0 110.74 -179.658 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -76.8 -39.74 50.42 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.119 -0.988 . . . . 0.0 110.507 -179.66 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 7.7 tt -71.46 -36.76 71.31 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.13 -0.981 . . . . 0.0 110.511 -179.741 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 2.0 tp -65.55 -57.43 8.22 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.182 -0.949 . . . . 0.0 110.587 -179.708 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -50.58 -34.88 27.48 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.129 -0.982 . . . . 0.0 110.242 -179.901 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -62.89 -50.13 66.42 Favored Glycine 0 N--CA 1.49 2.236 0 N-CA-C 109.245 -1.542 . . . . 0.0 109.245 179.651 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 30.6 t80 -56.12 -41.46 75.33 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.244 -1.15 . . . . 0.0 110.119 179.807 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 57.6 m -61.52 -37.67 84.57 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.321 -0.862 . . . . 0.0 110.59 -179.803 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 98.5 t -69.12 -22.09 25.82 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.72 0 O-C-N 121.264 -0.897 . . . . 0.0 110.437 -179.705 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.419 ' OE2' ' CE1' ' A' ' 37' ' ' TYR . 1.2 mt-10 -88.18 -48.48 7.67 Favored 'General case' 0 N--CA 1.499 2.016 0 O-C-N 121.209 -0.932 . . . . 0.0 108.818 179.666 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 64.7 t -48.98 -31.63 4.2 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.473 0 O-C-N 121.75 -0.594 . . . . 0.0 110.339 179.936 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.403 ' CD1' ' CD1' ' C' ' 2' ' ' LEU . 0.1 OUTLIER -85.76 -40.15 16.38 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.268 -0.895 . . . . 0.0 110.158 -179.956 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -74.81 -52.66 10.83 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.169 -0.957 . . . . 0.0 110.289 179.933 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . 0.434 ' O ' ' CG ' ' A' ' 26' ' ' GLN . 3.8 mp0 -73.89 -19.4 60.72 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.225 -0.922 . . . . 0.0 110.603 -179.914 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . 0.434 ' CG ' ' O ' ' A' ' 25' ' ' GLN . 21.5 pt20 36.64 61.38 3.31 Favored Pre-proline 0 N--CA 1.506 2.343 0 O-C-N 121.937 -0.477 . . . . 0.0 111.912 -179.936 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . 0.474 ' HG3' ' CD2' ' A' ' 33' ' ' PHE . 44.1 Cg_endo -71.08 154.69 62.32 Favored 'Trans proline' 0 C--N 1.311 -1.4 0 O-C-N 123.564 1.297 . . . . 0.0 110.537 -179.957 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 46.2 Cg_endo -72.77 -42.69 1.05 Allowed 'Trans proline' 0 C--N 1.312 -1.387 0 O-C-N 123.734 1.386 . . . . 0.0 110.37 179.876 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 14.2 m-20 -113.85 122.89 48.4 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.31 -0.868 . . . . 0.0 110.14 179.887 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -75.48 -47.11 28.57 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.169 -0.957 . . . . 0.0 110.195 179.971 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 39.9 t -50.28 -60.98 0.69 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.786 0 O-C-N 121.177 -0.952 . . . . 0.0 109.797 179.702 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 5.1 t0 -58.86 -39.51 81.56 Favored 'General case' 0 C--N 1.302 -1.49 0 O-C-N 121.653 -0.655 . . . . 0.0 109.808 179.526 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . 0.474 ' CD2' ' HG3' ' A' ' 27' ' ' PRO . 36.9 t80 -62.54 -46.58 87.74 Favored 'General case' 0 N--CA 1.488 1.436 0 O-C-N 121.163 -0.961 . . . . 0.0 109.526 179.44 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . 0.452 ' HB2' ' CD2' ' B' ' 38' ' ' PHE . . . -56.13 -40.94 74.56 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.388 -0.82 . . . . 0.0 110.123 179.79 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 97.9 t -64.74 -43.95 96.51 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.337 0 O-C-N 121.151 -0.968 . . . . 0.0 110.146 -179.979 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -63.04 -35.0 78.77 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.28 -0.887 . . . . 0.0 110.103 179.859 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . 0.419 ' CE1' ' OE2' ' A' ' 21' ' ' GLU . 20.4 t80 -69.08 -60.42 2.37 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.233 -0.917 . . . . 0.0 110.367 -179.841 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 28.5 m-85 -61.68 -49.2 77.43 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.282 -0.886 . . . . 0.0 110.322 -179.791 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 55.7 m -51.79 -41.39 61.65 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.195 -0.941 . . . . 0.0 110.22 179.965 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 2.9 mtp180 -72.61 -30.22 64.17 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.235 -0.916 . . . . 0.0 109.963 179.766 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 1.4 tt -56.73 -40.89 76.51 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.353 -0.842 . . . . 0.0 110.085 179.914 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -51.54 -29.02 15.4 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.227 -0.92 . . . . 0.0 110.438 179.999 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 -106.86 -2.93 20.86 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.232 -0.917 . . . . 0.0 110.88 -179.931 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -59.31 -75.86 0.05 Allowed 'General case' 0 N--CA 1.493 1.684 0 O-C-N 120.947 -1.095 . . . . 0.0 110.28 179.928 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 1.2 mmt-85 -51.44 -79.4 0.02 OUTLIER 'General case' 0 N--CA 1.487 1.403 0 O-C-N 121.544 -0.722 . . . . 0.0 110.3 -179.504 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 5.8 ptp180 . . . . . 0 N--CA 1.49 1.575 0 CA-C-O 118.049 -0.977 . . . . 0.0 110.104 179.721 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 1' ' ' HIS . . . . . . . . . . . . . 1.2 t-80 . . . . . 0 N--CA 1.491 1.589 0 CA-C-O 121.243 0.544 . . . . 0.0 110.251 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 2' ' ' MET . . . . . . . . . . . . . 3.3 mtm -92.03 -52.52 4.67 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.219 -0.925 . . . . 0.0 110.156 -179.989 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 3' ' ' GLY . . . . . . . . . . . . . . . -66.45 -121.21 0.01 OUTLIER Glycine 0 N--CA 1.489 2.208 0 N-CA-C 109.495 -1.442 . . . . 0.0 109.495 179.888 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 4' ' ' HIS . . . . . . . . . . . . . 43.5 t60 -168.13 57.63 0.06 Allowed 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.218 -1.166 . . . . 0.0 110.28 179.923 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 5' ' ' ILE . . . . . . . . . . . . . 2.0 tp -101.97 145.15 12.25 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.599 0 O-C-N 121.216 -0.928 . . . . 0.0 110.09 179.934 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 6' ' ' GLN . . . . . . . . . . . . . 1.8 tp60 -142.06 67.85 1.32 Allowed 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.271 -0.893 . . . . 0.0 110.345 -179.877 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 7' ' ' ILE . . . . . . . . . . . . . 48.3 mm -121.57 98.37 46.06 Favored Pre-proline 0 N--CA 1.491 1.577 0 O-C-N 121.26 -0.9 . . . . 0.0 110.091 179.853 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 46.0 Cg_endo -71.82 113.33 3.62 Favored 'Trans proline' 0 C--N 1.31 -1.499 0 O-C-N 123.676 1.356 . . . . 0.0 110.417 -179.878 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 9' ' ' PRO . . . . . . . . . . . . . 48.2 Cg_endo -72.81 -174.88 1.65 Allowed 'Trans proline' 0 C--N 1.312 -1.345 0 O-C-N 123.559 1.294 . . . . 0.0 110.273 179.931 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 102.59 -38.28 3.28 Favored Glycine 0 N--CA 1.491 2.328 0 N-CA-C 109.296 -1.522 . . . . 0.0 109.296 -179.985 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -59.03 -36.49 75.08 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.327 -1.102 . . . . 0.0 110.09 179.962 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 22.1 m -51.93 -63.04 1.27 Allowed 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.234 -0.916 . . . . 0.0 110.302 179.895 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -57.6 -23.34 50.37 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.324 -0.86 . . . . 0.0 110.19 179.943 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -78.97 -33.74 44.86 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.234 -0.916 . . . . 0.0 110.087 179.965 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 4.9 mp -80.27 -47.13 15.05 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.237 -0.914 . . . . 0.0 110.122 179.963 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -53.73 -45.87 70.66 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.268 -0.895 . . . . 0.0 109.818 179.648 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 17' ' ' GLY . . . . . 0.412 ' O ' ' CG ' ' B' ' 21' ' ' GLU . . . -60.93 -50.96 61.78 Favored Glycine 0 N--CA 1.49 2.247 0 N-CA-C 109.293 -1.523 . . . . 0.0 109.293 179.632 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 18' ' ' TYR . . . . . . . . . . . . . 25.8 t80 -53.72 -31.95 50.19 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.322 -1.104 . . . . 0.0 110.103 179.809 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 88.8 m -75.83 -29.31 58.58 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.37 -0.831 . . . . 0.0 110.13 179.949 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 39.9 t -78.5 -19.58 13.3 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.664 0 O-C-N 121.327 -0.858 . . . . 0.0 110.252 -179.982 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 21' ' ' GLU . . . . . 0.448 ' OE1' ' CE1' ' B' ' 37' ' ' TYR . 1.3 mt-10 -87.07 -42.62 12.93 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.243 -0.911 . . . . 0.0 108.868 179.851 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 22' ' ' VAL . . . . . . . . . . . . . 51.9 t -64.52 -29.37 47.16 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.508 0 O-C-N 121.743 -0.598 . . . . 0.0 110.13 -179.918 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 1.4 mt -75.78 -48.13 22.96 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.315 -0.866 . . . . 0.0 110.064 179.798 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 7.1 mpt_? -69.3 -70.68 0.26 Allowed 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.249 -0.907 . . . . 0.0 110.113 179.898 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -51.83 -41.02 61.47 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.237 -0.914 . . . . 0.0 110.408 179.94 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER 52.15 66.21 5.34 Favored Pre-proline 0 N--CA 1.491 1.601 0 O-C-N 121.408 -0.808 . . . . 0.0 110.381 179.945 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 27' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_endo -71.35 159.99 50.05 Favored 'Trans proline' 0 C--N 1.311 -1.44 0 O-C-N 123.638 1.336 . . . . 0.0 110.531 179.873 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 44.7 Cg_endo -71.49 -35.23 8.39 Favored 'Trans proline' 0 C--N 1.311 -1.445 0 O-C-N 123.742 1.39 . . . . 0.0 110.27 179.771 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 29' ' ' ASP . . . . . 0.418 ' N ' ' OD1' ' B' ' 29' ' ' ASP . 38.2 p-10 -132.5 114.53 14.39 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.357 -0.839 . . . . 0.0 110.256 179.722 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 4.2 tp -67.91 -31.34 71.05 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.325 -0.86 . . . . 0.0 110.444 -179.829 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 44.6 t -49.77 -56.51 3.21 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.751 0 O-C-N 121.174 -0.954 . . . . 0.0 110.088 179.718 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -64.0 -45.63 88.12 Favored 'General case' 0 C--N 1.302 -1.482 0 O-C-N 121.577 -0.702 . . . . 0.0 110.102 179.919 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 33' ' ' PHE . . . . . . . . . . . . . 74.8 t80 -57.56 -40.07 78.1 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.045 -1.034 . . . . 0.0 109.628 179.519 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -60.99 -43.67 98.51 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.338 -0.851 . . . . 0.0 109.992 179.668 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 35' ' ' VAL . . . . . . . . . . . . . 58.9 t -70.53 -40.79 77.75 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.289 0 O-C-N 121.251 -0.906 . . . . 0.0 110.072 179.77 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -74.03 -21.58 59.9 Favored 'General case' 0 N--CA 1.487 1.404 0 O-C-N 121.293 -0.879 . . . . 0.0 109.712 179.961 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 37' ' ' TYR . . . . . 0.448 ' CE1' ' OE1' ' B' ' 21' ' ' GLU . 28.3 t80 -79.58 -64.46 1.18 Allowed 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.119 -0.988 . . . . 0.0 110.515 -179.864 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 38' ' ' PHE . . . . . 0.452 ' CD2' ' HB2' ' A' ' 34' ' ' ALA . 22.8 m-85 -60.04 -46.88 88.06 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.265 -0.897 . . . . 0.0 110.656 -179.613 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 39' ' ' THR . . . . . . . . . . . . . 72.9 m -53.68 -54.89 31.47 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.096 -1.002 . . . . 0.0 110.152 179.952 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 41.8 ttt180 -62.7 -22.62 66.63 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.225 -0.922 . . . . 0.0 110.019 179.688 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 41' ' ' LEU . . . . . 0.403 ' O ' ' HB3' ' B' ' 44' ' ' ALA . 0.5 OUTLIER -59.67 -51.01 71.63 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.317 -0.864 . . . . 0.0 110.063 179.943 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -50.41 -24.93 3.39 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.22 -0.925 . . . . 0.0 110.545 179.969 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 43' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -102.02 13.49 34.6 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.248 -0.907 . . . . 0.0 110.872 -179.669 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 44' ' ' ALA . . . . . 0.403 ' HB3' ' O ' ' B' ' 41' ' ' LEU . . . -65.44 -75.05 0.09 Allowed 'General case' 0 N--CA 1.493 1.697 0 O-C-N 120.998 -1.064 . . . . 0.0 110.313 179.868 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 45' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -48.61 -61.88 1.8 Allowed 'General case' 0 N--CA 1.488 1.475 0 O-C-N 121.579 -0.701 . . . . 0.0 110.797 -179.203 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.54 0 CA-C-O 117.975 -1.012 . . . . 0.0 110.383 -179.793 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 1' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.492 1.659 0 CA-C-O 121.251 0.548 . . . . 0.0 110.193 . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 2' ' ' LEU . . . . . 0.403 ' CD1' ' CD1' ' A' ' 23' ' ' LEU . 67.7 tp -81.96 -21.02 37.41 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.261 -0.899 . . . . 0.0 110.162 -179.96 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 3' ' ' ILE . . . . . . . . . . . . . 47.2 mm -75.71 -36.73 34.42 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.576 0 O-C-N 121.213 -0.929 . . . . 0.0 110.19 -179.969 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 4' ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 -74.98 -3.91 35.12 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.34 -0.85 . . . . 0.0 110.747 -179.971 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 5' ' ' THR . . . . . . . . . . . . . 2.3 p -105.72 -66.58 0.98 Allowed 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.051 -1.03 . . . . 0.0 110.209 -179.915 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 6' ' ' ALA . . . . . . . . . . . . . . . -54.26 -43.78 71.27 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.318 -0.864 . . . . 0.0 110.205 -179.928 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 7' ' ' SER . . . . . 0.414 ' O ' ' CG1' ' C' ' 10' ' ' VAL . 8.5 t -57.64 -25.31 59.98 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.202 -0.936 . . . . 0.0 110.106 179.951 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 8' ' ' SER . . . . . . . . . . . . . 47.4 t -83.27 -24.5 32.23 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.268 -0.895 . . . . 0.0 110.051 179.84 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 9' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -75.97 -34.61 59.79 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.352 -0.843 . . . . 0.0 110.098 179.993 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 10' ' ' VAL . . . . . 0.43 ' O ' ' CG2' ' C' ' 14' ' ' ILE . 6.4 p -67.7 -24.21 30.63 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.56 0 O-C-N 121.311 -0.868 . . . . 0.0 110.072 179.916 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 11' ' ' LYS . . . . . . . . . . . . . 1.2 ttmt -76.17 -47.01 25.79 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.264 -0.898 . . . . 0.0 110.039 179.776 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 12' ' ' ASN . . . . . . . . . . . . . 96.2 m-20 -67.32 -15.48 63.71 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.286 -0.884 . . . . 0.0 110.407 179.68 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 13' ' ' ALA . . . . . . . . . . . . . . . -101.44 -50.05 3.86 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.13 -0.981 . . . . 0.0 110.252 -179.953 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 14' ' ' ILE . . . . . 0.43 ' CG2' ' O ' ' C' ' 10' ' ' VAL . 2.5 tp -52.67 -23.67 5.37 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.629 0 O-C-N 121.278 -0.889 . . . . 0.0 110.265 -179.82 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 15' ' ' GLN . . . . . . . . . . . . . 17.7 mt-30 -85.26 -42.2 14.88 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.25 -0.906 . . . . 0.0 110.201 179.917 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 16' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -53.22 -22.85 7.34 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.178 -0.951 . . . . 0.0 110.144 -179.989 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 17' ' ' SER . . . . . 0.431 ' C ' ' CG1' ' C' ' 18' ' ' ILE . 0.2 OUTLIER -85.83 53.41 2.77 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.31 -0.869 . . . . 0.0 110.314 -179.994 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' C' C ' 18' ' ' ILE . . . . . 0.447 ' CD1' ' HB2' ' C' ' 21' ' ' LEU . 2.3 pt 36.51 37.43 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.509 2.485 0 O-C-N 121.714 -0.616 . . . . 0.0 111.29 179.991 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 19' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER 51.25 52.97 13.77 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.215 -0.928 . . . . 0.0 109.024 -179.239 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 20' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 53.49 26.31 5.45 Favored 'General case' 0 N--CA 1.489 1.503 0 N-CA-C 108.354 -0.98 . . . . 0.0 108.354 -177.81 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 21' ' ' LEU . . . . . 0.447 ' HB2' ' CD1' ' C' ' 18' ' ' ILE . 0.5 OUTLIER 48.06 59.12 4.45 Favored 'General case' 0 N--CA 1.49 1.571 0 CA-C-O 121.943 0.878 . . . . 0.0 109.703 -178.937 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' C' C ' 22' ' ' VAL . . . . . . . . . . . . . 75.4 t . . . . . 0 N--CA 1.489 1.495 0 CA-C-O 117.995 -1.003 . . . . 0.0 110.095 -179.721 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 41.5 m80 . . . . . 0 N--CA 1.493 1.688 0 CA-C-O 121.253 0.549 . . . . 0.0 110.191 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 52.37 44.55 29.75 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.262 -0.898 . . . . 0.0 110.265 -179.918 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -173.07 72.28 0.1 OUTLIER Glycine 0 N--CA 1.49 2.282 0 N-CA-C 109.738 -1.345 . . . . 0.0 109.738 -179.944 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 2.0 t-160 -103.89 120.76 41.68 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.152 -1.205 . . . . 0.0 110.103 179.778 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . 0.407 ' CG1' ' O ' ' A' ' 5' ' ' ILE . 0.9 OUTLIER -118.31 44.89 0.48 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.553 0 O-C-N 121.221 -0.924 . . . . 0.0 110.439 -179.775 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -126.87 -156.97 0.78 Allowed 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.204 -0.935 . . . . 0.0 110.298 -179.951 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . 0.407 ' CD1' ' N ' ' A' ' 7' ' ' ILE . 4.8 mp -88.28 122.25 69.83 Favored Pre-proline 0 N--CA 1.491 1.61 0 O-C-N 121.242 -0.911 . . . . 0.0 110.025 179.92 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 48.3 Cg_endo -73.92 117.81 5.17 Favored 'Trans proline' 0 C--N 1.313 -1.302 0 O-C-N 123.408 1.215 . . . . 0.0 110.383 -179.892 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 47.0 Cg_endo -73.79 -3.65 14.1 Favored 'Trans proline' 0 C--N 1.312 -1.349 0 O-C-N 123.474 1.25 . . . . 0.0 111.382 179.985 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -63.83 -24.24 68.11 Favored Glycine 0 N--CA 1.49 2.269 0 N-CA-C 109.34 -1.504 . . . . 0.0 109.34 179.679 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 7.1 tt -66.23 -26.6 67.45 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.219 -1.165 . . . . 0.0 110.095 179.924 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 63.4 m -74.24 -28.98 61.49 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.293 -0.879 . . . . 0.0 110.055 179.868 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -71.51 -41.32 69.38 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.358 -0.839 . . . . 0.0 110.008 179.864 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 28.1 tp -72.72 -41.76 64.86 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.31 -0.869 . . . . 0.0 110.071 179.902 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -58.03 -50.02 74.85 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.2 -0.937 . . . . 0.0 110.116 179.902 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 3.3 mt-30 -55.04 -43.3 73.64 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.207 -0.933 . . . . 0.0 109.698 179.731 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -53.24 -36.69 53.24 Favored Glycine 0 N--CA 1.493 2.486 0 N-CA-C 109.185 -1.566 . . . . 0.0 109.185 179.486 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . 0.403 ' O ' ' CG2' ' A' ' 22' ' ' VAL . 28.2 t80 -69.91 -54.63 12.54 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.441 -1.034 . . . . 0.0 109.363 179.307 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' THR . . . . . 0.402 ' O ' ' CD1' ' A' ' 23' ' ' LEU . 47.8 m -52.47 -27.65 17.06 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.373 -0.829 . . . . 0.0 109.982 179.373 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 43.9 t -71.54 -74.9 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.61 0 O-C-N 121.419 -0.801 . . . . 0.0 109.83 179.812 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.433 ' O ' ' CG ' ' A' ' 25' ' ' GLN . 21.8 pt-20 -48.54 -42.93 34.83 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.378 -0.826 . . . . 0.0 110.77 -179.665 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.414 ' N ' ' HG3' ' A' ' 21' ' ' GLU . 97.1 t -55.2 -39.0 49.24 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.649 0 O-C-N 121.145 -0.972 . . . . 0.0 110.38 -179.815 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.402 ' CD1' ' O ' ' A' ' 19' ' ' THR . 30.7 mt -88.65 -22.71 23.3 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.211 -0.931 . . . . 0.0 110.295 -179.88 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -81.24 -37.63 28.25 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.189 -0.945 . . . . 0.0 110.264 179.994 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . 0.508 ' NE2' ' CE1' ' A' ' 33' ' ' PHE . 0.0 OUTLIER -105.72 -20.19 13.53 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.18 -0.95 . . . . 0.0 110.34 179.84 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . 0.426 ' N ' ' HG3' ' A' ' 25' ' ' GLN . 0.9 OUTLIER 47.82 83.23 0.22 Allowed Pre-proline 0 N--CA 1.494 1.735 0 O-C-N 121.197 -0.939 . . . . 0.0 110.655 -179.983 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 46.1 Cg_endo -72.91 160.83 45.13 Favored 'Trans proline' 0 C--N 1.311 -1.416 0 O-C-N 123.749 1.394 . . . . 0.0 110.446 179.957 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 43.0 Cg_endo -69.52 -25.39 29.77 Favored 'Trans proline' 0 C--N 1.312 -1.367 0 O-C-N 123.653 1.344 . . . . 0.0 110.256 179.936 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 33.3 m-20 -148.9 114.03 5.49 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.418 -0.801 . . . . 0.0 109.935 179.851 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -57.38 -52.2 66.31 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.33 -0.856 . . . . 0.0 110.11 -179.866 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 60.8 t -49.01 -62.14 0.49 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.699 0 O-C-N 121.291 -0.881 . . . . 0.0 110.15 179.742 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -55.91 -36.49 67.74 Favored 'General case' 0 C--N 1.3 -1.565 0 O-C-N 121.548 -0.72 . . . . 0.0 109.658 179.491 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . 0.508 ' CE1' ' NE2' ' A' ' 25' ' ' GLN . 55.5 t80 -66.1 -50.53 63.73 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.269 -0.895 . . . . 0.0 109.537 179.393 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -56.27 -38.51 71.29 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.397 -0.814 . . . . 0.0 109.798 179.535 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 91.2 t -73.03 -34.57 46.05 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.339 0 O-C-N 121.373 -0.829 . . . . 0.0 109.993 179.782 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -80.43 -31.69 37.48 Favored 'General case' 0 C--N 1.303 -1.447 0 O-C-N 121.308 -0.87 . . . . 0.0 109.675 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 78.3 t80 -75.01 -65.3 0.89 Allowed 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.129 -0.982 . . . . 0.0 110.386 -179.859 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 12.9 m-85 -52.9 -49.56 65.69 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.228 -0.92 . . . . 0.0 110.626 -179.523 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 35.9 m -52.88 -37.71 60.81 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 120.989 -1.07 . . . . 0.0 110.037 179.944 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -72.35 -27.25 62.28 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.171 -0.955 . . . . 0.0 110.056 179.646 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 1.1 tt -65.35 -34.0 77.3 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.277 -0.89 . . . . 0.0 110.04 179.892 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.16 -24.15 62.8 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.299 -0.875 . . . . 0.0 109.894 179.72 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -76.7 -56.78 4.3 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.317 -0.864 . . . . 0.0 110.118 179.939 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -58.83 -69.45 0.19 Allowed 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.326 -0.859 . . . . 0.0 110.172 179.813 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -51.48 142.79 13.17 Favored 'General case' 0 C--N 1.303 -1.424 0 O-C-N 121.513 -0.742 . . . . 0.0 110.483 -179.354 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.661 0 CA-C-O 118.015 -0.993 . . . . 0.0 110.259 -179.995 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 1' ' ' HIS . . . . . 0.436 ' O ' ' N ' ' B' ' 3' ' ' GLY . 0.1 OUTLIER . . . . . 0 N--CA 1.491 1.621 0 CA-C-O 121.103 0.477 . . . . 0.0 110.318 . . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 2' ' ' MET . . . . . . . . . . . . . 15.0 mtt 56.71 -85.8 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.557 -0.714 . . . . 0.0 110.605 -179.925 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 3' ' ' GLY . . . . . 0.436 ' N ' ' O ' ' B' ' 1' ' ' HIS . . . 169.76 -160.93 34.18 Favored Glycine 0 N--CA 1.49 2.273 0 N-CA-C 109.505 -1.438 . . . . 0.0 109.505 -179.995 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 4' ' ' HIS . . . . . . . . . . . . . 35.8 p-80 -165.69 149.09 7.88 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.29 -1.123 . . . . 0.0 110.392 -179.991 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 5' ' ' ILE . . . . . . . . . . . . . 6.0 tp -118.54 48.91 0.36 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.545 0 O-C-N 121.373 -0.83 . . . . 0.0 110.121 179.902 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 6' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -116.76 -154.96 0.57 Allowed 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.266 -0.896 . . . . 0.0 110.075 -179.997 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 7' ' ' ILE . . . . . . . . . . . . . 47.0 mm -94.4 138.32 22.45 Favored Pre-proline 0 N--CA 1.493 1.676 0 O-C-N 121.192 -0.943 . . . . 0.0 110.276 -179.803 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 49.0 Cg_endo -72.79 129.87 15.0 Favored 'Trans proline' 0 C--N 1.313 -1.34 0 O-C-N 123.541 1.285 . . . . 0.0 110.317 179.921 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 9' ' ' PRO . . . . . . . . . . . . . 49.5 Cg_endo -74.43 153.97 45.11 Favored 'Trans proline' 0 C--N 1.311 -1.397 0 O-C-N 123.497 1.261 . . . . 0.0 110.477 -179.968 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 111.58 -25.05 14.04 Favored Glycine 0 N--CA 1.49 2.292 0 N-CA-C 109.553 -1.419 . . . . 0.0 109.553 179.889 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -69.05 -22.91 64.0 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.224 -1.162 . . . . 0.0 110.214 -179.986 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 91.6 m -78.96 -35.11 43.65 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.159 -0.963 . . . . 0.0 110.281 -179.956 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 28.1 mt-10 -65.88 -44.25 85.88 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.191 -0.943 . . . . 0.0 110.389 -179.928 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -67.89 -32.87 73.65 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.239 -0.913 . . . . 0.0 110.545 -179.803 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 2.5 mp -77.76 -42.32 34.51 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.192 -0.943 . . . . 0.0 110.559 -179.733 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -53.16 -44.03 67.5 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.035 -1.041 . . . . 0.0 110.011 179.93 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 17' ' ' GLY . . . . . . . . . . . . . . . -62.26 -51.42 56.72 Favored Glycine 0 N--CA 1.489 2.2 0 N-CA-C 109.346 -1.502 . . . . 0.0 109.346 179.902 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 18' ' ' TYR . . . . . 0.432 ' CD1' ' CD2' ' B' ' 37' ' ' TYR . 16.3 t80 -56.12 -33.78 65.46 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.341 -1.093 . . . . 0.0 110.279 179.895 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 62.6 m -71.55 -31.76 67.36 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.26 -0.9 . . . . 0.0 110.354 -179.887 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 48.6 t -75.14 -17.47 16.07 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.645 0 O-C-N 121.271 -0.893 . . . . 0.0 110.487 -179.885 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 21' ' ' GLU . . . . . 0.416 ' OE1' ' CE1' ' B' ' 37' ' ' TYR . 0.8 OUTLIER -89.15 -50.31 6.23 Favored 'General case' 0 N--CA 1.497 1.92 0 O-C-N 121.137 -0.977 . . . . 0.0 109.281 179.906 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 22' ' ' VAL . . . . . . . . . . . . . 23.8 t -60.79 -24.59 32.81 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.515 0 O-C-N 121.776 -0.577 . . . . 0.0 110.323 -179.637 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 6.8 mt -90.15 -31.65 16.99 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.214 -0.929 . . . . 0.0 110.492 -179.835 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -87.4 -51.71 5.79 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.189 -0.944 . . . . 0.0 110.591 -179.643 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 25' ' ' GLN . . . . . 0.407 ' O ' ' CG ' ' B' ' 26' ' ' GLN . 14.0 tp60 -85.15 -19.77 31.26 Favored 'General case' 0 N--CA 1.486 1.335 0 O-C-N 121.146 -0.971 . . . . 0.0 110.477 -179.557 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 26' ' ' GLN . . . . . 0.407 ' CG ' ' O ' ' B' ' 25' ' ' GLN . 9.0 pt20 36.26 74.82 0.55 Allowed Pre-proline 0 N--CA 1.507 2.376 0 O-C-N 121.81 -0.556 . . . . 0.0 111.893 -179.92 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 27' ' ' PRO . . . . . . . . . . . . . 44.4 Cg_endo -70.04 166.94 26.26 Favored 'Trans proline' 0 C--N 1.311 -1.429 0 O-C-N 123.532 1.28 . . . . 0.0 110.565 179.887 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 45.4 Cg_endo -71.79 -52.96 0.18 Allowed 'Trans proline' 0 C--N 1.313 -1.317 0 O-C-N 123.611 1.322 . . . . 0.0 110.551 -179.969 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -114.66 122.26 45.92 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.225 -0.922 . . . . 0.0 110.195 -179.899 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 3.8 tp -74.59 -39.44 62.2 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.194 -0.941 . . . . 0.0 110.264 179.957 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 86.2 t -49.73 -66.81 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.711 0 O-C-N 121.169 -0.957 . . . . 0.0 110.097 179.726 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 1.5 t0 -56.28 -38.44 71.19 Favored 'General case' 0 C--N 1.301 -1.536 0 O-C-N 121.626 -0.671 . . . . 0.0 110.101 179.744 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 33' ' ' PHE . . . . . . . . . . . . . 69.5 t80 -62.95 -44.38 96.22 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.215 -0.928 . . . . 0.0 109.845 179.747 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -56.44 -31.93 64.42 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.206 -0.934 . . . . 0.0 109.78 179.65 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 35' ' ' VAL . . . . . . . . . . . . . 89.9 t -73.91 -53.57 17.27 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.37 0 O-C-N 121.303 -0.873 . . . . 0.0 110.097 179.8 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -59.55 -24.75 63.97 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.342 -0.849 . . . . 0.0 110.491 -179.779 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 37' ' ' TYR . . . . . 0.432 ' CD2' ' CD1' ' B' ' 18' ' ' TYR . 14.2 t80 -78.66 -69.03 0.59 Allowed 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.191 -0.943 . . . . 0.0 110.54 -179.751 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 26.0 m-85 -53.53 -39.24 64.53 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.2 -0.937 . . . . 0.0 110.165 -179.832 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 39' ' ' THR . . . . . . . . . . . . . 55.2 m -57.71 -49.91 74.97 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.145 -0.972 . . . . 0.0 109.901 179.835 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.0 -24.1 65.08 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.222 -0.924 . . . . 0.0 109.936 179.873 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -69.52 -31.48 69.74 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.352 -0.843 . . . . 0.0 110.128 179.807 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -74.26 -40.73 62.16 Favored 'General case' 0 C--N 1.305 -1.352 0 O-C-N 121.329 -0.857 . . . . 0.0 109.688 179.916 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 43' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 -101.48 14.71 31.13 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.329 -0.857 . . . . 0.0 110.36 179.838 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -62.89 -63.36 1.23 Allowed 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.164 -0.96 . . . . 0.0 110.496 -179.982 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 45' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -48.14 -69.11 0.13 Allowed 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.487 -0.758 . . . . 0.0 110.732 -179.164 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 18.9 ttt180 . . . . . 0 N--CA 1.491 1.625 0 CA-C-O 117.964 -1.017 . . . . 0.0 110.204 179.909 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' C' C ' 1' ' ' LEU . . . . . . . . . . . . . 1.3 pp . . . . . 0 N--CA 1.494 1.756 0 CA-C-O 121.375 0.607 . . . . 0.0 110.209 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' C' C ' 2' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -175.61 -39.01 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.243 -0.911 . . . . 0.0 110.159 -179.946 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 3' ' ' ILE . . . . . . . . . . . . . 1.5 tt -70.09 -18.07 21.44 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.66 0 O-C-N 121.319 -0.863 . . . . 0.0 110.462 -179.878 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 4' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -78.95 -44.13 23.12 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.112 -0.993 . . . . 0.0 110.32 -179.861 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 5' ' ' THR . . . . . 0.449 ' CG2' ' N ' ' C' ' 6' ' ' ALA . 13.5 t -83.17 -41.83 18.01 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.269 -0.894 . . . . 0.0 110.211 -179.754 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 6' ' ' ALA . . . . . 0.449 ' N ' ' CG2' ' C' ' 5' ' ' THR . . . -54.58 -45.63 73.61 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.441 -0.787 . . . . 0.0 110.295 -179.998 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 7' ' ' SER . . . . . . . . . . . . . 61.4 p -75.69 -28.42 58.64 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.211 -0.931 . . . . 0.0 110.337 -179.944 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 8' ' ' SER . . . . . . . . . . . . . 12.6 t -79.5 -33.31 42.24 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.309 -0.869 . . . . 0.0 110.363 -179.953 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 9' ' ' LEU . . . . . . . . . . . . . 7.1 tt -66.52 -53.0 39.78 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.191 -0.943 . . . . 0.0 110.361 -179.83 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 10' ' ' VAL . . . . . . . . . . . . . 25.8 m -58.62 -26.15 30.48 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.693 0 O-C-N 121.282 -0.887 . . . . 0.0 110.291 -179.795 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 11' ' ' LYS . . . . . 0.41 ' O ' ' NE2' ' C' ' 15' ' ' GLN . 1.2 ttmm -68.94 -52.39 29.72 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.328 -0.857 . . . . 0.0 110.311 -179.806 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 12' ' ' ASN . . . . . . . . . . . . . 13.8 t30 -64.17 -17.62 63.69 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.195 -0.941 . . . . 0.0 110.513 -179.979 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 13' ' ' ALA . . . . . . . . . . . . . . . -87.14 -54.51 4.28 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.131 -0.98 . . . . 0.0 110.504 -179.836 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 14' ' ' ILE . . . . . . . . . . . . . 35.4 mm -53.72 -26.96 14.64 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.653 0 O-C-N 121.227 -0.921 . . . . 0.0 110.311 -179.751 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 15' ' ' GLN . . . . . 0.41 ' NE2' ' O ' ' C' ' 11' ' ' LYS . 0.9 OUTLIER -86.98 -33.77 19.5 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.191 -0.943 . . . . 0.0 110.223 -179.991 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' C' C ' 16' ' ' LEU . . . . . . . . . . . . . 4.1 tp -53.64 -52.71 59.03 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.25 -0.906 . . . . 0.0 110.21 -179.868 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 17' ' ' SER . . . . . . . . . . . . . 8.9 p -59.93 -51.02 71.46 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.276 -0.89 . . . . 0.0 110.112 179.967 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 18' ' ' ILE . . . . . . . . . . . . . 79.9 mt -61.12 -34.73 61.5 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.62 0 O-C-N 121.273 -0.892 . . . . 0.0 110.177 -179.97 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 19' ' ' GLU . . . . . . . . . . . . . 46.0 tt0 -68.44 -46.74 69.03 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.255 -0.903 . . . . 0.0 110.242 -179.952 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 20' ' ' GLN . . . . . . . . . . . . . 23.3 tt0 -67.3 -20.71 65.66 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.224 -0.922 . . . . 0.0 110.266 -179.985 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 21' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -62.99 -36.32 83.12 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.256 -0.903 . . . . 0.0 110.224 179.991 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 22' ' ' VAL . . . . . . . . . . . . . 61.3 t . . . . . 0 N--CA 1.491 1.586 0 CA-C-O 118.042 -0.98 . . . . 0.0 110.315 179.984 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 3.9 m80 . . . . . 0 N--CA 1.491 1.623 0 CA-C-O 121.202 0.525 . . . . 0.0 110.233 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -171.75 -174.93 1.44 Allowed 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.183 -0.948 . . . . 0.0 110.421 179.988 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 105.58 98.38 2.55 Favored Glycine 0 N--CA 1.49 2.272 0 N-CA-C 109.501 -1.439 . . . . 0.0 109.501 179.983 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -121.78 -32.9 3.68 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.192 -1.181 . . . . 0.0 110.338 -179.933 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 46.6 mm -120.84 141.91 39.19 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.651 0 O-C-N 121.246 -0.909 . . . . 0.0 110.32 -179.972 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 17.8 pt20 -101.39 -153.48 0.46 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.319 -0.863 . . . . 0.0 109.967 179.835 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 38.8 mm -52.1 117.84 10.95 Favored Pre-proline 0 N--CA 1.492 1.645 0 O-C-N 121.103 -0.998 . . . . 0.0 110.051 179.999 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 44.9 Cg_endo -70.18 118.45 5.69 Favored 'Trans proline' 0 C--N 1.313 -1.303 0 O-C-N 123.492 1.259 . . . . 0.0 110.668 -179.788 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 46.6 Cg_endo -72.7 -164.59 0.19 Allowed 'Trans proline' 0 C--N 1.314 -1.273 0 O-C-N 123.451 1.237 . . . . 0.0 110.442 179.916 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 94.05 -36.01 3.94 Favored Glycine 0 N--CA 1.491 2.325 0 N-CA-C 109.63 -1.388 . . . . 0.0 109.63 179.867 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -66.66 -32.48 73.83 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.218 -1.166 . . . . 0.0 110.242 179.997 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 65.9 m -57.42 -63.18 1.32 Allowed 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.268 -0.895 . . . . 0.0 110.355 -179.806 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -51.0 -41.15 59.58 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.295 -0.878 . . . . 0.0 110.533 -179.86 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -64.32 -42.79 96.15 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.317 -0.865 . . . . 0.0 110.28 -179.891 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 59.8 mt -70.24 -47.4 61.53 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.195 -0.941 . . . . 0.0 110.14 -179.934 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -54.49 -39.91 68.0 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.158 -0.964 . . . . 0.0 109.947 179.882 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -57.04 -49.81 68.93 Favored Glycine 0 N--CA 1.49 2.266 0 N-CA-C 109.202 -1.559 . . . . 0.0 109.202 179.671 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 23.7 t80 -58.65 -21.39 53.88 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.358 -1.083 . . . . 0.0 110.109 179.729 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 1.3 m -82.77 -28.57 30.26 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.285 -0.884 . . . . 0.0 110.077 -179.992 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 61.6 t -79.92 -18.1 12.6 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.701 0 O-C-N 121.356 -0.84 . . . . 0.0 110.294 179.997 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -90.79 -46.99 7.9 Favored 'General case' 0 N--CA 1.499 1.986 0 O-C-N 121.131 -0.981 . . . . 0.0 109.09 179.939 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 86.1 t -59.71 -38.52 76.25 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.512 0 O-C-N 121.669 -0.644 . . . . 0.0 110.029 -179.976 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -75.87 -36.28 59.61 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.347 -0.846 . . . . 0.0 109.959 179.701 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.98 -26.12 53.54 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.288 -0.883 . . . . 0.0 110.233 179.928 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 73.4 mm-40 -97.96 -38.58 9.34 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.257 -0.902 . . . . 0.0 110.409 -179.856 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 1.7 mt-30 53.35 56.54 13.93 Favored Pre-proline 0 N--CA 1.492 1.634 0 O-C-N 121.247 -0.908 . . . . 0.0 110.028 -179.834 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 45.0 Cg_endo -71.09 156.9 58.96 Favored 'Trans proline' 0 C--N 1.312 -1.387 0 O-C-N 123.757 1.399 . . . . 0.0 110.606 -179.798 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 44.6 Cg_endo -70.93 -21.31 28.22 Favored 'Trans proline' 0 C--N 1.312 -1.371 0 O-C-N 123.768 1.404 . . . . 0.0 110.469 179.9 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 4.4 p-10 -139.36 123.61 18.03 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.28 -0.888 . . . . 0.0 110.204 179.987 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 5.3 tp -88.82 -31.04 18.52 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.2 -0.938 . . . . 0.0 110.125 179.851 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 42.9 t -50.71 -58.4 1.83 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.769 0 O-C-N 121.27 -0.894 . . . . 0.0 110.124 179.865 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 8.0 t0 -64.23 -42.88 96.36 Favored 'General case' 0 C--N 1.302 -1.487 0 O-C-N 121.509 -0.745 . . . . 0.0 110.12 179.87 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 89.4 t80 -61.57 -40.32 94.31 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.212 -0.93 . . . . 0.0 109.904 179.722 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -56.72 -37.28 70.74 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.279 -0.888 . . . . 0.0 110.204 179.905 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . 0.405 ' O ' ' CB ' ' A' ' 39' ' ' THR . 90.1 t -74.18 -37.79 46.93 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.346 0 O-C-N 121.277 -0.889 . . . . 0.0 110.403 -179.798 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -68.76 -37.95 79.74 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.187 -0.945 . . . . 0.0 110.507 -179.819 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 33.0 t80 -63.99 -56.76 12.74 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.222 -0.924 . . . . 0.0 110.592 -179.691 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 20.0 m-85 -68.15 -48.75 64.52 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.252 -0.905 . . . . 0.0 110.908 -179.391 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' THR . . . . . 0.405 ' CB ' ' O ' ' A' ' 35' ' ' VAL . 55.5 m -52.17 -46.73 65.61 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.048 -1.033 . . . . 0.0 110.209 -179.786 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 7.1 ttt-85 -64.13 -29.0 70.15 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.199 -0.938 . . . . 0.0 110.018 179.83 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -64.82 -28.27 69.45 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.338 -0.851 . . . . 0.0 110.279 179.982 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.07 -22.02 62.17 Favored 'General case' 0 C--N 1.306 -1.307 0 O-C-N 121.212 -0.93 . . . . 0.0 109.853 179.871 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -106.8 -12.52 15.49 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.228 -0.92 . . . . 0.0 110.549 179.9 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -52.63 -55.01 25.49 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.08 -1.012 . . . . 0.0 110.705 -179.782 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 3.6 tpm_? -47.03 -43.99 20.15 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.585 -0.697 . . . . 0.0 110.836 -178.833 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 28.7 mtt85 . . . . . 0 N--CA 1.49 1.56 0 CA-C-O 117.983 -1.008 . . . . 0.0 110.223 179.848 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 1' ' ' HIS . . . . . . . . . . . . . 1.5 t-160 . . . . . 0 N--CA 1.491 1.59 0 CA-C-O 121.287 0.565 . . . . 0.0 110.192 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 2' ' ' MET . . . . . . . . . . . . . 11.9 mmt -128.92 -57.4 1.17 Allowed 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.348 -0.845 . . . . 0.0 110.045 179.891 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 3' ' ' GLY . . . . . . . . . . . . . . . 127.9 122.11 2.47 Favored Glycine 0 N--CA 1.491 2.357 0 N-CA-C 109.602 -1.399 . . . . 0.0 109.602 179.863 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 4' ' ' HIS . . . . . . . . . . . . . 6.3 t60 -100.31 -25.53 14.21 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.246 -1.15 . . . . 0.0 110.132 179.93 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 5' ' ' ILE . . . . . . . . . . . . . 1.2 tt -104.27 147.1 10.8 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.602 0 O-C-N 121.236 -0.915 . . . . 0.0 110.214 179.918 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 6' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -153.68 48.76 0.66 Allowed 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.247 -0.908 . . . . 0.0 110.22 179.958 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 7' ' ' ILE . . . . . . . . . . . . . 47.2 mm -122.04 121.59 27.93 Favored Pre-proline 0 N--CA 1.491 1.612 0 O-C-N 121.215 -0.928 . . . . 0.0 110.147 179.97 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 48.8 Cg_endo -73.33 116.46 4.71 Favored 'Trans proline' 0 C--N 1.313 -1.295 0 O-C-N 123.469 1.247 . . . . 0.0 110.614 -179.808 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 9' ' ' PRO . . . . . . . . . . . . . 48.3 Cg_endo -75.14 -172.91 1.4 Allowed 'Trans proline' 0 C--N 1.312 -1.355 0 O-C-N 123.551 1.29 . . . . 0.0 110.33 179.797 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 94.37 -18.88 56.07 Favored Glycine 0 N--CA 1.491 2.335 0 N-CA-C 109.822 -1.311 . . . . 0.0 109.822 -179.963 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 3.3 tt -88.53 -19.32 26.53 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.183 -1.186 . . . . 0.0 110.367 -180.0 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 64.8 m -63.55 -50.55 69.05 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.193 -0.942 . . . . 0.0 110.398 -179.88 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -51.53 -34.52 36.67 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.302 -0.874 . . . . 0.0 110.34 -179.892 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -69.14 -55.69 9.92 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.294 -0.879 . . . . 0.0 110.145 179.983 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -55.35 -41.2 72.19 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.214 -0.929 . . . . 0.0 109.919 179.872 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 1.7 tt0 -59.29 -39.23 82.34 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.233 -0.917 . . . . 0.0 109.734 179.679 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 17' ' ' GLY . . . . . . . . . . . . . . . -62.39 -39.67 98.07 Favored Glycine 0 N--CA 1.489 2.225 0 N-CA-C 109.152 -1.579 . . . . 0.0 109.152 179.621 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 18' ' ' TYR . . . . . . . . . . . . . 16.8 t80 -71.56 -43.91 65.5 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.261 -1.14 . . . . 0.0 109.935 179.676 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 10.3 m -53.55 -35.42 60.72 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.346 -0.846 . . . . 0.0 109.919 179.683 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 42.2 t -69.76 -73.62 0.1 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.614 0 O-C-N 121.364 -0.835 . . . . 0.0 109.904 179.769 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 7.8 pt-20 -46.75 -42.96 17.66 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.449 -0.782 . . . . 0.0 110.912 -179.752 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 22' ' ' VAL . . . . . . . . . . . . . 55.1 t -57.47 -36.25 52.71 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.622 0 O-C-N 121.108 -0.995 . . . . 0.0 109.506 179.445 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 8.2 tp -89.47 -22.32 22.54 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.347 -0.846 . . . . 0.0 109.964 179.612 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -86.85 -61.89 1.63 Allowed 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.268 -0.895 . . . . 0.0 110.139 179.782 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 29.5 mm-40 -58.84 -33.09 70.03 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.313 -0.867 . . . . 0.0 110.271 179.968 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER 49.7 59.92 16.05 Favored Pre-proline 0 N--CA 1.492 1.656 0 O-C-N 121.326 -0.859 . . . . 0.0 110.411 -179.903 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 27' ' ' PRO . . . . . . . . . . . . . 45.3 Cg_endo -71.52 158.52 53.67 Favored 'Trans proline' 0 C--N 1.311 -1.446 0 O-C-N 123.81 1.427 . . . . 0.0 110.523 -179.859 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 44.0 Cg_endo -70.16 -37.9 7.6 Favored 'Trans proline' 0 C--N 1.311 -1.435 0 O-C-N 123.704 1.371 . . . . 0.0 110.113 179.769 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -127.47 119.35 25.9 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.286 -0.884 . . . . 0.0 109.924 179.677 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 5.0 tp -73.49 -29.85 62.77 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.249 -0.907 . . . . 0.0 110.299 -179.731 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 42.0 t -52.19 -64.79 0.34 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.664 0 O-C-N 121.177 -0.952 . . . . 0.0 110.052 179.749 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 11.8 t0 -56.7 -42.6 79.41 Favored 'General case' 0 C--N 1.302 -1.458 0 O-C-N 121.444 -0.785 . . . . 0.0 110.171 179.806 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 33' ' ' PHE . . . . . . . . . . . . . 22.9 t80 -60.06 -53.58 56.1 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.163 -0.96 . . . . 0.0 109.783 179.497 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -51.01 -33.31 24.39 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.369 -0.832 . . . . 0.0 110.296 179.679 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 35' ' ' VAL . . . . . . . . . . . . . 88.9 t -79.44 -41.54 22.51 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.406 0 O-C-N 121.166 -0.959 . . . . 0.0 110.222 179.946 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -66.51 -39.04 88.47 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.307 -0.871 . . . . 0.0 110.548 -179.783 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 37' ' ' TYR . . . . . . . . . . . . . 61.1 t80 -67.14 -66.72 0.52 Allowed 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.136 -0.978 . . . . 0.0 110.423 -179.691 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 10.6 m-85 -51.26 -48.84 62.08 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.142 -0.974 . . . . 0.0 110.519 -179.586 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 39' ' ' THR . . . . . . . . . . . . . 45.6 m -53.75 -32.44 52.27 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.096 -1.003 . . . . 0.0 109.905 179.961 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -76.14 -30.5 58.18 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.174 -0.954 . . . . 0.0 109.775 179.589 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -61.9 -28.64 69.65 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.318 -0.864 . . . . 0.0 109.823 179.563 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.43 -22.11 65.53 Favored 'General case' 0 C--N 1.304 -1.391 0 O-C-N 121.363 -0.836 . . . . 0.0 109.91 179.793 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 43' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -71.2 -28.37 64.17 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.27 -0.894 . . . . 0.0 110.198 -179.884 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -66.4 -78.64 0.05 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.302 -0.874 . . . . 0.0 110.371 -179.95 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 45' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 51.22 -179.66 0.02 OUTLIER 'General case' 0 C--N 1.304 -1.408 0 O-C-N 121.663 -0.648 . . . . 0.0 110.519 -179.526 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.49 1.572 0 CA-C-O 118.002 -0.999 . . . . 0.0 110.304 -179.977 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 1' ' ' LEU . . . . . . . . . . . . . 3.9 mp . . . . . 0 N--CA 1.492 1.642 0 CA-C-O 121.266 0.555 . . . . 0.0 110.153 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' C' C ' 2' ' ' LEU . . . . . . . . . . . . . 1.1 pp -76.87 -22.88 52.83 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.259 -0.901 . . . . 0.0 110.155 179.967 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 3' ' ' ILE . . . . . . . . . . . . . 5.3 mt -58.28 -58.05 8.17 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.64 0 O-C-N 121.295 -0.878 . . . . 0.0 110.176 179.912 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 4' ' ' GLU . . . . . . . . . . . . . 6.8 tm-20 -53.36 -41.18 65.56 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.204 -0.935 . . . . 0.0 109.968 179.976 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 5' ' ' THR . . . . . . . . . . . . . 1.3 m -63.32 -34.08 76.91 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.289 -0.882 . . . . 0.0 109.892 179.886 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 6' ' ' ALA . . . . . . . . . . . . . . . -75.77 -32.62 60.02 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.281 -0.887 . . . . 0.0 110.101 179.934 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 7' ' ' SER . . . . . . . . . . . . . 27.8 t -68.6 -34.53 75.93 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.192 -0.943 . . . . 0.0 110.187 179.899 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 8' ' ' SER . . . . . . . . . . . . . 46.7 t -67.94 -32.96 73.77 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.341 -0.85 . . . . 0.0 110.285 179.89 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 9' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -68.35 -36.02 78.62 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.176 -0.952 . . . . 0.0 110.17 179.919 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C ' 10' ' ' VAL . . . . . . . . . . . . . 95.0 t -57.53 -44.25 84.59 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 O-C-N 121.293 -0.879 . . . . 0.0 110.125 -179.978 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.18 -55.38 34.54 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.377 -0.827 . . . . 0.0 110.192 179.951 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C ' 12' ' ' ASN . . . . . . . . . . . . . 1.2 m-80 -60.34 -26.73 66.81 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.289 -0.882 . . . . 0.0 110.384 -179.877 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 13' ' ' ALA . . . . . . . . . . . . . . . -72.51 -46.58 53.99 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.189 -0.944 . . . . 0.0 110.251 -179.861 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 14' ' ' ILE . . . . . . . . . . . . . 49.8 mm -71.32 -22.42 22.32 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.64 0 O-C-N 121.256 -0.902 . . . . 0.0 110.309 -179.878 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 15' ' ' GLN . . . . . 0.401 ' O ' ' N ' ' C' ' 17' ' ' SER . 12.3 mt-30 -82.81 -46.13 13.45 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.227 -0.921 . . . . 0.0 110.349 179.986 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C ' 16' ' ' LEU . . . . . . . . . . . . . 71.2 mt -69.85 65.17 0.22 Allowed 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.301 -0.874 . . . . 0.0 110.13 179.948 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 17' ' ' SER . . . . . 0.401 ' N ' ' O ' ' C' ' 15' ' ' GLN . 13.5 p -177.16 -70.1 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.281 -0.887 . . . . 0.0 109.914 -179.95 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C ' 18' ' ' ILE . . . . . . . . . . . . . 31.4 pt -69.88 -20.73 23.58 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.593 0 O-C-N 121.314 -0.866 . . . . 0.0 110.187 179.79 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 19' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -98.39 14.94 26.3 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.219 -0.926 . . . . 0.0 110.575 -179.906 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 20' ' ' GLN . . . . . . . . . . . . . 29.8 tt0 -134.35 -56.35 0.85 Allowed 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.09 -1.006 . . . . 0.0 110.128 179.832 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 21' ' ' LEU . . . . . . . . . . . . . 3.0 tp -88.76 47.98 1.57 Allowed 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.23 -0.918 . . . . 0.0 110.134 179.889 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 22' ' ' VAL . . . . . . . . . . . . . 7.1 p . . . . . 0 N--CA 1.491 1.606 0 CA-C-O 117.961 -1.019 . . . . 0.0 110.227 -179.862 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.492 1.626 0 CA-C-O 121.24 0.543 . . . . 0.0 110.277 . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -61.61 -59.38 5.3 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.234 -0.916 . . . . 0.0 110.051 179.995 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 150.4 89.21 0.07 OUTLIER Glycine 0 N--CA 1.491 2.322 0 N-CA-C 109.631 -1.388 . . . . 0.0 109.631 179.953 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -135.78 -161.63 1.18 Allowed 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.261 -1.14 . . . . 0.0 110.2 179.997 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 4.6 mp -112.18 128.83 68.56 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.574 0 O-C-N 121.291 -0.881 . . . . 0.0 110.198 179.88 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 6.1 pt20 -171.41 175.16 4.23 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.314 -0.866 . . . . 0.0 109.907 -179.962 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . 0.425 ' CD1' ' O ' ' A' ' 7' ' ' ILE . 2.2 pp -76.7 132.16 72.47 Favored Pre-proline 0 N--CA 1.492 1.669 0 O-C-N 121.141 -0.974 . . . . 0.0 109.925 -179.912 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 49.6 Cg_endo -75.15 138.33 22.55 Favored 'Trans proline' 0 C--N 1.313 -1.336 0 O-C-N 123.5 1.263 . . . . 0.0 110.621 -179.773 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 48.4 Cg_endo -74.51 164.33 34.14 Favored 'Trans proline' 0 C--N 1.312 -1.381 0 O-C-N 123.608 1.32 . . . . 0.0 110.22 179.803 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 99.3 -33.48 6.15 Favored Glycine 0 N--CA 1.49 2.294 0 N-CA-C 109.528 -1.429 . . . . 0.0 109.528 179.989 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 11.6 tp -52.88 -46.39 67.9 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.282 -1.128 . . . . 0.0 110.066 179.869 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 98.2 m -59.19 -47.07 86.68 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.193 -0.942 . . . . 0.0 110.151 179.864 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.6 tm-20 -57.47 -29.23 64.07 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.232 -0.917 . . . . 0.0 110.057 179.846 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 4.0 tt -78.41 -44.56 24.51 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.267 -0.895 . . . . 0.0 110.242 179.924 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 98.4 mt -70.39 -50.53 37.78 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.288 -0.883 . . . . 0.0 110.271 -179.859 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -53.3 -46.81 69.53 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.164 -0.96 . . . . 0.0 110.052 179.959 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -56.89 -40.35 90.08 Favored Glycine 0 N--CA 1.491 2.301 0 N-CA-C 109.137 -1.585 . . . . 0.0 109.137 179.613 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 22.8 t80 -66.64 -44.74 81.16 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.309 -1.113 . . . . 0.0 109.812 179.668 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 52.4 m -57.3 -26.85 61.54 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.366 -0.834 . . . . 0.0 109.902 179.632 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 44.2 t -73.53 -72.27 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.569 0 O-C-N 121.381 -0.824 . . . . 0.0 110.258 179.995 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.443 ' OE2' ' CD1' ' A' ' 37' ' ' TYR . 10.1 pt-20 -46.42 -43.56 16.5 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.39 -0.819 . . . . 0.0 111.144 -179.476 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 99.6 t -58.52 -37.34 64.08 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.657 0 O-C-N 120.914 -1.116 . . . . 0.0 110.004 179.955 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -78.57 -20.63 50.12 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.362 -0.836 . . . . 0.0 110.298 179.939 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -95.23 -58.33 2.17 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.284 -0.885 . . . . 0.0 110.462 -179.736 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . 0.43 ' O ' ' CG ' ' A' ' 26' ' ' GLN . 7.9 mp0 -63.11 -22.34 66.79 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.218 -0.926 . . . . 0.0 110.531 -179.73 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . 0.43 ' CG ' ' O ' ' A' ' 25' ' ' GLN . 3.4 pt20 36.49 59.24 3.46 Favored Pre-proline 0 N--CA 1.505 2.279 0 O-C-N 122.013 -0.429 . . . . 0.0 111.589 -179.9 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo -69.95 161.22 46.78 Favored 'Trans proline' 0 C--N 1.31 -1.459 0 O-C-N 123.796 1.419 . . . . 0.0 110.763 -179.735 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 43.4 Cg_endo -69.81 -46.34 1.24 Allowed 'Trans proline' 0 C--N 1.311 -1.398 0 O-C-N 123.84 1.442 . . . . 0.0 110.33 179.975 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -120.54 116.45 25.4 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.355 -0.84 . . . . 0.0 110.048 179.86 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 6.7 tp -70.22 -30.8 67.98 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.391 -0.818 . . . . 0.0 110.273 -179.992 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 41.5 t -51.3 -64.8 0.31 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.663 0 O-C-N 121.239 -0.913 . . . . 0.0 109.956 179.929 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 1.4 t0 -55.3 -39.36 69.8 Favored 'General case' 0 C--N 1.302 -1.467 0 O-C-N 121.429 -0.794 . . . . 0.0 110.022 179.654 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . 0.401 ' CZ ' ' OE2' ' A' ' 21' ' ' GLU . 66.4 t80 -62.35 -44.69 95.89 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.267 -0.896 . . . . 0.0 109.876 179.63 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -59.34 -42.9 92.58 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.31 -0.868 . . . . 0.0 110.116 179.887 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . 0.44 ' CG2' ' HB3' ' B' ' 38' ' ' PHE . 71.9 t -73.09 -24.39 20.8 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.382 0 O-C-N 121.209 -0.932 . . . . 0.0 109.977 179.903 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -80.98 -36.64 30.51 Favored 'General case' 0 C--N 1.304 -1.398 0 O-C-N 121.288 -0.883 . . . . 0.0 109.793 -179.911 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . 0.443 ' CD1' ' OE2' ' A' ' 21' ' ' GLU . 61.4 t80 -74.94 -61.28 1.94 Allowed 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.15 -0.969 . . . . 0.0 110.318 -179.826 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . 0.426 ' HB3' ' CG2' ' B' ' 35' ' ' VAL . 14.9 m-85 -52.15 -51.36 58.47 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.316 -0.865 . . . . 0.0 110.415 -179.925 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 21.2 m -51.91 -43.25 63.32 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.189 -0.944 . . . . 0.0 110.069 179.914 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.73 -30.52 70.03 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.232 -0.918 . . . . 0.0 110.14 179.829 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -57.86 -36.5 72.44 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.235 -0.916 . . . . 0.0 109.966 179.917 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 8.4 mtm180 -50.61 -26.86 5.86 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.321 -0.862 . . . . 0.0 109.933 179.563 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . 0.413 ' O ' ' N ' ' A' ' 45' ' ' ARG . 1.4 mm-40 -104.16 -61.22 1.47 Allowed 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.501 -0.749 . . . . 0.0 109.855 179.679 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . 67.14 -61.63 0.34 Allowed 'General case' 0 N--CA 1.501 2.104 0 O-C-N 121.525 -0.734 . . . . 0.0 110.78 179.816 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.413 ' N ' ' O ' ' A' ' 43' ' ' GLU . 0.0 OUTLIER -52.21 176.1 0.02 OUTLIER 'General case' 0 C--N 1.3 -1.559 0 O-C-N 121.542 -0.724 . . . . 0.0 110.546 -179.058 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 31.1 ttp180 . . . . . 0 N--CA 1.492 1.658 0 CA-C-O 117.992 -1.004 . . . . 0.0 110.164 -179.967 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 1' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.492 1.673 0 CA-C-O 121.312 0.577 . . . . 0.0 110.167 . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 2' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 53.59 60.17 3.86 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.197 -0.94 . . . . 0.0 110.111 179.936 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 3' ' ' GLY . . . . . . . . . . . . . . . -106.46 -120.7 4.67 Favored Glycine 0 N--CA 1.49 2.275 0 N-CA-C 109.691 -1.363 . . . . 0.0 109.691 180.0 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 4' ' ' HIS . . . . . . . . . . . . . 1.3 t-160 -126.69 -161.5 1.07 Allowed 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.255 -1.144 . . . . 0.0 110.489 -179.769 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 5' ' ' ILE . . . . . 0.453 ' CD1' ' N ' ' B' ' 6' ' ' GLN . 0.0 OUTLIER -100.03 146.93 8.07 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.561 0 O-C-N 121.489 -0.757 . . . . 0.0 109.802 179.971 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 6' ' ' GLN . . . . . 0.453 ' N ' ' CD1' ' B' ' 5' ' ' ILE . 8.4 mt-30 -128.46 155.64 44.47 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.08 -1.013 . . . . 0.0 110.704 -179.483 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 7' ' ' ILE . . . . . . . . . . . . . 33.8 mm -48.37 128.64 13.02 Favored Pre-proline 0 N--CA 1.495 1.794 0 O-C-N 121.268 -0.895 . . . . 0.0 110.581 -179.949 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 48.8 Cg_endo -75.88 117.85 4.85 Favored 'Trans proline' 0 C--N 1.314 -1.26 0 O-C-N 123.469 1.247 . . . . 0.0 110.32 179.811 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 9' ' ' PRO . . . . . . . . . . . . . 46.1 Cg_endo -73.27 153.83 51.18 Favored 'Trans proline' 0 C--N 1.312 -1.36 0 O-C-N 123.535 1.282 . . . . 0.0 110.396 -179.854 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 117.76 -23.38 9.5 Favored Glycine 0 N--CA 1.49 2.282 0 N-CA-C 109.508 -1.437 . . . . 0.0 109.508 -179.863 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -73.5 -46.74 46.11 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.229 -1.16 . . . . 0.0 110.215 -179.961 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 95.6 m -54.78 -30.0 55.72 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.156 -0.965 . . . . 0.0 110.138 -179.955 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 4.4 tt0 -64.59 -48.77 73.71 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.314 -0.866 . . . . 0.0 110.18 179.999 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -68.82 -31.02 69.7 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.3 -0.875 . . . . 0.0 110.23 179.901 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -65.27 -55.38 18.69 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.223 -0.923 . . . . 0.0 110.254 -179.978 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -53.11 -45.16 68.16 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.26 -0.9 . . . . 0.0 110.177 179.837 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 17' ' ' GLY . . . . . . . . . . . . . . . -56.35 -36.88 71.22 Favored Glycine 0 N--CA 1.49 2.285 0 N-CA-C 109.256 -1.538 . . . . 0.0 109.256 179.733 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 18' ' ' TYR . . . . . . . . . . . . . 38.5 t80 -73.41 -44.88 57.47 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.386 -1.067 . . . . 0.0 110.063 179.811 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 52.2 m -57.28 -23.31 47.55 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.239 -0.913 . . . . 0.0 110.05 179.923 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 37.6 t -78.58 -70.34 0.38 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.649 0 O-C-N 121.409 -0.807 . . . . 0.0 110.143 -179.982 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 21' ' ' GLU . . . . . 0.429 ' OE1' ' CZ ' ' B' ' 37' ' ' TYR . 10.2 pt-20 -44.58 -42.81 7.63 Favored 'General case' 0 N--CA 1.497 1.906 0 O-C-N 121.514 -0.741 . . . . 0.0 111.065 -179.507 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 22' ' ' VAL . . . . . . . . . . . . . 84.7 t -66.23 -34.59 71.21 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.551 0 O-C-N 121.051 -1.031 . . . . 0.0 109.64 179.556 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -75.47 -28.72 59.36 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.342 -0.849 . . . . 0.0 109.923 179.802 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -90.58 -65.2 1.04 Allowed 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.377 -0.827 . . . . 0.0 110.187 -179.876 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 25' ' ' GLN . . . . . 0.446 ' O ' ' CG ' ' B' ' 25' ' ' GLN . 1.9 tt0 -85.29 56.56 4.0 Favored 'General case' 0 C--N 1.305 -1.35 0 O-C-N 121.114 -0.991 . . . . 0.0 109.845 179.911 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 10.1 mt-30 -38.29 98.8 0.17 Allowed Pre-proline 0 N--CA 1.499 1.986 0 O-C-N 121.896 -0.503 . . . . 0.0 111.56 -179.717 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 27' ' ' PRO . . . . . 0.411 ' HD3' ' O ' ' B' ' 25' ' ' GLN . 47.3 Cg_endo -74.26 160.05 42.86 Favored 'Trans proline' 0 C--N 1.311 -1.421 0 O-C-N 123.909 1.478 . . . . 0.0 110.41 -179.909 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 44.4 Cg_endo -71.39 -28.16 18.41 Favored 'Trans proline' 0 C--N 1.312 -1.363 0 O-C-N 123.677 1.356 . . . . 0.0 109.967 179.691 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -146.59 112.38 5.67 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.392 -0.818 . . . . 0.0 109.926 179.695 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 1.7 tp -57.09 -33.74 67.61 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.226 -0.921 . . . . 0.0 109.882 -179.994 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 47.5 t -53.55 -55.9 11.13 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.653 0 O-C-N 121.353 -0.842 . . . . 0.0 109.898 179.59 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -65.21 -40.35 94.03 Favored 'General case' 0 C--N 1.301 -1.506 0 O-C-N 121.58 -0.7 . . . . 0.0 110.191 -179.93 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 33' ' ' PHE . . . . . . . . . . . . . 79.3 t80 -63.83 -43.29 96.64 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.214 -0.928 . . . . 0.0 109.757 179.642 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -59.01 -38.69 79.8 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.31 -0.868 . . . . 0.0 110.109 179.846 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 35' ' ' VAL . . . . . 0.426 ' CG2' ' HB3' ' A' ' 38' ' ' PHE . 70.7 t -79.84 -25.57 12.1 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.358 0 O-C-N 121.245 -0.909 . . . . 0.0 109.901 179.791 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -81.88 -36.83 27.76 Favored 'General case' 0 C--N 1.304 -1.391 0 O-C-N 121.297 -0.877 . . . . 0.0 110.112 -179.791 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 37' ' ' TYR . . . . . 0.429 ' CZ ' ' OE1' ' B' ' 21' ' ' GLU . 87.5 t80 -76.1 -59.52 2.73 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.043 -1.036 . . . . 0.0 110.629 -179.658 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 38' ' ' PHE . . . . . 0.44 ' HB3' ' CG2' ' A' ' 35' ' ' VAL . 4.3 m-85 -55.48 -46.38 76.87 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.232 -0.917 . . . . 0.0 110.655 -179.554 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 39' ' ' THR . . . . . . . . . . . . . 8.7 m -53.23 -48.73 67.94 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 120.939 -1.101 . . . . 0.0 109.975 179.993 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -55.74 -42.46 75.43 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.222 -0.924 . . . . 0.0 110.255 179.989 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 1.6 mt -54.56 -40.96 69.25 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.206 -0.934 . . . . 0.0 109.913 179.75 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.16 -25.46 67.77 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.233 -0.917 . . . . 0.0 109.907 179.79 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 43' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -94.78 -28.1 15.44 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.364 -0.835 . . . . 0.0 110.103 179.798 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -75.82 -66.69 0.75 Allowed 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.367 -0.833 . . . . 0.0 110.317 179.929 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 45' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -50.83 157.48 0.8 Allowed 'General case' 0 N--CA 1.487 1.401 0 O-C-N 121.529 -0.732 . . . . 0.0 110.546 -179.222 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 5.4 mmm180 . . . . . 0 N--CA 1.492 1.633 0 CA-C-O 117.934 -1.032 . . . . 0.0 110.186 -179.912 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' C' C ' 1' ' ' LEU . . . . . 0.41 ' O ' ' N ' ' C' ' 3' ' ' ILE . 5.5 mt . . . . . 0 N--CA 1.491 1.597 0 CA-C-O 121.106 0.479 . . . . 0.0 110.199 . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 2' ' ' LEU . . . . . 0.403 ' CB ' ' O ' ' C' ' 1' ' ' LEU . 0.6 OUTLIER 67.28 -63.44 0.29 Allowed 'General case' 0 N--CA 1.501 2.111 0 O-C-N 121.44 -0.788 . . . . 0.0 110.419 -179.958 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' C' C ' 3' ' ' ILE . . . . . 0.41 ' N ' ' O ' ' C' ' 1' ' ' LEU . 49.3 mm -66.3 -53.93 31.57 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.636 0 O-C-N 121.078 -1.014 . . . . 0.0 110.254 -179.895 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 4' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -51.77 -38.03 53.85 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.248 -0.908 . . . . 0.0 110.327 -179.981 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 5' ' ' THR . . . . . . . . . . . . . 93.1 m -72.62 -48.42 39.75 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.387 -0.821 . . . . 0.0 110.364 -179.921 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 6' ' ' ALA . . . . . . . . . . . . . . . -56.35 -25.65 49.99 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.254 -0.903 . . . . 0.0 110.477 -179.781 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 7' ' ' SER . . . . . . . . . . . . . 63.1 m -83.79 -39.12 20.41 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.124 -0.985 . . . . 0.0 110.267 -179.897 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 8' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -75.39 -37.43 60.52 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.18 -0.95 . . . . 0.0 110.107 179.923 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 9' ' ' LEU . . . . . . . . . . . . . 2.6 tp -66.34 -56.68 9.96 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.246 -0.909 . . . . 0.0 110.065 179.85 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 10' ' ' VAL . . . . . . . . . . . . . 10.9 p -51.64 -28.38 8.9 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.597 0 O-C-N 121.309 -0.869 . . . . 0.0 110.405 179.966 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 11' ' ' LYS . . . . . . . . . . . . . 8.9 mttm -67.98 -49.0 64.25 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.266 -0.897 . . . . 0.0 110.269 179.969 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 12' ' ' ASN . . . . . . . . . . . . . 28.4 m-20 -93.65 -0.31 56.16 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.269 -0.895 . . . . 0.0 110.761 179.985 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 13' ' ' ALA . . . . . . . . . . . . . . . -107.51 -14.87 14.74 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 120.957 -1.089 . . . . 0.0 110.485 179.989 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 14' ' ' ILE . . . . . . . . . . . . . 47.9 mm -119.76 -35.84 1.58 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.689 0 O-C-N 121.105 -0.997 . . . . 0.0 110.222 -179.852 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 15' ' ' GLN . . . . . . . . . . . . . 7.6 mt-30 -106.53 30.11 6.31 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.226 -0.921 . . . . 0.0 110.222 -179.979 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 16' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -71.59 -18.54 62.22 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.293 -0.88 . . . . 0.0 110.556 -179.903 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 17' ' ' SER . . . . . . . . . . . . . 2.4 t -112.82 -57.11 2.33 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.122 -0.987 . . . . 0.0 110.365 -179.91 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 18' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -54.33 -31.64 22.79 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.597 0 O-C-N 121.259 -0.9 . . . . 0.0 110.212 179.994 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 19' ' ' GLU . . . . . . . . . . . . . 20.2 tt0 -114.65 55.84 0.74 Allowed 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.147 -0.971 . . . . 0.0 110.182 179.992 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 20' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -169.07 -39.21 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.217 -0.927 . . . . 0.0 110.273 179.864 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 21' ' ' LEU . . . . . . . . . . . . . 25.9 mt -93.91 29.68 2.04 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.232 -0.917 . . . . 0.0 110.169 179.989 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 22' ' ' VAL . . . . . . . . . . . . . 88.1 t . . . . . 0 N--CA 1.492 1.626 0 CA-C-O 118.078 -0.963 . . . . 0.0 110.179 -179.96 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.655 0 CA-C-O 121.279 0.561 . . . . 0.0 110.134 . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 1.4 mmm -104.58 79.53 1.57 Allowed 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.222 -0.924 . . . . 0.0 110.312 179.939 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -113.3 -141.51 8.0 Favored Glycine 0 N--CA 1.49 2.264 0 N-CA-C 109.463 -1.455 . . . . 0.0 109.463 179.887 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 32.0 p-80 -127.45 154.77 44.67 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.181 -1.187 . . . . 0.0 110.277 179.946 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 1.4 tt -116.47 133.58 62.61 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.634 0 O-C-N 121.203 -0.936 . . . . 0.0 110.283 -179.87 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 1.5 mt-30 -143.46 173.06 11.96 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.166 -0.959 . . . . 0.0 110.461 -179.908 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . 0.415 ' CD1' ' N ' ' A' ' 7' ' ' ILE . 4.9 mp -130.18 122.36 20.1 Favored Pre-proline 0 N--CA 1.493 1.693 0 O-C-N 121.209 -0.932 . . . . 0.0 110.191 -179.978 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 48.6 Cg_endo -75.23 120.11 5.86 Favored 'Trans proline' 0 C--N 1.314 -1.281 0 O-C-N 123.472 1.248 . . . . 0.0 110.44 179.881 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 48.1 Cg_endo -77.42 0.75 9.47 Favored 'Trans proline' 0 C--N 1.314 -1.256 0 O-C-N 123.408 1.215 . . . . 0.0 111.565 -179.99 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -65.65 -19.0 66.66 Favored Glycine 0 N--CA 1.491 2.314 0 N-CA-C 109.807 -1.317 . . . . 0.0 109.807 179.994 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 1.7 mp -84.36 -24.36 29.74 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.152 -1.205 . . . . 0.0 110.492 -179.739 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 71.5 m -54.8 -57.14 12.77 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.153 -0.967 . . . . 0.0 110.589 -179.754 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -56.94 -48.71 77.65 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.276 -0.89 . . . . 0.0 110.631 -179.593 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.5 tp -50.75 -58.13 6.66 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.277 -0.889 . . . . 0.0 110.692 -179.489 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 2.4 mp -56.36 -49.41 74.49 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.199 -0.938 . . . . 0.0 110.389 -179.752 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -50.41 -49.15 55.44 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.185 -0.947 . . . . 0.0 110.324 179.981 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -55.25 -38.84 69.24 Favored Glycine 0 N--CA 1.491 2.333 0 N-CA-C 109.055 -1.618 . . . . 0.0 109.055 179.658 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . 0.409 ' O ' ' CG2' ' A' ' 22' ' ' VAL . 24.7 t80 -67.42 -50.65 58.53 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.407 -1.055 . . . . 0.0 109.708 179.492 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 70.9 m -57.01 -32.83 66.54 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.282 -0.886 . . . . 0.0 109.807 179.621 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 44.8 t -63.46 -73.76 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.545 0 O-C-N 121.357 -0.839 . . . . 0.0 110.22 179.959 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.414 ' OE1' ' CE1' ' A' ' 37' ' ' TYR . 10.3 pt-20 -45.06 -43.26 9.3 Favored 'General case' 0 N--CA 1.498 1.931 0 O-C-N 121.461 -0.774 . . . . 0.0 111.035 -179.575 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.409 ' CG2' ' O ' ' A' ' 18' ' ' TYR . 94.6 t -51.92 -53.84 15.99 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.713 0 O-C-N 121.1 -1.0 . . . . 0.0 110.144 179.888 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -56.81 -35.27 68.57 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.271 -0.893 . . . . 0.0 110.115 179.874 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 1.4 mmt180 -77.34 -62.9 1.5 Allowed 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.31 -0.869 . . . . 0.0 110.331 -179.925 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 34.9 mm-40 -57.84 -39.34 77.45 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.218 -0.926 . . . . 0.0 110.26 -179.955 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 51.79 56.93 16.34 Favored Pre-proline 0 N--CA 1.492 1.661 0 O-C-N 121.235 -0.916 . . . . 0.0 110.102 -179.794 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 43.8 Cg_endo -70.06 161.06 47.39 Favored 'Trans proline' 0 C--N 1.311 -1.403 0 O-C-N 123.735 1.387 . . . . 0.0 110.51 -179.996 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 45.4 Cg_endo -71.5 -34.04 10.0 Favored 'Trans proline' 0 C--N 1.311 -1.401 0 O-C-N 123.694 1.365 . . . . 0.0 110.23 -179.976 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -130.12 119.45 23.04 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.325 -0.859 . . . . 0.0 110.264 -179.847 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 5.3 tp -75.28 -35.57 61.29 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.342 -0.848 . . . . 0.0 109.816 179.802 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.436 ' CG1' ' HD2' ' B' ' 42' ' ' ARG . 44.9 t -51.55 -59.18 1.46 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.695 0 O-C-N 121.279 -0.888 . . . . 0.0 109.855 179.564 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 6.0 t0 -58.55 -40.1 82.08 Favored 'General case' 0 C--N 1.301 -1.529 0 O-C-N 121.683 -0.636 . . . . 0.0 109.932 179.753 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 42.4 t80 -62.05 -48.78 78.7 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.157 -0.965 . . . . 0.0 109.511 179.448 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -52.97 -38.2 61.94 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.389 -0.819 . . . . 0.0 110.121 179.716 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 97.1 t -70.06 -35.73 65.24 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.367 0 O-C-N 121.25 -0.906 . . . . 0.0 110.174 -179.958 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -83.14 -20.17 35.28 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.294 -0.879 . . . . 0.0 110.444 -179.989 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . 0.414 ' CE1' ' OE1' ' A' ' 21' ' ' GLU . 33.7 t80 -73.31 -62.21 1.55 Allowed 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.205 -0.935 . . . . 0.0 110.565 -179.665 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 29.3 m-85 -67.18 -45.21 77.63 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.204 -0.935 . . . . 0.0 110.644 -179.571 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 42.7 m -52.53 -39.28 61.21 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.156 -0.965 . . . . 0.0 110.252 -179.939 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 3.6 mtp85 -74.37 -34.59 63.41 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.204 -0.935 . . . . 0.0 110.008 179.773 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 10.5 tp -65.97 -19.95 66.04 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.38 -0.825 . . . . 0.0 110.396 -179.939 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -82.69 -21.91 34.73 Favored 'General case' 0 C--N 1.305 -1.367 0 O-C-N 121.139 -0.976 . . . . 0.0 109.915 179.977 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 12.2 mt-10 -104.21 -4.99 22.35 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.194 -0.941 . . . . 0.0 110.816 -179.983 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -108.7 -75.93 0.62 Allowed 'General case' 0 N--CA 1.492 1.652 0 O-C-N 120.933 -1.104 . . . . 0.0 110.318 179.93 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -56.08 158.07 4.2 Favored 'General case' 0 C--N 1.304 -1.405 0 O-C-N 121.515 -0.74 . . . . 0.0 110.237 -179.308 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.576 0 CA-C-O 118.028 -0.987 . . . . 0.0 110.265 -179.976 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 1' ' ' HIS . . . . . . . . . . . . . 51.3 m80 . . . . . 0 N--CA 1.491 1.621 0 CA-C-O 121.273 0.559 . . . . 0.0 110.147 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 2' ' ' MET . . . . . . . . . . . . . 2.9 tpt -102.66 113.97 27.82 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.354 -0.841 . . . . 0.0 110.109 -179.965 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 3' ' ' GLY . . . . . . . . . . . . . . . -169.94 53.57 0.2 Allowed Glycine 0 N--CA 1.49 2.271 0 N-CA-C 109.458 -1.457 . . . . 0.0 109.458 -179.935 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 4' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -103.67 53.79 0.75 Allowed 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.263 -1.14 . . . . 0.0 110.39 -179.851 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 5' ' ' ILE . . . . . 0.405 ' CD1' ' N ' ' B' ' 5' ' ' ILE . 5.3 mp -110.42 -11.89 11.41 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.61 0 O-C-N 121.163 -0.961 . . . . 0.0 110.711 179.837 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 6' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 179.65 33.12 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.347 -0.846 . . . . 0.0 110.492 179.363 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 7' ' ' ILE . . . . . . . . . . . . . 4.3 mp -145.39 100.37 4.45 Favored Pre-proline 0 N--CA 1.493 1.689 0 O-C-N 121.216 -0.928 . . . . 0.0 110.43 -179.905 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 45.0 Cg_endo -72.43 139.34 31.48 Favored 'Trans proline' 0 C--N 1.312 -1.347 0 O-C-N 123.604 1.318 . . . . 0.0 110.628 179.885 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 9' ' ' PRO . . . . . . . . . . . . . 47.9 Cg_endo -73.72 156.82 48.68 Favored 'Trans proline' 0 C--N 1.312 -1.369 0 O-C-N 123.654 1.344 . . . . 0.0 110.248 179.675 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 135.25 -31.27 2.71 Favored Glycine 0 N--CA 1.49 2.28 0 N-CA-C 109.606 -1.398 . . . . 0.0 109.606 179.884 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 1.8 mp -78.32 -22.96 47.32 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.276 -1.132 . . . . 0.0 110.151 179.941 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 89.3 m -54.4 -42.15 70.08 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.378 -0.826 . . . . 0.0 110.302 179.985 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -79.4 -36.09 39.68 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.282 -0.886 . . . . 0.0 110.274 179.976 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 2.8 tp -65.2 -49.95 67.78 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.235 -0.916 . . . . 0.0 110.151 -179.994 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 6.0 mp -62.78 -50.29 71.62 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.319 -0.863 . . . . 0.0 110.391 -179.971 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 1.1 mt-30 -52.04 -40.5 61.18 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.153 -0.967 . . . . 0.0 110.139 179.972 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 17' ' ' GLY . . . . . . . . . . . . . . . -57.6 -51.67 56.51 Favored Glycine 0 N--CA 1.491 2.301 0 N-CA-C 109.169 -1.572 . . . . 0.0 109.169 179.649 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 18' ' ' TYR . . . . . 0.45 ' CZ ' ' HB3' ' B' ' 34' ' ' ALA . 12.0 t80 -54.04 -38.99 65.8 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.369 -1.077 . . . . 0.0 110.19 179.891 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 51.9 m -71.03 -32.94 69.84 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.391 -0.818 . . . . 0.0 110.307 -179.862 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 90.3 t -70.1 -17.38 20.91 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.625 0 O-C-N 121.216 -0.927 . . . . 0.0 110.473 -179.892 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 21' ' ' GLU . . . . . 0.472 ' OE1' ' CD1' ' B' ' 37' ' ' TYR . 0.7 OUTLIER -92.23 -57.79 2.59 Favored 'General case' 0 N--CA 1.497 1.905 0 O-C-N 121.09 -1.006 . . . . 0.0 109.439 -179.927 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 22' ' ' VAL . . . . . . . . . . . . . 96.5 t -49.85 -26.34 2.76 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.528 0 O-C-N 121.565 -0.71 . . . . 0.0 110.476 -179.952 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 1.2 mt -84.78 -47.34 10.49 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.214 -0.929 . . . . 0.0 110.076 179.722 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.47 -66.6 0.64 Allowed 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.205 -0.934 . . . . 0.0 110.178 179.82 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 25' ' ' GLN . . . . . 0.429 ' O ' ' CG ' ' B' ' 25' ' ' GLN . 0.2 OUTLIER -91.68 59.69 3.8 Favored 'General case' 0 C--N 1.306 -1.292 0 O-C-N 121.039 -1.038 . . . . 0.0 109.917 179.903 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 21.2 mt-30 -38.42 98.63 0.17 Allowed Pre-proline 0 N--CA 1.5 2.056 0 O-C-N 122.042 -0.411 . . . . 0.0 111.676 -179.646 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 27' ' ' PRO . . . . . 0.486 ' HG3' ' CD2' ' B' ' 33' ' ' PHE . 49.4 Cg_endo -77.42 163.66 29.57 Favored 'Trans proline' 0 C--N 1.311 -1.422 0 O-C-N 123.821 1.432 . . . . 0.0 110.55 -179.986 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 45.1 Cg_endo -71.84 -52.65 0.19 Allowed 'Trans proline' 0 C--N 1.313 -1.34 0 O-C-N 123.679 1.357 . . . . 0.0 110.745 -179.946 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 58.0 m-20 -117.53 116.83 27.89 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.12 -0.988 . . . . 0.0 110.31 -179.826 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -60.5 -45.49 93.59 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.28 -0.888 . . . . 0.0 110.169 179.991 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 43.5 t -50.6 -63.05 0.44 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.761 0 O-C-N 121.233 -0.917 . . . . 0.0 109.964 179.737 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 4.8 t0 -57.92 -33.37 68.72 Favored 'General case' 0 C--N 1.303 -1.43 0 O-C-N 121.477 -0.764 . . . . 0.0 109.855 179.711 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 33' ' ' PHE . . . . . 0.486 ' CD2' ' HG3' ' B' ' 27' ' ' PRO . 32.7 t80 -67.24 -51.32 54.56 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.316 -0.865 . . . . 0.0 109.477 179.38 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 34' ' ' ALA . . . . . 0.45 ' HB3' ' CZ ' ' B' ' 18' ' ' TYR . . . -54.05 -32.14 53.67 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.399 -0.813 . . . . 0.0 109.961 179.698 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 35' ' ' VAL . . . . . . . . . . . . . 87.5 t -71.8 -38.19 64.69 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.355 0 O-C-N 121.277 -0.889 . . . . 0.0 110.117 -179.981 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -73.45 -34.36 65.36 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.182 -0.949 . . . . 0.0 110.23 179.922 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 37' ' ' TYR . . . . . 0.472 ' CD1' ' OE1' ' B' ' 21' ' ' GLU . 19.1 t80 -70.57 -66.62 0.58 Allowed 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.24 -0.913 . . . . 0.0 110.328 -179.945 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 24.8 m-85 -51.36 -53.49 35.78 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.24 -0.912 . . . . 0.0 110.428 -179.877 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 39' ' ' THR . . . . . . . . . . . . . 51.6 m -51.27 -30.88 19.25 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.152 -0.968 . . . . 0.0 110.006 179.79 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -82.83 -28.19 30.33 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.306 -0.871 . . . . 0.0 109.799 179.642 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -54.09 -43.87 70.71 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.4 -0.813 . . . . 0.0 110.094 179.817 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 42' ' ' ARG . . . . . 0.436 ' HD2' ' CG1' ' A' ' 31' ' ' VAL . 0.0 OUTLIER -51.9 -30.3 23.62 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.27 -0.894 . . . . 0.0 110.645 -179.733 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 43' ' ' GLU . . . . . . . . . . . . . 18.4 mm-40 -99.21 -14.53 19.26 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.126 -0.984 . . . . 0.0 110.803 -179.738 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -59.27 -77.49 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.084 -1.01 . . . . 0.0 110.524 -179.864 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 45' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.32 -31.3 32.55 Favored 'General case' 0 C--N 1.303 -1.426 0 O-C-N 121.523 -0.735 . . . . 0.0 110.547 -179.185 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 4.0 tmt_? . . . . . 0 N--CA 1.491 1.6 0 CA-C-O 117.968 -1.015 . . . . 0.0 110.313 -179.887 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' C' C ' 1' ' ' LEU . . . . . 0.439 ' O ' ' N ' ' C' ' 3' ' ' ILE . 1.2 mp . . . . . 0 N--CA 1.491 1.605 0 CA-C-O 121.084 0.469 . . . . 0.0 110.285 . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 2' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER 64.05 -73.47 0.05 Allowed 'General case' 0 N--CA 1.499 2.013 0 O-C-N 121.465 -0.772 . . . . 0.0 110.528 -179.939 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 3' ' ' ILE . . . . . 0.439 ' N ' ' O ' ' C' ' 1' ' ' LEU . 15.1 tt -55.03 -22.97 12.05 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.68 0 O-C-N 121.235 -0.916 . . . . 0.0 110.684 -179.78 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 4' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -86.34 -0.23 55.42 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.121 -0.987 . . . . 0.0 110.841 -179.769 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 5' ' ' THR . . . . . . . . . . . . . 86.2 m -125.01 -34.84 2.73 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.043 -1.036 . . . . 0.0 110.369 -179.913 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 6' ' ' ALA . . . . . . . . . . . . . . . -72.28 -38.06 68.88 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.154 -0.966 . . . . 0.0 110.383 -179.811 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 7' ' ' SER . . . . . . . . . . . . . 16.2 m -62.42 -45.84 91.28 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.216 -0.927 . . . . 0.0 110.479 -179.794 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 8' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -72.63 -25.2 61.21 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.2 -0.938 . . . . 0.0 110.37 -179.742 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 9' ' ' LEU . . . . . . . . . . . . . 1.7 tp -61.88 -51.21 69.13 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.296 -0.878 . . . . 0.0 110.194 179.978 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 10' ' ' VAL . . . . . . . . . . . . . 88.5 t -54.31 -47.97 68.3 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.645 0 O-C-N 121.232 -0.918 . . . . 0.0 110.162 179.881 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.98 -46.14 68.13 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.309 -0.869 . . . . 0.0 110.328 179.996 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 12' ' ' ASN . . . . . . . . . . . . . 48.6 t-20 -73.5 -18.01 61.15 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.221 -0.924 . . . . 0.0 110.424 -179.86 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 13' ' ' ALA . . . . . . . . . . . . . . . -105.03 5.0 32.21 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.118 -0.989 . . . . 0.0 110.8 -179.981 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 14' ' ' ILE . . . . . . . . . . . . . 9.7 tp -120.32 -16.54 6.82 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.605 0 O-C-N 120.937 -1.102 . . . . 0.0 110.73 -179.688 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 15' ' ' GLN . . . . . 0.404 ' O ' ' CB ' ' C' ' 19' ' ' GLU . 3.5 mt-30 -92.87 -39.8 10.98 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.007 -1.058 . . . . 0.0 110.189 -179.894 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 16' ' ' LEU . . . . . 0.459 ' O ' ' N ' ' C' ' 18' ' ' ILE . 4.3 mp -56.69 -169.9 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.283 -0.886 . . . . 0.0 109.909 179.761 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 17' ' ' SER . . . . . 0.43 ' HB3' ' O ' ' C' ' 16' ' ' LEU . 36.4 t 57.67 -82.34 0.02 OUTLIER 'General case' 0 N--CA 1.497 1.906 0 O-C-N 121.595 -0.69 . . . . 0.0 110.633 -179.912 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 18' ' ' ILE . . . . . 0.459 ' N ' ' O ' ' C' ' 16' ' ' LEU . 29.5 pt -60.98 -33.82 57.33 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.628 0 O-C-N 120.904 -1.123 . . . . 0.0 109.914 179.978 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 19' ' ' GLU . . . . . 0.404 ' CB ' ' O ' ' C' ' 15' ' ' GLN . 3.3 tt0 -105.33 19.41 20.63 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.237 -0.915 . . . . 0.0 110.08 179.727 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 20' ' ' GLN . . . . . . . . . . . . . 15.3 tt0 -121.3 -39.27 2.69 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.211 -0.931 . . . . 0.0 109.988 179.982 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 21' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -93.85 -29.98 15.04 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.244 -0.91 . . . . 0.0 110.126 179.92 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 22' ' ' VAL . . . . . . . . . . . . . 65.1 t . . . . . 0 N--CA 1.491 1.618 0 CA-C-O 117.954 -1.022 . . . . 0.0 110.137 179.973 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 26.1 m80 . . . . . 0 N--CA 1.492 1.645 0 CA-C-O 121.159 0.504 . . . . 0.0 110.148 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 4.7 ptp -103.87 43.81 1.06 Allowed 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.229 -0.919 . . . . 0.0 110.21 179.963 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -156.78 103.48 0.24 Allowed Glycine 0 N--CA 1.49 2.278 0 N-CA-C 109.286 -1.525 . . . . 0.0 109.286 179.999 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 2.9 t60 -114.87 170.19 8.52 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.117 -1.225 . . . . 0.0 110.596 -179.668 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . 0.455 ' CD1' ' N ' ' A' ' 5' ' ' ILE . 5.2 mp -134.39 172.05 16.83 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.66 0 O-C-N 121.431 -0.793 . . . . 0.0 109.748 179.994 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 3.1 tt0 -99.06 31.54 2.99 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.028 -1.045 . . . . 0.0 110.226 -179.707 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 3.3 mp -135.65 103.52 10.16 Favored Pre-proline 0 N--CA 1.49 1.57 0 O-C-N 121.357 -0.839 . . . . 0.0 109.75 179.584 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 45.4 Cg_endo -71.29 133.4 22.71 Favored 'Trans proline' 0 C--N 1.312 -1.351 0 O-C-N 123.71 1.374 . . . . 0.0 110.548 -179.798 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 47.9 Cg_endo -74.15 174.17 12.89 Favored 'Trans proline' 0 C--N 1.313 -1.314 0 O-C-N 123.582 1.306 . . . . 0.0 110.511 -179.969 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 94.74 -22.13 39.5 Favored Glycine 0 N--CA 1.491 2.321 0 N-CA-C 109.729 -1.348 . . . . 0.0 109.729 179.955 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -70.37 -29.68 66.41 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.2 -1.176 . . . . 0.0 110.352 -179.898 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 21.9 m -62.14 -60.65 3.28 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.229 -0.919 . . . . 0.0 110.317 -179.885 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . 0.421 ' HG3' ' N ' ' A' ' 14' ' ' LEU . 4.5 pt-20 -52.24 -25.22 8.75 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.278 -0.889 . . . . 0.0 110.391 -179.857 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.421 ' N ' ' HG3' ' A' ' 13' ' ' GLU . 9.0 mt -79.48 -50.1 11.27 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.235 -0.916 . . . . 0.0 110.508 -179.889 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -70.75 -50.0 40.72 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.212 -0.93 . . . . 0.0 110.269 -179.853 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 1.2 tt0 -57.42 -42.49 82.44 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.274 -0.891 . . . . 0.0 109.949 179.929 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -59.04 -41.49 96.49 Favored Glycine 0 N--CA 1.492 2.371 0 N-CA-C 109.592 -1.403 . . . . 0.0 109.592 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . 0.421 ' CE1' ' CE2' ' A' ' 33' ' ' PHE . 60.4 t80 -68.99 -43.74 74.26 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.159 -1.201 . . . . 0.0 109.959 179.868 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 86.0 m -58.69 -28.27 65.6 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.361 -0.837 . . . . 0.0 110.136 179.883 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 25.4 t -75.4 -70.89 0.28 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.653 0 O-C-N 121.265 -0.897 . . . . 0.0 110.031 179.961 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -47.08 -45.59 21.97 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.341 -0.849 . . . . 0.0 111.032 -179.433 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.407 ' CG2' ' O ' ' A' ' 18' ' ' TYR . 81.8 t -54.8 -57.63 6.17 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.586 0 O-C-N 120.912 -1.118 . . . . 0.0 110.13 179.96 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 8.4 mt -68.07 -15.15 63.47 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.369 -0.832 . . . . 0.0 110.686 -179.799 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 5.5 tpt180 -80.37 -58.85 2.94 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.088 -1.008 . . . . 0.0 110.47 -179.832 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 5.9 pt20 -81.65 -22.18 37.71 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.241 -0.912 . . . . 0.0 110.443 -179.738 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER 53.22 75.65 0.61 Allowed Pre-proline 0 N--CA 1.491 1.582 0 O-C-N 121.165 -0.959 . . . . 0.0 110.162 -179.837 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 45.0 Cg_endo -71.95 156.86 55.78 Favored 'Trans proline' 0 C--N 1.312 -1.369 0 O-C-N 123.563 1.296 . . . . 0.0 110.415 -179.899 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 43.2 Cg_endo -69.74 -24.36 29.87 Favored 'Trans proline' 0 C--N 1.311 -1.43 0 O-C-N 123.712 1.375 . . . . 0.0 110.043 179.693 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -143.44 117.71 9.59 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.353 -0.842 . . . . 0.0 109.902 179.585 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.41 ' CD1' ' OH ' ' A' ' 18' ' ' TYR . 17.4 tp -72.67 -39.11 67.34 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.269 -0.894 . . . . 0.0 110.307 -179.851 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 45.0 t -49.74 -61.71 0.57 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.767 0 O-C-N 121.242 -0.911 . . . . 0.0 110.22 179.933 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . 0.408 ' OD2' ' NH2' ' B' ' 42' ' ' ARG . 7.1 t0 -58.07 -34.73 70.45 Favored 'General case' 0 C--N 1.302 -1.459 0 O-C-N 121.454 -0.779 . . . . 0.0 110.206 -179.906 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . 0.421 ' CE2' ' CE1' ' A' ' 18' ' ' TYR . 68.6 t80 -66.64 -44.19 82.64 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.173 -0.954 . . . . 0.0 109.557 179.533 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -56.62 -40.53 75.53 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.429 -0.794 . . . . 0.0 110.257 179.685 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 90.5 t -75.7 -26.67 18.17 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.423 0 O-C-N 121.232 -0.917 . . . . 0.0 110.164 -179.999 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . 0.428 ' OE1' ' CA ' ' A' ' 36' ' ' GLU . 1.5 tp10 -81.73 -41.94 20.54 Favored 'General case' 0 C--N 1.303 -1.452 0 O-C-N 121.336 -0.853 . . . . 0.0 109.759 -179.88 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 88.4 t80 -69.39 -59.35 3.05 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.211 -0.931 . . . . 0.0 110.356 -179.836 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . 0.419 ' CG ' ' HB1' ' B' ' 34' ' ' ALA . 6.1 m-85 -54.1 -52.42 61.07 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.231 -0.918 . . . . 0.0 110.451 -179.789 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 24.3 m -52.82 -27.51 18.55 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.135 -0.978 . . . . 0.0 109.988 179.973 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.97 -26.53 60.53 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.21 -0.931 . . . . 0.0 109.986 179.758 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -77.67 -34.75 52.88 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.232 -0.917 . . . . 0.0 110.064 179.82 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -55.7 -28.99 58.61 Favored 'General case' 0 C--N 1.306 -1.297 0 O-C-N 121.226 -0.921 . . . . 0.0 109.271 179.484 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . 0.436 ' O ' ' N ' ' A' ' 45' ' ' ARG . 0.6 OUTLIER -99.32 -59.56 1.7 Allowed 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.522 -0.736 . . . . 0.0 109.638 179.417 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . 0.402 ' CB ' ' O ' ' A' ' 43' ' ' GLU . . . 66.11 -70.32 0.1 Allowed 'General case' 0 N--CA 1.497 1.88 0 CA-C-O 121.734 0.778 . . . . 0.0 110.275 179.822 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.436 ' N ' ' O ' ' A' ' 43' ' ' GLU . 0.0 OUTLIER 41.14 90.62 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.736 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.364 -179.709 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 2.3 mtt180 . . . . . 0 N--CA 1.491 1.611 0 CA-C-O 117.971 -1.014 . . . . 0.0 110.215 -179.964 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 1' ' ' HIS . . . . . . . . . . . . . 93.4 m-70 . . . . . 0 N--CA 1.49 1.561 0 CA-C-O 121.2 0.524 . . . . 0.0 110.226 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 2' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -91.83 -177.73 4.83 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.302 -0.874 . . . . 0.0 110.168 179.996 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 3' ' ' GLY . . . . . . . . . . . . . . . -148.26 -95.82 0.16 Allowed Glycine 0 N--CA 1.49 2.281 0 N-CA-C 109.575 -1.41 . . . . 0.0 109.575 -179.973 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 4' ' ' HIS . . . . . 0.419 ' CD2' ' C ' ' B' ' 4' ' ' HIS . 3.5 p-80 -114.27 173.94 6.2 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.148 -1.207 . . . . 0.0 110.319 -179.983 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 5' ' ' ILE . . . . . . . . . . . . . 44.1 mm -121.31 129.81 75.25 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.667 0 O-C-N 121.35 -0.844 . . . . 0.0 109.859 179.83 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 6' ' ' GLN . . . . . . . . . . . . . 10.9 mt-30 -146.9 131.88 18.17 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.112 -0.993 . . . . 0.0 110.516 -179.796 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 7' ' ' ILE . . . . . 0.479 ' CB ' ' CD ' ' B' ' 8' ' ' PRO . 1.1 mp -73.44 -60.92 1.54 Allowed Pre-proline 0 N--CA 1.491 1.617 0 O-C-N 121.397 -0.815 . . . . 0.0 110.603 -179.952 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 8' ' ' PRO . . . . . 0.479 ' CD ' ' CB ' ' B' ' 7' ' ' ILE . 44.1 Cg_endo -70.28 111.93 3.04 Favored 'Trans proline' 0 C--N 1.305 -1.756 0 O-C-N 123.573 1.302 . . . . 0.0 110.662 179.747 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 9' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_endo -86.27 123.38 2.26 Favored 'Trans proline' 0 C--N 1.313 -1.322 0 O-C-N 123.597 1.314 . . . . 0.0 111.246 -179.619 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 73.74 2.27 60.49 Favored Glycine 0 N--CA 1.492 2.411 0 C-N-CA 120.262 -0.97 . . . . 0.0 110.887 179.055 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . 0.449 ' CB ' ' HB2' ' B' ' 8' ' ' PRO . 0.1 OUTLIER -90.38 -28.86 18.4 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 120.728 -1.454 . . . . 0.0 110.44 -179.935 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 82.0 m -58.13 -39.87 79.83 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.139 -0.976 . . . . 0.0 110.202 179.891 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -60.64 -40.07 90.6 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.351 -0.843 . . . . 0.0 110.106 179.969 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -60.19 -42.15 94.44 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.254 -0.903 . . . . 0.0 110.252 -179.975 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 65.1 mt -74.64 -44.21 51.6 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.241 -0.912 . . . . 0.0 109.963 179.956 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -54.09 -37.7 64.54 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.308 -0.87 . . . . 0.0 109.956 179.837 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 17' ' ' GLY . . . . . . . . . . . . . . . -67.99 -49.64 46.34 Favored Glycine 0 N--CA 1.49 2.264 0 N-CA-C 109.397 -1.481 . . . . 0.0 109.397 179.862 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 18' ' ' TYR . . . . . 0.4 ' HA ' ' HG3' ' B' ' 21' ' ' GLU . 18.4 t80 -60.02 -34.89 73.98 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.345 -1.091 . . . . 0.0 110.181 179.895 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 95.4 m -63.87 -33.64 76.14 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.18 -0.95 . . . . 0.0 110.525 -179.912 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 59.4 t -75.46 -22.68 16.53 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.751 0 O-C-N 121.147 -0.971 . . . . 0.0 110.29 -179.811 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 21' ' ' GLU . . . . . 0.4 ' HG3' ' HA ' ' B' ' 18' ' ' TYR . 0.6 OUTLIER -88.92 -52.89 4.86 Favored 'General case' 0 N--CA 1.497 1.915 0 O-C-N 121.153 -0.967 . . . . 0.0 108.702 179.685 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 22' ' ' VAL . . . . . . . . . . . . . 57.0 t -50.38 -31.8 8.98 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.5 0 O-C-N 121.665 -0.647 . . . . 0.0 110.07 179.498 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -86.34 -39.26 16.64 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.275 -0.891 . . . . 0.0 110.057 179.758 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 1.8 tpt180 -75.86 -52.23 10.8 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.278 -0.889 . . . . 0.0 110.271 -179.95 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 1.9 mm100 -64.04 -40.58 96.61 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.247 -0.908 . . . . 0.0 110.28 -179.961 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 26' ' ' GLN . . . . . 0.401 ' N ' ' CD ' ' B' ' 27' ' ' PRO . 0.2 OUTLIER 51.83 55.71 15.55 Favored Pre-proline 0 N--CA 1.491 1.624 0 O-C-N 121.278 -0.888 . . . . 0.0 110.026 -179.856 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 27' ' ' PRO . . . . . 0.401 ' CD ' ' N ' ' B' ' 26' ' ' GLN . 43.3 Cg_endo -69.6 158.97 55.28 Favored 'Trans proline' 0 C--N 1.313 -1.336 0 O-C-N 123.789 1.415 . . . . 0.0 110.687 -179.629 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_endo -70.0 -22.35 31.11 Favored 'Trans proline' 0 C--N 1.311 -1.406 0 O-C-N 123.724 1.381 . . . . 0.0 110.182 179.811 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 10.4 m-20 -140.2 115.56 9.95 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.369 -0.832 . . . . 0.0 110.123 179.709 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 7.0 tp -72.2 -32.95 67.25 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.297 -0.877 . . . . 0.0 110.008 179.886 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 33.2 t -57.05 -65.3 0.42 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.715 0 O-C-N 121.316 -0.865 . . . . 0.0 109.879 179.656 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -56.25 -31.74 63.85 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.477 -0.764 . . . . 0.0 109.984 179.868 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 33' ' ' PHE . . . . . . . . . . . . . 47.8 t80 -68.88 -45.48 70.88 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.305 -0.872 . . . . 0.0 109.691 179.462 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 34' ' ' ALA . . . . . 0.419 ' HB1' ' CG ' ' A' ' 38' ' ' PHE . . . -58.49 -37.1 74.84 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.495 -0.753 . . . . 0.0 110.124 179.772 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 35' ' ' VAL . . . . . 0.407 ' O ' ' CB ' ' B' ' 39' ' ' THR . 98.3 t -73.2 -46.7 49.7 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.399 0 O-C-N 121.161 -0.962 . . . . 0.0 110.311 179.975 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -60.14 -44.37 94.99 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.165 -0.959 . . . . 0.0 110.416 -179.85 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 37' ' ' TYR . . . . . . . . . . . . . 28.1 t80 -64.45 -67.94 0.39 Allowed 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.209 -0.932 . . . . 0.0 110.606 -179.72 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 13.1 m-85 -51.12 -48.78 61.69 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.279 -0.888 . . . . 0.0 110.776 -179.552 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 39' ' ' THR . . . . . 0.407 ' CB ' ' O ' ' B' ' 35' ' ' VAL . 35.7 m -52.35 -32.86 40.34 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 120.959 -1.088 . . . . 0.0 110.002 -179.816 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -68.59 -41.65 79.33 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.266 -0.896 . . . . 0.0 109.848 179.651 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -55.39 -28.31 53.2 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.261 -0.9 . . . . 0.0 109.818 179.658 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 42' ' ' ARG . . . . . 0.408 ' NH2' ' OD2' ' A' ' 32' ' ' ASP . 7.2 mmm180 -78.63 -19.85 51.71 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.276 -0.89 . . . . 0.0 110.297 179.843 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 43' ' ' GLU . . . . . . . . . . . . . 7.3 mm-40 -115.31 12.57 16.44 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.136 -0.978 . . . . 0.0 110.649 -179.95 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -82.12 -71.28 0.49 Allowed 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.092 -1.005 . . . . 0.0 110.372 179.928 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 45' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -49.15 134.7 17.46 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.52 -0.738 . . . . 0.0 110.892 -179.192 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 57.3 ttt180 . . . . . 0 N--CA 1.493 1.68 0 CA-C-O 118.053 -0.975 . . . . 0.0 110.429 179.751 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' C' C ' 1' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.614 0 CA-C-O 121.269 0.557 . . . . 0.0 110.226 . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 2' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -100.47 -21.81 15.23 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.171 -0.955 . . . . 0.0 110.276 -179.849 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' C' C ' 3' ' ' ILE . . . . . . . . . . . . . 97.0 mt -63.67 -38.53 82.53 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.629 0 O-C-N 121.19 -0.944 . . . . 0.0 110.3 -179.946 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 4' ' ' GLU . . . . . . . . . . . . . 6.5 mt-10 -66.38 -36.9 84.03 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.229 -0.919 . . . . 0.0 110.397 -179.873 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 5' ' ' THR . . . . . . . . . . . . . 99.0 m -76.46 -56.05 4.98 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.207 -0.933 . . . . 0.0 110.24 -179.956 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 6' ' ' ALA . . . . . . . . . . . . . . . -54.42 -35.25 62.71 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.284 -0.885 . . . . 0.0 110.187 -179.983 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 7' ' ' SER . . . . . . . . . . . . . 84.0 p -69.78 -30.25 67.76 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.28 -0.887 . . . . 0.0 110.18 -179.992 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 8' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -96.68 -21.08 17.82 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.29 -0.882 . . . . 0.0 110.215 179.97 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' C' C ' 9' ' ' LEU . . . . . . . . . . . . . 9.3 tt -69.56 -47.47 63.53 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.32 -0.862 . . . . 0.0 110.179 -179.938 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 10' ' ' VAL . . . . . . . . . . . . . 33.6 m -57.63 -40.61 76.18 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.66 0 O-C-N 121.184 -0.948 . . . . 0.0 110.038 179.996 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 11' ' ' LYS . . . . . . . . . . . . . 18.4 mttt -59.46 -38.61 81.23 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.299 -0.875 . . . . 0.0 110.038 179.817 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 12' ' ' ASN . . . . . . . . . . . . . 8.0 m-20 -69.5 -23.13 63.58 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.31 -0.869 . . . . 0.0 110.053 179.861 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 13' ' ' ALA . . . . . . . . . . . . . . . -82.01 -22.95 36.23 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.257 -0.902 . . . . 0.0 110.374 -179.944 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 14' ' ' ILE . . . . . . . . . . . . . 66.8 mt -88.51 -53.49 9.53 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.593 0 O-C-N 121.217 -0.927 . . . . 0.0 110.476 -179.831 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 15' ' ' GLN . . . . . . . . . . . . . 2.9 pp0? -57.11 -24.93 57.57 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.09 -1.007 . . . . 0.0 110.205 -179.933 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 16' ' ' LEU . . . . . . . . . . . . . 22.1 tp -73.39 -15.62 61.36 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.346 -0.846 . . . . 0.0 110.473 -179.949 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 17' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -73.9 -57.98 3.61 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.077 -1.014 . . . . 0.0 110.273 -179.934 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' C' C ' 18' ' ' ILE . . . . . . . . . . . . . 44.3 pt -66.85 -21.19 28.08 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.596 0 O-C-N 121.253 -0.904 . . . . 0.0 110.283 -179.987 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 19' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -82.72 -20.99 34.96 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.217 -0.927 . . . . 0.0 110.16 179.948 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 20' ' ' GLN . . . . . . . . . . . . . 16.1 tt0 -86.04 -32.11 21.62 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.276 -0.89 . . . . 0.0 110.321 180.0 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 21' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -90.51 -36.13 14.68 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.204 -0.935 . . . . 0.0 110.309 179.994 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' C' C ' 22' ' ' VAL . . . . . . . . . . . . . 98.2 t . . . . . 0 N--CA 1.49 1.569 0 CA-C-O 118.026 -0.988 . . . . 0.0 110.257 -179.82 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 10.1 m-70 . . . . . 0 N--CA 1.492 1.65 0 CA-C-O 121.135 0.493 . . . . 0.0 110.208 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -125.83 -41.69 1.95 Allowed 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.343 -0.848 . . . . 0.0 110.167 179.936 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -92.76 108.48 3.66 Favored Glycine 0 N--CA 1.49 2.296 0 N-CA-C 109.532 -1.427 . . . . 0.0 109.532 179.98 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -112.28 27.33 9.74 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.271 -1.134 . . . . 0.0 110.201 -180.0 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -117.39 45.67 0.43 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.561 0 O-C-N 121.147 -0.971 . . . . 0.0 110.335 -179.865 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 1.4 mm100 -148.41 135.01 19.76 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.178 -0.951 . . . . 0.0 110.195 179.921 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . 0.416 ' CD1' ' O ' ' A' ' 7' ' ' ILE . 2.4 pp -75.71 138.91 70.05 Favored Pre-proline 0 N--CA 1.491 1.612 0 O-C-N 121.253 -0.905 . . . . 0.0 110.215 -179.998 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 49.2 Cg_endo -74.06 140.06 27.77 Favored 'Trans proline' 0 C--N 1.313 -1.31 0 O-C-N 123.552 1.29 . . . . 0.0 110.539 -179.968 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 48.9 Cg_endo -75.48 165.77 29.95 Favored 'Trans proline' 0 C--N 1.312 -1.353 0 O-C-N 123.578 1.304 . . . . 0.0 110.439 179.863 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 104.13 -32.99 6.93 Favored Glycine 0 N--CA 1.491 2.338 0 N-CA-C 109.748 -1.341 . . . . 0.0 109.748 179.787 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 6.8 tp -53.58 -55.58 24.48 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.131 -1.217 . . . . 0.0 110.211 -179.932 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 57.0 m -53.53 -56.33 17.92 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.259 -0.901 . . . . 0.0 110.411 -179.851 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -53.75 -41.09 66.75 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.302 -0.874 . . . . 0.0 110.498 -179.698 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -75.19 -27.67 59.73 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.179 -0.951 . . . . 0.0 110.419 -179.761 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 5.3 mp -86.44 -55.38 3.92 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.1 -1.0 . . . . 0.0 110.307 -179.967 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 1.6 mt-30 -51.48 -37.73 50.43 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.14 -0.975 . . . . 0.0 109.877 179.694 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . 0.421 ' O ' ' CG ' ' A' ' 21' ' ' GLU . . . -69.18 -55.5 10.35 Favored Glycine 0 N--CA 1.489 2.232 0 N-CA-C 108.988 -1.645 . . . . 0.0 108.988 179.45 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 21.5 t80 -50.48 -32.12 17.18 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.349 -1.089 . . . . 0.0 110.088 179.673 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 94.4 m -76.25 -32.45 58.87 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.465 -0.772 . . . . 0.0 110.053 179.936 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 95.1 t -78.5 -18.78 13.4 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.62 0 O-C-N 121.296 -0.877 . . . . 0.0 110.673 -179.858 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.421 ' CG ' ' O ' ' A' ' 17' ' ' GLY . 1.3 mt-10 -84.87 -57.99 2.88 Favored 'General case' 0 N--CA 1.498 1.933 0 O-C-N 121.008 -1.057 . . . . 0.0 109.036 179.91 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 39.8 t -51.65 -34.25 15.92 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.477 0 O-C-N 121.643 -0.661 . . . . 0.0 109.94 179.821 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 2.4 mp -76.53 -37.94 55.9 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.389 -0.82 . . . . 0.0 109.774 179.51 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -66.36 -24.67 66.54 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.37 -0.831 . . . . 0.0 110.002 179.874 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . 0.421 ' O ' ' HD3' ' A' ' 27' ' ' PRO . 0.8 OUTLIER -143.81 59.45 1.37 Allowed 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.265 -0.897 . . . . 0.0 110.212 -179.991 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . 0.407 ' HG3' ' O ' ' A' ' 26' ' ' GLN . 6.2 pt20 -34.72 95.56 0.09 OUTLIER Pre-proline 0 N--CA 1.505 2.28 0 CA-C-O 120.959 0.409 . . . . 0.0 111.741 -179.75 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' PRO . . . . . 0.421 ' HD3' ' O ' ' A' ' 25' ' ' GLN . 46.7 Cg_endo -73.72 161.01 42.77 Favored 'Trans proline' 0 C--N 1.312 -1.348 0 O-C-N 123.876 1.461 . . . . 0.0 110.515 -179.614 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 43.5 Cg_endo -70.18 -29.54 21.73 Favored 'Trans proline' 0 C--N 1.31 -1.451 0 O-C-N 123.689 1.363 . . . . 0.0 110.224 179.79 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -142.83 118.46 10.42 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.207 -0.933 . . . . 0.0 110.086 179.712 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 4.9 tp -76.79 -24.58 52.86 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.264 -0.897 . . . . 0.0 109.937 179.934 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 43.7 t -52.83 -62.96 0.53 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.61 0 O-C-N 121.313 -0.867 . . . . 0.0 110.05 179.791 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -60.82 -43.03 98.78 Favored 'General case' 0 C--N 1.302 -1.457 0 O-C-N 121.504 -0.748 . . . . 0.0 110.02 179.826 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 90.7 t80 -59.79 -43.71 94.27 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.128 -0.983 . . . . 0.0 109.678 179.502 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' ALA . . . . . 0.43 ' HB1' ' CD2' ' B' ' 38' ' ' PHE . . . -54.68 -43.99 72.96 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.311 -0.868 . . . . 0.0 109.735 179.626 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . 0.402 ' CG2' ' HB3' ' B' ' 38' ' ' PHE . 54.5 t -71.77 -49.28 46.58 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.335 0 O-C-N 121.309 -0.87 . . . . 0.0 109.94 179.741 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -62.04 -27.65 69.03 Favored 'General case' 0 N--CA 1.487 1.38 0 O-C-N 121.276 -0.89 . . . . 0.0 109.812 179.829 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 73.7 t80 -72.67 -72.04 0.26 Allowed 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.215 -0.928 . . . . 0.0 110.414 -179.734 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . 0.467 ' CD2' ' HB3' ' B' ' 34' ' ' ALA . 27.3 m-85 -54.63 -47.79 73.04 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.209 -0.932 . . . . 0.0 110.446 -179.796 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 99.1 m -52.39 -34.19 46.94 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.102 -0.999 . . . . 0.0 109.94 179.84 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 1.9 tpt85 -75.92 -23.05 55.46 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.312 -0.867 . . . . 0.0 109.902 179.645 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -65.54 -40.7 93.21 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.253 -0.904 . . . . 0.0 110.189 179.967 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.78 -22.29 34.81 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.321 -0.862 . . . . 0.0 110.431 -179.847 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 -83.25 -31.87 26.74 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.252 -0.905 . . . . 0.0 110.457 -179.725 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -83.0 -77.66 0.24 Allowed 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.213 -0.929 . . . . 0.0 110.764 -179.782 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -61.57 102.17 0.23 Allowed 'General case' 0 C--N 1.304 -1.372 0 O-C-N 121.429 -0.794 . . . . 0.0 110.289 -179.056 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 2.5 mtp85 . . . . . 0 N--CA 1.492 1.664 0 CA-C-O 118.098 -0.953 . . . . 0.0 110.247 -179.921 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 1' ' ' HIS . . . . . . . . . . . . . 39.9 m80 . . . . . 0 N--CA 1.491 1.599 0 CA-C-O 121.313 0.578 . . . . 0.0 110.101 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 2' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -54.94 -56.27 21.53 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.253 -0.904 . . . . 0.0 110.255 -179.967 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 3' ' ' GLY . . . . . . . . . . . . . . . 176.36 161.48 25.46 Favored Glycine 0 N--CA 1.49 2.265 0 N-CA-C 109.705 -1.358 . . . . 0.0 109.705 -179.969 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 4' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -122.68 96.04 4.87 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.314 -1.109 . . . . 0.0 110.189 179.905 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 5' ' ' ILE . . . . . 0.406 ' CG2' ' O ' ' B' ' 5' ' ' ILE . 1.9 tt -128.44 61.43 0.3 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.592 0 O-C-N 121.245 -0.91 . . . . 0.0 110.359 -179.888 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 6' ' ' GLN . . . . . . . . . . . . . 31.4 mt-30 -124.51 83.86 2.21 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.284 -0.885 . . . . 0.0 110.246 -179.996 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 7' ' ' ILE . . . . . . . . . . . . . 50.4 mm -107.57 97.74 21.13 Favored Pre-proline 0 N--CA 1.492 1.67 0 O-C-N 121.247 -0.908 . . . . 0.0 110.139 179.868 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 46.5 Cg_endo -72.57 116.8 4.85 Favored 'Trans proline' 0 C--N 1.312 -1.365 0 O-C-N 123.715 1.376 . . . . 0.0 110.626 -179.96 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 9' ' ' PRO . . . . . . . . . . . . . 45.9 Cg_endo -72.93 -176.61 2.45 Favored 'Trans proline' 0 C--N 1.313 -1.339 0 O-C-N 123.592 1.311 . . . . 0.0 110.386 179.986 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 118.51 -26.97 7.46 Favored Glycine 0 N--CA 1.491 2.337 0 N-CA-C 109.573 -1.411 . . . . 0.0 109.573 179.969 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 4.5 tt -73.64 -24.07 59.96 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.279 -1.13 . . . . 0.0 110.314 -179.921 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 23.4 m -57.94 -58.75 7.03 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.227 -0.921 . . . . 0.0 110.119 -179.989 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 4.5 mt-10 -53.9 -44.7 70.74 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.415 -0.803 . . . . 0.0 110.195 -179.975 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 6.5 mt -55.71 -57.94 9.92 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.209 -0.932 . . . . 0.0 110.124 179.967 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -60.86 -37.94 83.86 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.315 -0.866 . . . . 0.0 110.122 179.92 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 2.3 tt0 -51.94 -52.01 53.09 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.241 -0.912 . . . . 0.0 110.314 179.899 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 17' ' ' GLY . . . . . . . . . . . . . . . -56.14 -51.53 55.21 Favored Glycine 0 N--CA 1.49 2.249 0 N-CA-C 109.142 -1.583 . . . . 0.0 109.142 179.665 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 18' ' ' TYR . . . . . 0.421 ' HA ' ' HG3' ' B' ' 21' ' ' GLU . 14.8 t80 -53.98 -40.16 66.67 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.332 -1.099 . . . . 0.0 110.083 179.684 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 54.1 m -62.75 -41.4 99.19 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.435 -0.79 . . . . 0.0 110.386 -179.844 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 48.9 t -65.42 -18.81 24.54 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.66 0 O-C-N 121.148 -0.97 . . . . 0.0 110.378 -179.938 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 21' ' ' GLU . . . . . 0.468 ' OE1' ' CE1' ' B' ' 37' ' ' TYR . 1.4 mt-10 -93.32 -49.84 5.75 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.126 -0.984 . . . . 0.0 109.051 179.793 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 22' ' ' VAL . . . . . . . . . . . . . 85.7 t -58.92 -28.4 38.15 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.461 0 O-C-N 121.719 -0.613 . . . . 0.0 110.02 179.962 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 8.5 tp -85.18 -43.47 13.79 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.26 -0.9 . . . . 0.0 109.891 179.583 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -78.34 -64.16 1.23 Allowed 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.36 -0.838 . . . . 0.0 110.1 179.874 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -55.06 -37.88 67.3 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.323 -0.86 . . . . 0.0 110.127 179.824 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 2.0 tt0 52.16 60.54 13.31 Favored Pre-proline 0 N--CA 1.491 1.61 0 O-C-N 121.246 -0.908 . . . . 0.0 110.306 -179.947 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 27' ' ' PRO . . . . . . . . . . . . . 45.2 Cg_endo -71.35 151.5 60.01 Favored 'Trans proline' 0 C--N 1.313 -1.341 0 O-C-N 123.586 1.308 . . . . 0.0 110.505 -179.973 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 45.2 Cg_endo -70.62 -33.25 13.62 Favored 'Trans proline' 0 C--N 1.311 -1.421 0 O-C-N 123.637 1.335 . . . . 0.0 110.392 179.873 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -118.35 117.13 28.24 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.304 -0.873 . . . . 0.0 110.207 -179.998 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -82.3 -46.49 13.58 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.296 -0.877 . . . . 0.0 110.013 179.9 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 40.7 t -53.62 -51.83 39.39 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.695 0 O-C-N 121.384 -0.823 . . . . 0.0 109.608 179.569 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 7.9 t0 -67.95 -35.78 78.98 Favored 'General case' 0 C--N 1.303 -1.45 0 O-C-N 121.648 -0.657 . . . . 0.0 109.782 179.812 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 33' ' ' PHE . . . . . . . . . . . . . 44.0 t80 -67.03 -44.69 79.58 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.23 -0.919 . . . . 0.0 109.396 179.359 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 34' ' ' ALA . . . . . 0.467 ' HB3' ' CD2' ' A' ' 38' ' ' PHE . . . -57.49 -36.89 72.07 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.363 -0.835 . . . . 0.0 109.777 179.604 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 35' ' ' VAL . . . . . . . . . . . . . 99.4 t -69.5 -43.91 80.28 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.301 0 O-C-N 121.298 -0.876 . . . . 0.0 110.018 179.79 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -67.28 -30.47 70.35 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.244 -0.91 . . . . 0.0 110.046 179.755 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 37' ' ' TYR . . . . . 0.468 ' CE1' ' OE1' ' B' ' 21' ' ' GLU . 82.9 t80 -73.67 -63.39 1.21 Allowed 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.349 -0.844 . . . . 0.0 110.185 179.977 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 38' ' ' PHE . . . . . 0.43 ' CD2' ' HB1' ' A' ' 34' ' ' ALA . 9.3 m-85 -57.04 -48.7 77.9 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.259 -0.901 . . . . 0.0 110.413 -179.976 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 39' ' ' THR . . . . . . . . . . . . . 57.4 m -53.93 -36.63 62.98 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.139 -0.976 . . . . 0.0 110.013 179.848 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.36 -25.85 61.68 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.292 -0.88 . . . . 0.0 109.923 179.706 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 4.7 mt -72.79 -28.87 62.85 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.254 -0.904 . . . . 0.0 110.025 179.879 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -76.5 -23.46 53.73 Favored 'General case' 0 C--N 1.306 -1.284 0 O-C-N 121.302 -0.874 . . . . 0.0 109.717 179.882 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 43' ' ' GLU . . . . . . . . . . . . . 26.3 mt-10 -82.71 -30.88 28.81 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.297 -0.877 . . . . 0.0 110.188 179.907 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -82.96 -74.78 0.34 Allowed 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.343 -0.848 . . . . 0.0 110.373 179.971 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 45' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -50.77 164.05 0.16 Allowed 'General case' 0 N--CA 1.488 1.444 0 O-C-N 121.588 -0.695 . . . . 0.0 110.466 -179.262 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 16.1 ttt180 . . . . . 0 N--CA 1.492 1.645 0 CA-C-O 118.048 -0.977 . . . . 0.0 110.173 179.987 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' C' C ' 1' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.492 1.659 0 CA-C-O 121.147 0.498 . . . . 0.0 110.23 . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 2' ' ' LEU . . . . . . . . . . . . . 5.5 mp 53.99 21.02 2.67 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.389 -0.819 . . . . 0.0 110.585 179.964 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 3' ' ' ILE . . . . . . . . . . . . . 19.3 tt -88.27 -18.87 7.92 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.636 0 O-C-N 121.165 -0.96 . . . . 0.0 110.295 179.894 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 4' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -98.35 -9.22 25.68 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.179 -0.951 . . . . 0.0 110.785 -179.892 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 5' ' ' THR . . . . . . . . . . . . . 65.9 m -113.29 -54.12 2.64 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 120.983 -1.073 . . . . 0.0 110.511 -179.807 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 6' ' ' ALA . . . . . . . . . . . . . . . -61.76 -56.95 14.14 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.124 -0.985 . . . . 0.0 110.316 -179.785 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 7' ' ' SER . . . . . . . . . . . . . 47.4 m -65.4 -25.2 67.44 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.224 -0.923 . . . . 0.0 110.339 -179.857 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 8' ' ' SER . . . . . . . . . . . . . 1.1 t -82.87 -39.49 21.54 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.206 -0.934 . . . . 0.0 110.403 -179.916 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 9' ' ' LEU . . . . . . . . . . . . . 29.7 mt -61.06 -55.39 33.17 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.207 -0.933 . . . . 0.0 110.399 -179.891 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 10' ' ' VAL . . . . . . . . . . . . . 12.3 p -58.17 -38.97 71.19 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.601 0 O-C-N 121.163 -0.961 . . . . 0.0 110.213 -179.941 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 11' ' ' LYS . . . . . . . . . . . . . 5.2 tttm -54.76 -57.79 10.13 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.239 -0.913 . . . . 0.0 110.211 -179.927 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 12' ' ' ASN . . . . . . . . . . . . . 2.8 m-20 -67.29 -23.67 65.68 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.161 -0.962 . . . . 0.0 110.064 179.917 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 13' ' ' ALA . . . . . . . . . . . . . . . -68.18 -43.05 79.01 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.283 -0.886 . . . . 0.0 110.109 179.965 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 14' ' ' ILE . . . . . . . . . . . . . 45.5 mm -69.99 -26.79 30.7 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.601 0 O-C-N 121.215 -0.928 . . . . 0.0 109.911 179.795 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 15' ' ' GLN . . . . . . . . . . . . . 32.8 mt-30 -57.69 -24.19 55.54 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.254 -0.904 . . . . 0.0 109.976 179.729 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 16' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -56.55 -21.26 25.2 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.187 -0.946 . . . . 0.0 109.553 179.293 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 17' ' ' SER . . . . . 0.454 ' O ' ' CG1' ' C' ' 18' ' ' ILE . 2.8 m -82.2 54.09 2.44 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.291 -0.88 . . . . 0.0 109.907 179.477 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 18' ' ' ILE . . . . . 0.456 ' O ' ' N ' ' C' ' 20' ' ' GLN . 18.4 pt 41.36 27.28 0.1 OUTLIER 'Isoleucine or valine' 0 N--CA 1.498 1.941 0 O-C-N 121.911 -0.493 . . . . 0.0 111.731 -179.801 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 19' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 61.81 -71.08 0.04 OUTLIER 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.408 -0.808 . . . . 0.0 111.571 178.942 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 20' ' ' GLN . . . . . 0.456 ' N ' ' O ' ' C' ' 18' ' ' ILE . 3.4 mt-30 -49.56 -27.35 4.35 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.315 -0.866 . . . . 0.0 110.921 -179.115 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 21' ' ' LEU . . . . . 0.435 ' HB2' ' CG1' ' C' ' 18' ' ' ILE . 0.3 OUTLIER -89.65 53.84 2.7 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.048 -1.032 . . . . 0.0 110.138 179.997 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' C' C ' 22' ' ' VAL . . . . . 0.408 ' O ' ' CG2' ' C' ' 22' ' ' VAL . 7.6 p . . . . . 0 N--CA 1.492 1.636 0 CA-C-O 117.96 -1.019 . . . . 0.0 110.179 179.942 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.238 0 N-CA-C 109.498 -1.441 . . . . 0.0 109.498 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.676 HD22 HD11 ' A' ' 15' ' ' LEU . 0.8 OUTLIER -76.0 -21.98 56.32 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.232 -1.158 . . . . 0.0 110.099 179.937 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 92.6 m -74.07 -37.35 64.26 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.236 -0.915 . . . . 0.0 110.213 -179.97 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -82.04 -47.46 12.6 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.367 -0.833 . . . . 0.0 110.208 179.986 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -53.45 -41.72 66.41 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.177 -0.952 . . . . 0.0 110.115 179.86 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.891 HD22 HD11 ' B' ' 15' ' ' LEU . 71.0 mt -71.48 -37.53 71.29 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.191 -0.943 . . . . 0.0 109.989 179.789 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 16' ' ' GLN . . . . . 0.723 ' O ' HG23 ' A' ' 20' ' ' VAL . 0.0 OUTLIER -64.38 -34.13 77.46 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.275 -0.891 . . . . 0.0 110.137 179.893 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -67.43 -45.23 80.38 Favored Glycine 0 N--CA 1.491 2.315 0 N-CA-C 109.218 -1.553 . . . . 0.0 109.218 179.721 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' TYR . . . . . 0.629 ' OH ' ' HB2' ' A' ' 34' ' ' ALA . 20.4 t80 -63.6 -47.22 82.33 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.346 -1.091 . . . . 0.0 109.697 179.581 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 59.4 m -57.42 -27.1 62.1 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.329 -0.857 . . . . 0.0 110.139 179.715 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.723 HG23 ' O ' ' A' ' 16' ' ' GLN . 46.1 t -74.74 -73.91 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.59 0 O-C-N 121.396 -0.815 . . . . 0.0 110.316 -179.959 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.469 ' OE1' ' CE1' ' A' ' 37' ' ' TYR . 10.3 pt-20 -44.7 -44.32 9.05 Favored 'General case' 0 N--CA 1.497 1.898 0 O-C-N 121.482 -0.761 . . . . 0.0 111.319 -179.443 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.588 HG23 ' O ' ' A' ' 18' ' ' TYR . 89.6 t -55.21 -50.84 61.08 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.638 0 O-C-N 120.96 -1.087 . . . . 0.0 110.188 179.969 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.53 HD13 HD11 ' C' ' 2' ' ' LEU . 88.8 mt -77.34 -3.64 41.05 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.319 -0.863 . . . . 0.0 110.892 -179.734 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -106.72 -52.78 2.72 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 120.923 -1.111 . . . . 0.0 110.388 -179.919 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 3.3 tp-100 -78.89 -24.98 43.83 Favored 'General case' 0 C--N 1.306 -1.322 0 O-C-N 121.278 -0.889 . . . . 0.0 109.831 -179.999 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 2.7 mt-30 52.77 70.85 1.64 Allowed Pre-proline 0 N--CA 1.491 1.59 0 O-C-N 121.192 -0.942 . . . . 0.0 110.091 179.996 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 45.4 Cg_endo -70.3 159.7 52.08 Favored 'Trans proline' 0 C--N 1.31 -1.485 0 O-C-N 123.67 1.353 . . . . 0.0 110.5 -179.95 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 44.4 Cg_endo -71.22 -30.4 15.95 Favored 'Trans proline' 0 C--N 1.311 -1.402 0 O-C-N 123.761 1.4 . . . . 0.0 110.278 179.96 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -140.26 116.01 10.23 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.267 -0.896 . . . . 0.0 110.17 179.864 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 16.7 tp -67.45 -38.73 84.92 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.221 -0.924 . . . . 0.0 109.955 179.972 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 42.6 t -55.06 -66.55 0.26 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.632 0 O-C-N 121.379 -0.825 . . . . 0.0 109.837 179.796 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -56.78 -34.63 67.81 Favored 'General case' 0 N--CA 1.487 1.406 0 O-C-N 121.48 -0.763 . . . . 0.0 109.819 179.735 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 46.1 t80 -64.18 -47.71 78.76 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.269 -0.895 . . . . 0.0 109.609 179.337 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' ALA . . . . . 0.629 ' HB2' ' OH ' ' A' ' 18' ' ' TYR . . . -52.53 -32.07 38.7 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.369 -0.832 . . . . 0.0 110.132 179.762 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.471 HG13 ' OG1' ' B' ' 39' ' ' THR . 58.5 t -74.86 -39.04 45.0 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.388 0 O-C-N 121.379 -0.826 . . . . 0.0 110.356 -179.963 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 39.5 mm-40 -72.23 -32.0 66.33 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.148 -0.97 . . . . 0.0 110.479 -179.763 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' TYR . . . . . 0.469 ' CE1' ' OE1' ' A' ' 21' ' ' GLU . 34.1 t80 -73.37 -68.88 0.46 Allowed 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.256 -0.902 . . . . 0.0 110.594 -179.686 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 38' ' ' PHE . . . . . 0.471 ' CD2' ' O ' ' A' ' 34' ' ' ALA . 24.1 m-85 -50.28 -49.51 53.16 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.207 -0.933 . . . . 0.0 110.665 -179.565 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 39' ' ' THR . . . . . 0.464 ' OG1' HG13 ' B' ' 35' ' ' VAL . 45.5 m -52.35 -40.51 62.05 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.151 -0.968 . . . . 0.0 109.941 179.912 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 12.0 mtt85 -74.93 -27.0 60.03 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.253 -0.904 . . . . 0.0 109.717 179.562 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -58.23 -32.38 68.27 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.317 -0.865 . . . . 0.0 109.745 179.655 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.417 ' NH2' ' OD1' ' B' ' 32' ' ' ASP . 5.0 ttp180 -53.09 -43.42 66.77 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.385 -0.822 . . . . 0.0 110.158 179.945 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 5.5 mt-10 -75.32 -30.88 60.46 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.327 -0.858 . . . . 0.0 110.468 -179.748 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.635 0 O-C-N 121.185 -0.947 . . . . 0.0 110.663 -179.787 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 47.8 Cg_endo . . . . . 0 N--CA 1.485 1.003 0 N-CA-C 110.671 -0.55 . . . . 0.0 110.671 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' B' B ' 9' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_endo -76.82 165.21 28.95 Favored 'Trans proline' 0 C--N 1.313 -1.34 0 O-C-N 123.594 1.312 . . . . 0.0 110.378 179.848 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 108.65 -26.09 17.21 Favored Glycine 0 N--CA 1.491 2.33 0 N-CA-C 109.93 -1.268 . . . . 0.0 109.93 179.64 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 11' ' ' LEU . . . . . 0.626 HD23 HD23 ' B' ' 15' ' ' LEU . 0.4 OUTLIER -80.2 -26.8 39.04 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.16 -1.2 . . . . 0.0 110.267 -179.89 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 88.8 m -68.53 -36.99 79.61 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.194 -0.941 . . . . 0.0 110.344 179.993 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -74.27 -40.48 62.3 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.28 -0.888 . . . . 0.0 110.111 179.923 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 14' ' ' LEU . . . . . 0.44 HD23 ' HA ' ' B' ' 14' ' ' LEU . 3.2 mt -62.68 -37.6 87.1 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.183 -0.948 . . . . 0.0 110.055 179.786 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 15' ' ' LEU . . . . . 0.891 HD11 HD22 ' A' ' 15' ' ' LEU . 1.3 mm? -72.84 -49.07 32.45 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.324 -0.86 . . . . 0.0 110.054 179.859 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 16' ' ' GLN . . . . . 0.793 ' O ' HG23 ' B' ' 20' ' ' VAL . 2.5 mt-30 -55.52 -37.54 68.04 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.282 -0.886 . . . . 0.0 110.013 179.789 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 17' ' ' GLY . . . . . . . . . . . . . . . -62.59 -40.29 98.95 Favored Glycine 0 N--CA 1.489 2.224 0 N-CA-C 109.0 -1.64 . . . . 0.0 109.0 179.769 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 18' ' ' TYR . . . . . 0.621 ' OH ' ' HB2' ' B' ' 34' ' ' ALA . 34.1 t80 -71.17 -53.71 13.53 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.304 -1.116 . . . . 0.0 109.722 179.572 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 90.6 m -51.1 -27.07 7.48 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.239 -0.913 . . . . 0.0 110.185 179.721 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 20' ' ' VAL . . . . . 0.793 HG23 ' O ' ' B' ' 16' ' ' GLN . 55.7 t -73.88 -75.44 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.651 0 O-C-N 121.316 -0.865 . . . . 0.0 109.829 179.669 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 21' ' ' GLU . . . . . 0.443 ' HG3' ' N ' ' B' ' 22' ' ' VAL . 11.0 pt-20 -47.09 -41.5 17.28 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.459 -0.775 . . . . 0.0 110.793 -179.849 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 22' ' ' VAL . . . . . 0.72 ' CG1' HD11 ' B' ' 30' ' ' LEU . 78.7 t -55.94 -44.9 79.59 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.575 0 O-C-N 121.176 -0.953 . . . . 0.0 110.116 179.912 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -73.22 -26.18 61.03 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.196 -0.94 . . . . 0.0 110.4 -179.86 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.55 -55.47 4.11 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.113 -0.992 . . . . 0.0 110.425 -179.868 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 25' ' ' GLN . . . . . 0.437 ' O ' ' CG ' ' B' ' 26' ' ' GLN . 5.6 mp0 -65.67 -20.35 66.26 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.147 -0.97 . . . . 0.0 110.657 -179.708 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 26' ' ' GLN . . . . . 0.437 ' CG ' ' O ' ' B' ' 25' ' ' GLN . 12.7 pt20 36.45 55.22 2.91 Favored Pre-proline 0 N--CA 1.507 2.38 0 O-C-N 122.058 -0.401 . . . . 0.0 111.534 -179.791 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 27' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_endo -68.09 152.02 76.82 Favored 'Trans proline' 0 C--N 1.31 -1.488 0 O-C-N 123.678 1.357 . . . . 0.0 110.526 -179.798 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 44.3 Cg_endo -71.06 -14.41 31.96 Favored 'Trans proline' 0 C--N 1.312 -1.392 0 O-C-N 123.755 1.397 . . . . 0.0 110.503 -179.958 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 12.5 m-20 -137.46 111.2 8.16 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.066 -1.021 . . . . 0.0 110.282 179.915 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 30' ' ' LEU . . . . . 0.72 HD11 ' CG1' ' B' ' 22' ' ' VAL . 0.2 OUTLIER -76.73 -34.19 58.11 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.345 -0.847 . . . . 0.0 109.492 179.641 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 21.6 t -61.93 -50.8 78.65 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.603 0 CA-C-O 121.658 0.742 . . . . 0.0 109.468 179.484 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 32' ' ' ASP . . . . . 0.417 ' OD1' ' NH2' ' A' ' 42' ' ' ARG . 10.5 t70 -67.61 -30.25 69.78 Favored 'General case' 0 C--N 1.303 -1.456 0 O-C-N 121.643 -0.661 . . . . 0.0 109.97 179.775 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 33' ' ' PHE . . . . . . . . . . . . . 83.5 t80 -72.68 -39.48 67.03 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.273 -0.892 . . . . 0.0 109.501 179.284 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 34' ' ' ALA . . . . . 0.621 ' HB2' ' OH ' ' B' ' 18' ' ' TYR . . . -65.83 -38.35 88.67 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.376 -0.827 . . . . 0.0 109.938 179.633 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 35' ' ' VAL . . . . . 0.464 HG13 ' OG1' ' A' ' 39' ' ' THR . 96.8 t -73.8 -32.58 35.01 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.325 0 O-C-N 121.309 -0.87 . . . . 0.0 110.195 179.886 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -80.13 -30.18 38.98 Favored 'General case' 0 N--CA 1.487 1.42 0 O-C-N 121.262 -0.899 . . . . 0.0 109.592 179.892 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 37' ' ' TYR . . . . . . . . . . . . . 16.5 t80 -76.96 -64.14 1.2 Allowed 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.18 -0.95 . . . . 0.0 110.205 -179.957 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 12.7 m-85 -51.95 -50.27 61.54 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.255 -0.903 . . . . 0.0 110.444 -179.845 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 39' ' ' THR . . . . . 0.471 ' OG1' HG13 ' A' ' 35' ' ' VAL . 43.1 m -53.19 -40.98 64.82 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.2 -0.938 . . . . 0.0 110.031 179.853 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 16.6 ttt85 -72.13 -25.27 61.66 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.266 -0.896 . . . . 0.0 110.076 179.766 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -57.68 -55.27 37.02 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.262 -0.899 . . . . 0.0 110.089 179.856 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.93 -36.22 26.95 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.16 -0.963 . . . . 0.0 110.633 -179.958 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 43' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 . . . . . 0 N--CA 1.491 1.612 0 O-C-N 121.211 -0.931 . . . . 0.0 110.371 -179.844 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' C' C ' 2' ' ' LEU . . . . . 0.53 HD11 HD13 ' A' ' 23' ' ' LEU . 4.0 tp . . . . . 0 N--CA 1.491 1.584 0 CA-C-O 121.245 0.545 . . . . 0.0 110.222 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 3' ' ' ILE . . . . . . . . . . . . . 1.8 pp -63.09 -23.16 32.55 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.591 0 O-C-N 121.339 -0.851 . . . . 0.0 110.239 -179.977 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 4' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 -78.6 -32.35 47.54 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.235 -0.916 . . . . 0.0 110.329 -179.918 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 5' ' ' THR . . . . . . . . . . . . . 93.1 m -74.82 -34.57 62.38 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.221 -0.924 . . . . 0.0 110.262 -179.958 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 6' ' ' ALA . . . . . 0.436 ' HA ' ' HB2' ' C' ' 9' ' ' LEU . . . -77.7 -37.92 48.48 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.243 -0.911 . . . . 0.0 110.306 -179.895 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' C' C ' 7' ' ' SER . . . . . . . . . . . . . 31.9 m -52.44 -69.85 0.1 Allowed 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.157 -0.964 . . . . 0.0 110.204 -179.885 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 8' ' ' SER . . . . . . . . . . . . . 1.9 m -58.68 -24.54 61.52 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.262 -0.899 . . . . 0.0 110.265 179.908 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 9' ' ' LEU . . . . . 0.436 ' HB2' ' HA ' ' C' ' 6' ' ' ALA . 0.4 OUTLIER -52.24 -43.14 64.15 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.248 -0.907 . . . . 0.0 110.301 -179.923 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' C' C ' 10' ' ' VAL . . . . . . . . . . . . . 71.1 t -71.95 -30.11 35.73 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.595 0 O-C-N 121.166 -0.959 . . . . 0.0 110.309 -179.887 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 11' ' ' LYS . . . . . . . . . . . . . 34.4 mmtm -66.05 -48.6 70.51 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.19 -0.944 . . . . 0.0 110.361 -179.901 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' C' C ' 12' ' ' ASN . . . . . . . . . . . . . 28.7 m-80 . . . . . 0 N--CA 1.492 1.646 0 O-C-N 121.288 -0.882 . . . . 0.0 110.262 -179.918 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.396 0 N-CA-C 109.608 -1.397 . . . . 0.0 109.608 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -69.06 -23.14 64.0 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.236 -1.156 . . . . 0.0 110.35 -179.881 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 31.9 m -76.91 -51.15 11.72 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.221 -0.925 . . . . 0.0 110.259 -179.96 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -57.77 -31.71 66.79 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.262 -0.899 . . . . 0.0 110.272 -179.923 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.1 mp -72.29 -40.35 67.64 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.357 -0.84 . . . . 0.0 110.282 -179.882 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 5.8 mp -77.79 -52.76 8.4 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.284 -0.885 . . . . 0.0 110.246 -179.94 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' GLN . . . . . 0.435 ' O ' HG23 ' A' ' 20' ' ' VAL . 1.0 OUTLIER -51.79 -44.27 63.38 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.185 -0.947 . . . . 0.0 110.257 179.956 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -58.38 -47.76 87.82 Favored Glycine 0 N--CA 1.49 2.297 0 N-CA-C 109.149 -1.58 . . . . 0.0 109.149 179.729 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' TYR . . . . . 0.645 ' O ' HG23 ' A' ' 22' ' ' VAL . 46.8 t80 -61.15 -47.19 87.37 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.271 -1.135 . . . . 0.0 109.629 179.466 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 7.9 m -56.58 -36.11 68.97 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.361 -0.837 . . . . 0.0 110.147 179.743 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.435 HG23 ' O ' ' A' ' 16' ' ' GLN . 41.6 t -67.15 -71.95 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.674 0 O-C-N 121.293 -0.879 . . . . 0.0 110.216 -179.981 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 5.4 pt-20 -46.58 -49.11 19.33 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.357 -0.839 . . . . 0.0 111.425 -179.392 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.746 HG11 HD11 ' B' ' 11' ' ' LEU . 93.5 t -50.8 -44.28 26.16 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.717 0 O-C-N 120.774 -1.204 . . . . 0.0 110.529 -179.777 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.42 ' HB3' HD11 ' C' ' 2' ' ' LEU . 0.2 OUTLIER -73.26 -25.1 60.56 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.218 -0.926 . . . . 0.0 110.252 -179.987 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -76.49 -69.39 0.51 Allowed 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.255 -0.903 . . . . 0.0 110.417 -179.929 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 25' ' ' GLN . . . . . 0.407 ' HG3' ' HD3' ' A' ' 27' ' ' PRO . 2.7 pt20 -71.94 -33.67 68.42 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.126 -0.984 . . . . 0.0 110.285 -179.845 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 52.13 81.38 0.26 Allowed Pre-proline 0 N--CA 1.492 1.662 0 O-C-N 121.275 -0.891 . . . . 0.0 110.18 179.965 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 27' ' ' PRO . . . . . 0.407 ' HD3' ' HG3' ' A' ' 25' ' ' GLN . 44.8 Cg_endo -71.82 162.3 42.4 Favored 'Trans proline' 0 C--N 1.311 -1.442 0 O-C-N 123.727 1.383 . . . . 0.0 110.528 -179.82 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo -70.14 -26.4 25.81 Favored 'Trans proline' 0 C--N 1.311 -1.44 0 O-C-N 123.803 1.423 . . . . 0.0 110.142 179.828 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 9.6 m-20 -139.15 112.22 8.0 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.361 -0.837 . . . . 0.0 109.726 179.588 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 3.5 tp -74.7 -33.49 62.44 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.32 -0.862 . . . . 0.0 110.29 -179.7 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.417 ' H ' HG23 ' A' ' 31' ' ' VAL . 43.2 t -50.78 -54.66 9.12 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.714 0 O-C-N 121.275 -0.89 . . . . 0.0 110.112 179.812 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -66.19 -44.18 84.7 Favored 'General case' 0 C--N 1.301 -1.533 0 O-C-N 121.565 -0.709 . . . . 0.0 110.148 179.911 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 36.7 t80 -58.18 -50.3 74.0 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.082 -1.011 . . . . 0.0 109.756 179.532 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' ALA . . . . . 0.416 ' HB2' ' OH ' ' A' ' 18' ' ' TYR . . . -49.22 -39.48 30.04 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.42 -0.8 . . . . 0.0 110.515 179.891 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.556 HG13 ' OG1' ' B' ' 39' ' ' THR . 90.3 t -73.88 -38.85 51.01 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.366 0 O-C-N 121.221 -0.924 . . . . 0.0 110.423 -179.883 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -74.17 -20.56 60.17 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.201 -0.937 . . . . 0.0 110.548 -179.661 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 26.6 t80 -75.65 -59.61 2.67 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.191 -0.943 . . . . 0.0 110.466 -179.899 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' PHE . . . . . 0.407 ' CD2' ' HB1' ' B' ' 34' ' ' ALA . 23.6 m-85 -67.44 -48.69 66.5 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.225 -0.922 . . . . 0.0 110.51 -179.824 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 39' ' ' THR . . . . . 0.484 ' OG1' HG13 ' B' ' 35' ' ' VAL . 94.8 m -50.42 -41.56 52.62 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.174 -0.954 . . . . 0.0 110.29 -179.943 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 1.5 ttt180 -70.25 -25.2 63.26 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.177 -0.952 . . . . 0.0 110.13 179.697 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -62.54 -34.23 76.5 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.258 -0.901 . . . . 0.0 109.954 179.888 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.421 ' HD3' HG12 ' B' ' 31' ' ' VAL . 0.0 OUTLIER -54.64 -37.49 65.73 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.352 -0.843 . . . . 0.0 110.275 179.92 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -84.01 -25.53 29.87 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.217 -0.927 . . . . 0.0 110.4 -179.887 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.645 0 O-C-N 121.169 -0.957 . . . . 0.0 110.345 -179.983 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 47.7 Cg_endo . . . . . 0 N--CA 1.483 0.892 0 N-CA-C 110.349 -0.673 . . . . 0.0 110.349 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' B' B ' 9' ' ' PRO . . . . . . . . . . . . . 45.3 Cg_endo -72.53 177.8 7.01 Favored 'Trans proline' 0 C--N 1.313 -1.34 0 O-C-N 123.522 1.275 . . . . 0.0 110.49 179.967 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 99.28 -40.28 2.49 Favored Glycine 0 N--CA 1.491 2.3 0 N-CA-C 109.473 -1.451 . . . . 0.0 109.473 -179.943 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 11' ' ' LEU . . . . . 0.746 HD11 HG11 ' A' ' 22' ' ' VAL . 0.2 OUTLIER -63.22 -23.94 67.65 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.306 -1.114 . . . . 0.0 110.26 179.994 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 95.5 m -62.94 -61.38 2.43 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.223 -0.923 . . . . 0.0 110.214 179.929 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 -52.3 -32.81 39.38 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.342 -0.849 . . . . 0.0 110.248 -179.979 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 14.1 mt -66.59 -56.94 8.41 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.285 -0.884 . . . . 0.0 110.429 -179.852 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 15' ' ' LEU . . . . . 0.657 HD11 ' CD2' ' B' ' 11' ' ' LEU . 14.3 mt -66.03 -48.95 69.41 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.218 -0.926 . . . . 0.0 110.27 -179.943 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -52.02 -47.49 64.98 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.139 -0.976 . . . . 0.0 110.028 179.826 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 17' ' ' GLY . . . . . 0.404 ' O ' ' HB ' ' B' ' 20' ' ' VAL . . . -55.14 -42.54 82.04 Favored Glycine 0 N--CA 1.49 2.3 0 N-CA-C 109.066 -1.614 . . . . 0.0 109.066 179.508 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 18' ' ' TYR . . . . . 0.453 ' O ' HG23 ' B' ' 22' ' ' VAL . 19.0 t80 -64.87 -45.27 86.73 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.323 -1.104 . . . . 0.0 109.561 179.365 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 6.6 m -58.28 -24.08 58.36 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.424 -0.798 . . . . 0.0 110.022 179.675 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 20' ' ' VAL . . . . . 0.404 ' HB ' ' O ' ' B' ' 17' ' ' GLY . 51.2 t -78.07 -74.07 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.608 0 O-C-N 121.351 -0.843 . . . . 0.0 110.413 -179.828 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -45.28 -44.62 11.52 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.464 -0.772 . . . . 0.0 111.194 -179.305 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 22' ' ' VAL . . . . . 0.502 HG22 ' CE2' ' B' ' 33' ' ' PHE . 86.0 t -59.24 -47.17 91.25 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.6 0 O-C-N 120.947 -1.096 . . . . 0.0 109.737 179.808 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 3.0 tp -72.65 -19.45 61.44 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.293 -0.879 . . . . 0.0 110.038 179.594 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -81.5 -59.07 2.75 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.297 -0.877 . . . . 0.0 110.33 -179.913 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 25' ' ' GLN . . . . . 0.438 ' HG3' ' N ' ' B' ' 26' ' ' GLN . 0.0 OUTLIER -89.82 -23.01 21.82 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.206 -0.934 . . . . 0.0 110.586 -179.653 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 26' ' ' GLN . . . . . 0.438 ' N ' ' HG3' ' B' ' 25' ' ' GLN . 7.6 mt-30 47.96 81.78 0.25 Allowed Pre-proline 0 N--CA 1.494 1.76 0 O-C-N 121.159 -0.963 . . . . 0.0 110.674 179.752 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 27' ' ' PRO . . . . . . . . . . . . . 44.9 Cg_endo -73.09 166.55 29.71 Favored 'Trans proline' 0 C--N 1.31 -1.483 0 O-C-N 123.615 1.324 . . . . 0.0 110.598 -179.815 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 44.3 Cg_endo -70.52 -49.17 0.47 Allowed 'Trans proline' 0 C--N 1.311 -1.41 0 O-C-N 123.749 1.394 . . . . 0.0 110.176 179.785 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 10.0 m-20 -119.37 116.87 27.08 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.237 -0.914 . . . . 0.0 110.081 179.718 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 30' ' ' LEU . . . . . 0.448 ' HG ' ' HH ' ' B' ' 18' ' ' TYR . 0.6 OUTLIER -71.46 -29.26 64.65 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.27 -0.894 . . . . 0.0 110.444 -179.708 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 31' ' ' VAL . . . . . 0.421 HG12 ' HD3' ' A' ' 42' ' ' ARG . 43.4 t -49.9 -65.39 0.24 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.784 0 O-C-N 121.189 -0.945 . . . . 0.0 110.054 179.83 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 4.3 t0 -56.54 -46.54 80.59 Favored 'General case' 0 C--N 1.302 -1.492 0 O-C-N 121.466 -0.771 . . . . 0.0 109.961 179.679 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 33' ' ' PHE . . . . . 0.502 ' CE2' HG22 ' B' ' 22' ' ' VAL . 67.7 t80 -54.83 -47.35 74.21 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.174 -0.954 . . . . 0.0 109.832 179.68 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 34' ' ' ALA . . . . . 0.417 ' HB2' ' OH ' ' B' ' 18' ' ' TYR . . . -56.1 -40.19 73.31 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.324 -0.86 . . . . 0.0 109.935 179.74 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 35' ' ' VAL . . . . . 0.484 HG13 ' OG1' ' A' ' 39' ' ' THR . 76.9 t -77.32 -45.65 29.31 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.323 0 O-C-N 121.306 -0.871 . . . . 0.0 109.82 179.77 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -61.23 -36.26 79.48 Favored 'General case' 0 N--CA 1.487 1.403 0 O-C-N 121.3 -0.875 . . . . 0.0 109.329 179.495 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 37' ' ' TYR . . . . . . . . . . . . . 61.6 t80 -68.9 -59.34 3.13 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.295 -0.878 . . . . 0.0 110.141 179.872 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 12.1 m-85 -64.19 -49.57 71.52 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.257 -0.902 . . . . 0.0 110.576 -179.65 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 39' ' ' THR . . . . . 0.556 ' OG1' HG13 ' A' ' 35' ' ' VAL . 94.2 m -51.53 -27.7 11.54 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.1 -1.0 . . . . 0.0 110.056 179.953 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -75.49 -35.65 60.76 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.295 -0.878 . . . . 0.0 109.77 179.528 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.02 -27.83 68.61 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.389 -0.82 . . . . 0.0 110.301 179.926 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.26 -28.28 63.02 Favored 'General case' 0 N--CA 1.486 1.343 0 O-C-N 121.263 -0.898 . . . . 0.0 110.04 -179.922 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 43' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 . . . . . 0 N--CA 1.492 1.639 0 O-C-N 121.125 -0.984 . . . . 0.0 110.565 179.937 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' C' C ' 2' ' ' LEU . . . . . 0.42 HD11 ' HB3' ' A' ' 23' ' ' LEU . 0.1 OUTLIER . . . . . 0 N--CA 1.498 1.972 0 CA-C-O 121.164 0.506 . . . . 0.0 110.553 . . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 3' ' ' ILE . . . . . . . . . . . . . 2.9 mp -55.48 -23.37 13.97 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.61 0 O-C-N 121.083 -1.011 . . . . 0.0 110.321 -179.888 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 4' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -103.62 20.49 17.87 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.278 -0.889 . . . . 0.0 110.306 -179.883 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 5' ' ' THR . . . . . . . . . . . . . 78.7 m -138.34 -47.93 0.53 Allowed 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.189 -0.944 . . . . 0.0 110.078 179.825 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 6' ' ' ALA . . . . . 0.581 ' O ' HG22 ' C' ' 10' ' ' VAL . . . -61.39 -36.18 79.55 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.235 -0.916 . . . . 0.0 110.065 179.877 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 7' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -60.79 -45.43 94.4 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.28 -0.888 . . . . 0.0 110.117 179.884 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 8' ' ' SER . . . . . . . . . . . . . 6.3 t -70.92 -29.62 65.72 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.276 -0.89 . . . . 0.0 110.095 179.8 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 9' ' ' LEU . . . . . . . . . . . . . 3.2 tp -68.68 -62.8 1.23 Allowed 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.277 -0.89 . . . . 0.0 110.158 179.945 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 10' ' ' VAL . . . . . 0.581 HG22 ' O ' ' C' ' 6' ' ' ALA . 35.2 m -53.85 -27.78 16.07 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.628 0 O-C-N 121.314 -0.866 . . . . 0.0 110.173 -179.94 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' C' C ' 11' ' ' LYS . . . . . . . . . . . . . 1.8 tppt? -70.37 -38.72 74.8 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.291 -0.881 . . . . 0.0 110.255 -179.951 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' C' C ' 12' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 . . . . . 0 N--CA 1.492 1.652 0 O-C-N 121.241 -0.912 . . . . 0.0 110.139 179.937 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.414 0 N-CA-C 109.615 -1.394 . . . . 0.0 109.615 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 22.3 tp -64.36 -23.15 67.19 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.239 -1.154 . . . . 0.0 110.338 -179.904 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 7.5 m -63.25 -62.81 1.45 Allowed 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.218 -0.926 . . . . 0.0 110.231 -179.987 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 31.6 tt0 -54.77 -30.49 56.79 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.352 -0.843 . . . . 0.0 110.223 -179.99 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -72.65 -49.82 29.22 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.205 -0.935 . . . . 0.0 110.222 179.93 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -70.7 -56.58 6.08 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.141 -0.974 . . . . 0.0 110.113 179.944 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 16' ' ' GLN . . . . . 0.583 ' HG3' HG11 ' C' ' 10' ' ' VAL . 0.0 OUTLIER -54.38 -41.67 69.49 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.147 -0.971 . . . . 0.0 109.646 179.607 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -55.57 -41.03 80.53 Favored Glycine 0 N--CA 1.489 2.205 0 N-CA-C 109.248 -1.541 . . . . 0.0 109.248 179.554 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' TYR . . . . . 0.559 ' O ' HG23 ' A' ' 22' ' ' VAL . 63.7 t80 -67.08 -43.15 83.35 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.296 -1.12 . . . . 0.0 109.736 179.624 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 1.6 m -54.41 -29.19 48.16 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.198 -0.939 . . . . 0.0 109.88 179.557 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 45.0 t -76.86 -71.68 0.26 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.593 0 O-C-N 121.407 -0.808 . . . . 0.0 110.238 -179.955 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.409 ' HG3' ' N ' ' A' ' 22' ' ' VAL . 10.0 pt-20 -45.31 -43.09 10.43 Favored 'General case' 0 N--CA 1.497 1.903 0 O-C-N 121.447 -0.783 . . . . 0.0 111.094 -179.489 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.559 HG23 ' O ' ' A' ' 18' ' ' TYR . 71.2 t -55.94 -54.07 31.06 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.581 0 O-C-N 121.001 -1.062 . . . . 0.0 109.596 179.706 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.676 ' HB3' HD11 ' C' ' 2' ' ' LEU . 4.0 mt -66.73 -23.79 66.15 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.311 -0.868 . . . . 0.0 109.976 179.713 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 24' ' ' ARG . . . . . 0.482 ' NH1' HD13 ' C' ' 2' ' ' LEU . 0.0 OUTLIER -81.34 -71.15 0.49 Allowed 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.258 -0.901 . . . . 0.0 109.944 179.899 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -55.18 -35.26 64.63 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.381 -0.824 . . . . 0.0 110.199 179.907 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER 51.25 64.61 7.77 Favored Pre-proline 0 N--CA 1.491 1.612 0 O-C-N 121.173 -0.954 . . . . 0.0 110.272 -179.944 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 46.2 Cg_endo -70.69 159.44 52.7 Favored 'Trans proline' 0 C--N 1.31 -1.452 0 O-C-N 123.76 1.4 . . . . 0.0 110.475 -179.953 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 43.7 Cg_endo -70.63 -23.03 27.29 Favored 'Trans proline' 0 C--N 1.31 -1.461 0 O-C-N 123.713 1.375 . . . . 0.0 110.149 179.876 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' ASP . . . . . 0.425 ' OD2' ' CB ' ' A' ' 32' ' ' ASP . 32.8 p-10 -142.4 115.26 8.7 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.384 -0.823 . . . . 0.0 109.917 179.697 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.415 ' CD1' ' OH ' ' A' ' 18' ' ' TYR . 10.8 tp -70.61 -34.93 72.66 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.273 -0.892 . . . . 0.0 110.318 -179.691 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 42.4 t -49.83 -59.9 0.92 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.832 0 O-C-N 121.261 -0.899 . . . . 0.0 109.925 179.714 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 32' ' ' ASP . . . . . 0.425 ' CB ' ' OD2' ' A' ' 29' ' ' ASP . 6.4 t0 -60.1 -46.1 90.72 Favored 'General case' 0 C--N 1.301 -1.503 0 O-C-N 121.619 -0.675 . . . . 0.0 109.972 179.801 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 53.3 t80 -56.56 -48.79 76.57 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.169 -0.957 . . . . 0.0 109.568 179.524 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -55.06 -43.45 73.85 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.329 -0.857 . . . . 0.0 109.659 179.579 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.43 HG13 ' OG1' ' B' ' 39' ' ' THR . 69.2 t -72.34 -23.42 21.34 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.36 0 O-C-N 121.486 -0.759 . . . . 0.0 109.878 179.712 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -81.7 -44.07 17.61 Favored 'General case' 0 C--N 1.303 -1.418 0 O-C-N 121.23 -0.919 . . . . 0.0 109.782 -179.749 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 51.5 t80 -62.71 -61.47 2.39 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.182 -0.949 . . . . 0.0 110.752 -179.63 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 29.7 m-85 -57.51 -52.95 63.32 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.241 -0.912 . . . . 0.0 111.123 -179.321 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' THR . . . . . 0.662 ' OG1' HG13 ' B' ' 35' ' ' VAL . 22.8 m -49.73 -41.79 44.55 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 121.065 -1.022 . . . . 0.0 110.195 -179.656 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 34.4 ttt-85 -71.59 -20.87 61.94 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.187 -0.946 . . . . 0.0 109.843 179.473 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -63.49 -43.21 97.91 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.302 -0.874 . . . . 0.0 110.242 179.998 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.498 ' HD2' HG12 ' B' ' 31' ' ' VAL . 0.0 OUTLIER -49.44 -25.71 2.77 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.198 -0.939 . . . . 0.0 110.22 179.771 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 43' ' ' GLU . . . . . 0.589 ' O ' ' HB3' ' A' ' 44' ' ' ALA . 1.0 OUTLIER -106.29 -58.26 1.94 Allowed 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.433 -0.792 . . . . 0.0 109.777 179.611 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 44' ' ' ALA . . . . . 0.589 ' HB3' ' O ' ' A' ' 43' ' ' GLU . . . . . . . . 0 N--CA 1.501 2.098 0 O-C-N 121.624 -0.672 . . . . 0.0 110.73 179.835 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_endo . . . . . 0 N--CA 1.484 0.918 0 N-CA-C 110.518 -0.608 . . . . 0.0 110.518 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' B' B ' 9' ' ' PRO . . . . . . . . . . . . . 49.3 Cg_endo -78.61 2.17 8.39 Favored 'Trans proline' 0 C--N 1.313 -1.294 0 O-C-N 123.661 1.348 . . . . 0.0 111.418 -179.943 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . -72.03 -20.2 78.82 Favored Glycine 0 N--CA 1.491 2.3 0 N-CA-C 109.664 -1.374 . . . . 0.0 109.664 179.982 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 11' ' ' LEU . . . . . 0.503 HD11 HG11 ' A' ' 22' ' ' VAL . 0.4 OUTLIER -81.12 -16.92 51.66 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.272 -1.134 . . . . 0.0 110.519 -179.891 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 12' ' ' THR . . . . . 0.525 ' OG1' HD11 ' C' ' 9' ' ' LEU . 78.4 m -73.12 -36.21 66.68 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.074 -1.016 . . . . 0.0 110.374 -179.881 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -75.06 -25.23 58.49 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.277 -0.889 . . . . 0.0 110.156 179.999 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -74.02 -47.56 36.14 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.277 -0.89 . . . . 0.0 110.166 179.922 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 84.5 mt -64.08 -49.78 70.94 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.224 -0.922 . . . . 0.0 110.021 179.882 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 16' ' ' GLN . . . . . 0.477 ' O ' HG23 ' B' ' 20' ' ' VAL . 0.0 OUTLIER -56.04 -42.35 76.43 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.264 -0.898 . . . . 0.0 109.871 179.764 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 17' ' ' GLY . . . . . 0.406 ' O ' ' CG ' ' B' ' 21' ' ' GLU . . . -57.92 -46.47 92.42 Favored Glycine 0 N--CA 1.49 2.257 0 N-CA-C 109.271 -1.532 . . . . 0.0 109.271 179.774 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 18' ' ' TYR . . . . . 0.492 ' OH ' ' HB2' ' B' ' 34' ' ' ALA . 39.4 t80 -63.38 -30.64 71.74 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.313 -1.11 . . . . 0.0 109.957 179.726 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 62.4 m -74.85 -27.69 60.37 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.343 -0.848 . . . . 0.0 110.237 179.993 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 20' ' ' VAL . . . . . 0.477 HG23 ' O ' ' B' ' 16' ' ' GLN . 87.1 t -78.1 -19.56 13.63 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.616 0 O-C-N 121.166 -0.958 . . . . 0.0 110.28 179.941 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 21' ' ' GLU . . . . . 0.456 ' HG3' ' HA ' ' B' ' 18' ' ' TYR . 0.6 OUTLIER -86.38 -45.79 10.86 Favored 'General case' 0 N--CA 1.499 1.991 0 O-C-N 121.138 -0.976 . . . . 0.0 108.895 179.605 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 22' ' ' VAL . . . . . 0.422 HG23 ' O ' ' B' ' 18' ' ' TYR . 78.2 t -63.31 -25.67 39.0 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.541 0 CA-C-O 121.308 0.575 . . . . 0.0 110.056 179.978 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 23' ' ' LEU . . . . . 0.44 HD23 ' HA ' ' B' ' 23' ' ' LEU . 4.4 mt -84.22 -31.6 24.95 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.26 -0.9 . . . . 0.0 110.09 179.777 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -87.6 -40.27 14.36 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.26 -0.9 . . . . 0.0 110.442 -179.847 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 1.8 tt0 -88.44 -40.85 13.17 Favored 'General case' 0 C--N 1.306 -1.303 0 O-C-N 121.28 -0.887 . . . . 0.0 110.298 -179.711 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 52.8 67.36 3.94 Favored Pre-proline 0 N--CA 1.492 1.628 0 O-C-N 121.318 -0.864 . . . . 0.0 110.211 179.945 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 27' ' ' PRO . . . . . . . . . . . . . 45.1 Cg_endo -70.94 167.45 25.95 Favored 'Trans proline' 0 C--N 1.312 -1.383 0 O-C-N 123.571 1.301 . . . . 0.0 110.558 -179.955 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 44.3 Cg_endo -71.26 -41.89 2.28 Favored 'Trans proline' 0 C--N 1.312 -1.359 0 O-C-N 123.734 1.386 . . . . 0.0 110.38 179.826 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 10.9 m-20 -123.22 120.88 34.45 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.222 -0.924 . . . . 0.0 110.164 179.935 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 2.7 tp -78.65 -31.55 46.86 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.289 -0.882 . . . . 0.0 109.898 179.747 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 31' ' ' VAL . . . . . 0.498 HG12 ' HD2' ' A' ' 42' ' ' ARG . 46.8 t -52.63 -67.38 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.678 0 O-C-N 121.278 -0.889 . . . . 0.0 109.967 179.787 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 1.6 t0 -55.5 -41.53 73.18 Favored 'General case' 0 C--N 1.303 -1.456 0 O-C-N 121.39 -0.819 . . . . 0.0 109.764 179.709 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 33' ' ' PHE . . . . . . . . . . . . . 59.4 t80 -58.2 -47.72 82.57 Favored 'General case' 0 N--CA 1.488 1.446 0 O-C-N 121.169 -0.957 . . . . 0.0 109.369 179.32 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 34' ' ' ALA . . . . . 0.492 ' HB2' ' OH ' ' B' ' 18' ' ' TYR . . . -58.54 -36.92 74.63 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.346 -0.846 . . . . 0.0 109.512 179.313 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 35' ' ' VAL . . . . . 0.662 HG13 ' OG1' ' A' ' 39' ' ' THR . 89.1 t -75.2 -51.43 21.38 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.32 0 O-C-N 121.471 -0.768 . . . . 0.0 109.994 179.704 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 36' ' ' GLU . . . . . 0.409 ' O ' ' HB2' ' B' ' 40' ' ' ARG . 3.0 mm-40 -58.96 -35.79 73.74 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.268 -0.895 . . . . 0.0 110.116 179.995 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 37' ' ' TYR . . . . . 0.447 ' CE1' ' OE2' ' B' ' 21' ' ' GLU . 43.2 t80 -62.29 -73.64 0.1 Allowed 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.295 -0.878 . . . . 0.0 110.107 179.957 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 20.9 m-85 -51.88 -45.36 64.09 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.242 -0.911 . . . . 0.0 110.521 -179.888 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 39' ' ' THR . . . . . 0.43 ' OG1' HG13 ' A' ' 35' ' ' VAL . 45.2 m -53.16 -28.53 26.67 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.174 -0.954 . . . . 0.0 110.032 179.835 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 40' ' ' ARG . . . . . 0.409 ' HB2' ' O ' ' B' ' 36' ' ' GLU . 0.0 OUTLIER -82.57 -30.61 29.52 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.292 -0.88 . . . . 0.0 109.953 179.686 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.69 -36.14 75.88 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.311 -0.868 . . . . 0.0 110.123 179.922 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 42' ' ' ARG . . . . . 0.415 ' NH1' ' OD2' ' A' ' 32' ' ' ASP . 0.0 OUTLIER -52.11 -38.0 55.94 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.221 -0.924 . . . . 0.0 110.194 179.934 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 43' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 . . . . . 0 N--CA 1.49 1.561 0 O-C-N 121.272 -0.893 . . . . 0.0 110.276 179.896 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' C' C ' 2' ' ' LEU . . . . . 0.676 HD11 ' HB3' ' A' ' 23' ' ' LEU . 0.1 OUTLIER . . . . . 0 N--CA 1.491 1.605 0 CA-C-O 121.26 0.553 . . . . 0.0 110.392 . . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 3' ' ' ILE . . . . . . . . . . . . . 10.5 mt -63.44 -28.86 45.86 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.651 0 O-C-N 121.294 -0.879 . . . . 0.0 110.316 -179.918 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 4' ' ' GLU . . . . . . . . . . . . . 26.2 mt-10 -94.92 -20.23 19.58 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.175 -0.953 . . . . 0.0 110.352 -179.921 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 5' ' ' THR . . . . . . . . . . . . . 9.2 m -98.56 -19.67 17.47 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.29 -0.881 . . . . 0.0 110.448 -179.83 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 6' ' ' ALA . . . . . 0.449 ' O ' HG23 ' C' ' 10' ' ' VAL . . . -77.27 -58.95 2.99 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.088 -1.007 . . . . 0.0 110.445 -179.826 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 7' ' ' SER . . . . . . . . . . . . . 2.9 t -62.19 -36.24 81.29 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.179 -0.951 . . . . 0.0 110.537 -179.718 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 8' ' ' SER . . . . . . . . . . . . . 4.2 t -65.17 -42.35 93.75 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.134 -0.978 . . . . 0.0 110.341 -179.863 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' C' C ' 9' ' ' LEU . . . . . 0.525 HD11 ' OG1' ' B' ' 12' ' ' THR . 3.3 tt -70.03 -48.56 57.46 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.205 -0.934 . . . . 0.0 110.236 179.991 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 10' ' ' VAL . . . . . 0.583 HG11 ' HG3' ' A' ' 16' ' ' GLN . 87.7 t -58.77 -56.34 17.31 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.669 0 O-C-N 121.221 -0.925 . . . . 0.0 110.317 -179.923 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 11' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -52.2 -40.02 60.98 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.28 -0.887 . . . . 0.0 110.474 -179.795 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' C' C ' 12' ' ' ASN . . . . . . . . . . . . . 28.7 t30 . . . . . 0 N--CA 1.492 1.63 0 O-C-N 121.174 -0.954 . . . . 0.0 110.381 -179.895 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.333 0 N-CA-C 109.65 -1.38 . . . . 0.0 109.65 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 49.0 tp -58.52 -27.2 64.3 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.294 -1.121 . . . . 0.0 110.538 -179.889 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' THR . . . . . 0.709 HG23 HG23 ' C' ' 10' ' ' VAL . 86.6 m -68.37 -30.78 69.8 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.218 -0.926 . . . . 0.0 110.74 -179.658 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -76.8 -39.74 50.42 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.119 -0.988 . . . . 0.0 110.507 -179.66 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.719 HD21 ' CE1' ' A' ' 38' ' ' PHE . 7.7 tt -71.46 -36.76 71.31 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.13 -0.981 . . . . 0.0 110.511 -179.741 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.434 HD12 ' HA ' ' A' ' 15' ' ' LEU . 2.0 tp -65.55 -57.43 8.22 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.182 -0.949 . . . . 0.0 110.587 -179.708 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 16' ' ' GLN . . . . . 0.501 ' O ' HG23 ' A' ' 20' ' ' VAL . 0.9 OUTLIER -50.58 -34.88 27.48 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.129 -0.982 . . . . 0.0 110.242 -179.901 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -62.89 -50.13 66.42 Favored Glycine 0 N--CA 1.49 2.236 0 N-CA-C 109.245 -1.542 . . . . 0.0 109.245 179.651 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' TYR . . . . . 0.451 ' HA ' ' HG3' ' A' ' 21' ' ' GLU . 30.6 t80 -56.12 -41.46 75.33 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.244 -1.15 . . . . 0.0 110.119 179.807 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 57.6 m -61.52 -37.67 84.57 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.321 -0.862 . . . . 0.0 110.59 -179.803 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.501 HG23 ' O ' ' A' ' 16' ' ' GLN . 98.5 t -69.12 -22.09 25.82 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.72 0 O-C-N 121.264 -0.897 . . . . 0.0 110.437 -179.705 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.451 ' HG3' ' HA ' ' A' ' 18' ' ' TYR . 1.2 mt-10 -88.18 -48.48 7.67 Favored 'General case' 0 N--CA 1.499 2.016 0 O-C-N 121.209 -0.932 . . . . 0.0 108.818 179.666 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.447 HG23 ' O ' ' A' ' 18' ' ' TYR . 64.7 t -48.98 -31.63 4.2 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.473 0 O-C-N 121.75 -0.594 . . . . 0.0 110.339 179.936 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 1.036 HD22 HD13 ' C' ' 2' ' ' LEU . 0.1 OUTLIER -85.76 -40.15 16.38 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.268 -0.895 . . . . 0.0 110.158 -179.956 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -74.81 -52.66 10.83 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.169 -0.957 . . . . 0.0 110.289 179.933 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 25' ' ' GLN . . . . . 0.434 ' O ' ' CG ' ' A' ' 26' ' ' GLN . 3.8 mp0 -73.89 -19.4 60.72 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.225 -0.922 . . . . 0.0 110.603 -179.914 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 26' ' ' GLN . . . . . 0.434 ' CG ' ' O ' ' A' ' 25' ' ' GLN . 21.5 pt20 36.64 61.38 3.31 Favored Pre-proline 0 N--CA 1.506 2.343 0 O-C-N 121.937 -0.477 . . . . 0.0 111.912 -179.936 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 27' ' ' PRO . . . . . 0.504 ' HG3' ' CD2' ' A' ' 33' ' ' PHE . 44.1 Cg_endo -71.08 154.69 62.32 Favored 'Trans proline' 0 C--N 1.311 -1.4 0 O-C-N 123.564 1.297 . . . . 0.0 110.537 -179.957 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 46.2 Cg_endo -72.77 -42.69 1.05 Allowed 'Trans proline' 0 C--N 1.312 -1.387 0 O-C-N 123.734 1.386 . . . . 0.0 110.37 179.876 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 14.2 m-20 -113.85 122.89 48.4 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.31 -0.868 . . . . 0.0 110.14 179.887 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.7 HD21 HD12 ' B' ' 11' ' ' LEU . 0.2 OUTLIER -75.48 -47.11 28.57 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.169 -0.957 . . . . 0.0 110.195 179.971 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 39.9 t -50.28 -60.98 0.69 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.786 0 O-C-N 121.177 -0.952 . . . . 0.0 109.797 179.702 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 5.1 t0 -58.86 -39.51 81.56 Favored 'General case' 0 C--N 1.302 -1.49 0 O-C-N 121.653 -0.655 . . . . 0.0 109.808 179.526 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' PHE . . . . . 0.504 ' CD2' ' HG3' ' A' ' 27' ' ' PRO . 36.9 t80 -62.54 -46.58 87.74 Favored 'General case' 0 N--CA 1.488 1.436 0 O-C-N 121.163 -0.961 . . . . 0.0 109.526 179.44 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -56.13 -40.94 74.56 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.388 -0.82 . . . . 0.0 110.123 179.79 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.407 HG13 ' OG1' ' B' ' 39' ' ' THR . 97.9 t -64.74 -43.95 96.51 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.337 0 O-C-N 121.151 -0.968 . . . . 0.0 110.146 -179.979 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -63.04 -35.0 78.77 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.28 -0.887 . . . . 0.0 110.103 179.859 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 37' ' ' TYR . . . . . 0.419 ' CE1' ' OE2' ' A' ' 21' ' ' GLU . 20.4 t80 -69.08 -60.42 2.37 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.233 -0.917 . . . . 0.0 110.367 -179.841 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 38' ' ' PHE . . . . . 0.719 ' CE1' HD21 ' A' ' 14' ' ' LEU . 28.5 m-85 -61.68 -49.2 77.43 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.282 -0.886 . . . . 0.0 110.322 -179.791 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 39' ' ' THR . . . . . 0.493 ' OG1' HG13 ' B' ' 35' ' ' VAL . 55.7 m -51.79 -41.39 61.65 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.195 -0.941 . . . . 0.0 110.22 179.965 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 2.9 mtp180 -72.61 -30.22 64.17 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.235 -0.916 . . . . 0.0 109.963 179.766 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.443 ' O ' HD23 ' A' ' 41' ' ' LEU . 1.4 tt -56.73 -40.89 76.51 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.353 -0.842 . . . . 0.0 110.085 179.914 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -51.54 -29.02 15.4 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.227 -0.92 . . . . 0.0 110.438 179.999 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 -106.86 -2.93 20.86 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.232 -0.917 . . . . 0.0 110.88 -179.931 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 1.684 0 O-C-N 120.947 -1.095 . . . . 0.0 110.28 179.928 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 46.0 Cg_endo . . . . . 0 N--CA 1.484 0.925 0 N-CA-C 110.417 -0.647 . . . . 0.0 110.417 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' B' B ' 9' ' ' PRO . . . . . . . . . . . . . 48.2 Cg_endo -72.81 -174.88 1.65 Allowed 'Trans proline' 0 C--N 1.312 -1.345 0 O-C-N 123.559 1.294 . . . . 0.0 110.273 179.931 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 102.59 -38.28 3.28 Favored Glycine 0 N--CA 1.491 2.328 0 N-CA-C 109.296 -1.522 . . . . 0.0 109.296 -179.985 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 11' ' ' LEU . . . . . 0.7 HD12 HD21 ' A' ' 30' ' ' LEU . 0.7 OUTLIER -59.03 -36.49 75.08 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.327 -1.102 . . . . 0.0 110.09 179.962 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 22.1 m -51.93 -63.04 1.27 Allowed 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.234 -0.916 . . . . 0.0 110.302 179.895 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -57.6 -23.34 50.37 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.324 -0.86 . . . . 0.0 110.19 179.943 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 14' ' ' LEU . . . . . 0.561 HD23 ' HE1' ' B' ' 38' ' ' PHE . 0.0 OUTLIER -78.97 -33.74 44.86 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.234 -0.916 . . . . 0.0 110.087 179.965 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 15' ' ' LEU . . . . . 0.611 HD13 ' HG ' ' B' ' 11' ' ' LEU . 4.9 mp -80.27 -47.13 15.05 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.237 -0.914 . . . . 0.0 110.122 179.963 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 16' ' ' GLN . . . . . 0.761 ' O ' HG23 ' B' ' 20' ' ' VAL . 0.0 OUTLIER -53.73 -45.87 70.66 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.268 -0.895 . . . . 0.0 109.818 179.648 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 17' ' ' GLY . . . . . 0.412 ' O ' ' CG ' ' B' ' 21' ' ' GLU . . . -60.93 -50.96 61.78 Favored Glycine 0 N--CA 1.49 2.247 0 N-CA-C 109.293 -1.523 . . . . 0.0 109.293 179.632 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 18' ' ' TYR . . . . . 0.699 ' O ' HG23 ' B' ' 22' ' ' VAL . 25.8 t80 -53.72 -31.95 50.19 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.322 -1.104 . . . . 0.0 110.103 179.809 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 88.8 m -75.83 -29.31 58.58 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.37 -0.831 . . . . 0.0 110.13 179.949 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 20' ' ' VAL . . . . . 0.761 HG23 ' O ' ' B' ' 16' ' ' GLN . 39.9 t -78.5 -19.58 13.3 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.664 0 O-C-N 121.327 -0.858 . . . . 0.0 110.252 -179.982 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 21' ' ' GLU . . . . . 0.448 ' OE1' ' CE1' ' B' ' 37' ' ' TYR . 1.3 mt-10 -87.07 -42.62 12.93 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.243 -0.911 . . . . 0.0 108.868 179.851 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 22' ' ' VAL . . . . . 0.699 HG23 ' O ' ' B' ' 18' ' ' TYR . 51.9 t -64.52 -29.37 47.16 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.508 0 O-C-N 121.743 -0.598 . . . . 0.0 110.13 -179.918 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 1.4 mt -75.78 -48.13 22.96 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.315 -0.866 . . . . 0.0 110.064 179.798 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 7.1 mpt_? -69.3 -70.68 0.26 Allowed 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.249 -0.907 . . . . 0.0 110.113 179.898 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -51.83 -41.02 61.47 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.237 -0.914 . . . . 0.0 110.408 179.94 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER 52.15 66.21 5.34 Favored Pre-proline 0 N--CA 1.491 1.601 0 O-C-N 121.408 -0.808 . . . . 0.0 110.381 179.945 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 27' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_endo -71.35 159.99 50.05 Favored 'Trans proline' 0 C--N 1.311 -1.44 0 O-C-N 123.638 1.336 . . . . 0.0 110.531 179.873 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 44.7 Cg_endo -71.49 -35.23 8.39 Favored 'Trans proline' 0 C--N 1.311 -1.445 0 O-C-N 123.742 1.39 . . . . 0.0 110.27 179.771 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 29' ' ' ASP . . . . . 0.418 ' OD1' ' N ' ' B' ' 29' ' ' ASP . 38.2 p-10 -132.5 114.53 14.39 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.357 -0.839 . . . . 0.0 110.256 179.722 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 4.2 tp -67.91 -31.34 71.05 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.325 -0.86 . . . . 0.0 110.444 -179.829 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 31' ' ' VAL . . . . . 0.431 ' H ' HG23 ' B' ' 31' ' ' VAL . 44.6 t -49.77 -56.51 3.21 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.751 0 O-C-N 121.174 -0.954 . . . . 0.0 110.088 179.718 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 32' ' ' ASP . . . . . 0.403 ' HB2' ' OD2' ' B' ' 29' ' ' ASP . 0.9 OUTLIER -64.0 -45.63 88.12 Favored 'General case' 0 C--N 1.302 -1.482 0 O-C-N 121.577 -0.702 . . . . 0.0 110.102 179.919 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 33' ' ' PHE . . . . . . . . . . . . . 74.8 t80 -57.56 -40.07 78.1 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.045 -1.034 . . . . 0.0 109.628 179.519 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 34' ' ' ALA . . . . . 0.514 ' HB2' ' OH ' ' B' ' 18' ' ' TYR . . . -60.99 -43.67 98.51 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.338 -0.851 . . . . 0.0 109.992 179.668 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 35' ' ' VAL . . . . . 0.493 HG13 ' OG1' ' A' ' 39' ' ' THR . 58.9 t -70.53 -40.79 77.75 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.289 0 O-C-N 121.251 -0.906 . . . . 0.0 110.072 179.77 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -74.03 -21.58 59.9 Favored 'General case' 0 N--CA 1.487 1.404 0 O-C-N 121.293 -0.879 . . . . 0.0 109.712 179.961 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 37' ' ' TYR . . . . . 0.448 ' CE1' ' OE1' ' B' ' 21' ' ' GLU . 28.3 t80 -79.58 -64.46 1.18 Allowed 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.119 -0.988 . . . . 0.0 110.515 -179.864 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 38' ' ' PHE . . . . . 0.561 ' HE1' HD23 ' B' ' 14' ' ' LEU . 22.8 m-85 -60.04 -46.88 88.06 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.265 -0.897 . . . . 0.0 110.656 -179.613 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 39' ' ' THR . . . . . 0.407 ' OG1' HG13 ' A' ' 35' ' ' VAL . 72.9 m -53.68 -54.89 31.47 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.096 -1.002 . . . . 0.0 110.152 179.952 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 41.8 ttt180 -62.7 -22.62 66.63 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.225 -0.922 . . . . 0.0 110.019 179.688 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -59.67 -51.01 71.63 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.317 -0.864 . . . . 0.0 110.063 179.943 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -50.41 -24.93 3.39 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.22 -0.925 . . . . 0.0 110.545 179.969 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 43' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.624 0 O-C-N 121.248 -0.907 . . . . 0.0 110.872 -179.669 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 2' ' ' LEU . . . . . 1.036 HD13 HD22 ' A' ' 23' ' ' LEU . 67.7 tp . . . . . 0 N--CA 1.492 1.637 0 CA-C-O 121.238 0.542 . . . . 0.0 110.162 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 3' ' ' ILE . . . . . . . . . . . . . 47.2 mm -75.71 -36.73 34.42 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.576 0 O-C-N 121.213 -0.929 . . . . 0.0 110.19 -179.969 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 4' ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 -74.98 -3.91 35.12 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.34 -0.85 . . . . 0.0 110.747 -179.971 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 5' ' ' THR . . . . . . . . . . . . . 2.3 p -105.72 -66.58 0.98 Allowed 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.051 -1.03 . . . . 0.0 110.209 -179.915 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 6' ' ' ALA . . . . . . . . . . . . . . . -54.26 -43.78 71.27 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.318 -0.864 . . . . 0.0 110.205 -179.928 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 7' ' ' SER . . . . . 0.53 ' O ' HG12 ' C' ' 10' ' ' VAL . 8.5 t -57.64 -25.31 59.98 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.202 -0.936 . . . . 0.0 110.106 179.951 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 8' ' ' SER . . . . . . . . . . . . . 47.4 t -83.27 -24.5 32.23 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.268 -0.895 . . . . 0.0 110.051 179.84 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 9' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -75.97 -34.61 59.79 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.352 -0.843 . . . . 0.0 110.098 179.993 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 10' ' ' VAL . . . . . 0.709 HG23 HG23 ' A' ' 12' ' ' THR . 6.4 p -67.7 -24.21 30.63 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.56 0 O-C-N 121.311 -0.868 . . . . 0.0 110.072 179.916 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' C' C ' 11' ' ' LYS . . . . . . . . . . . . . 1.2 ttmt -76.17 -47.01 25.79 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.264 -0.898 . . . . 0.0 110.039 179.776 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' C' C ' 12' ' ' ASN . . . . . . . . . . . . . 96.2 m-20 . . . . . 0 N--CA 1.492 1.632 0 O-C-N 121.286 -0.884 . . . . 0.0 110.407 179.68 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.269 0 N-CA-C 109.34 -1.504 . . . . 0.0 109.34 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.51 ' O ' HD23 ' A' ' 15' ' ' LEU . 7.1 tt -66.23 -26.6 67.45 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.219 -1.165 . . . . 0.0 110.095 179.924 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 63.4 m -74.24 -28.98 61.49 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.293 -0.879 . . . . 0.0 110.055 179.868 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -71.51 -41.32 69.38 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.358 -0.839 . . . . 0.0 110.008 179.864 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 28.1 tp -72.72 -41.76 64.86 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.31 -0.869 . . . . 0.0 110.071 179.902 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.533 HD12 HD21 ' B' ' 15' ' ' LEU . 2.8 mm? -58.03 -50.02 74.85 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.2 -0.937 . . . . 0.0 110.116 179.902 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 16' ' ' GLN . . . . . 0.496 ' O ' HG23 ' A' ' 20' ' ' VAL . 3.3 mt-30 -55.04 -43.3 73.64 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.207 -0.933 . . . . 0.0 109.698 179.731 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -53.24 -36.69 53.24 Favored Glycine 0 N--CA 1.493 2.486 0 N-CA-C 109.185 -1.566 . . . . 0.0 109.185 179.486 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' TYR . . . . . 0.627 ' O ' HG23 ' A' ' 22' ' ' VAL . 28.2 t80 -69.91 -54.63 12.54 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.441 -1.034 . . . . 0.0 109.363 179.307 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 19' ' ' THR . . . . . 0.765 ' O ' HD12 ' A' ' 23' ' ' LEU . 47.8 m -52.47 -27.65 17.06 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.373 -0.829 . . . . 0.0 109.982 179.373 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.496 HG23 ' O ' ' A' ' 16' ' ' GLN . 43.9 t -71.54 -74.9 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.61 0 O-C-N 121.419 -0.801 . . . . 0.0 109.83 179.812 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.433 ' O ' ' CG ' ' A' ' 25' ' ' GLN . 21.8 pt-20 -48.54 -42.93 34.83 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.378 -0.826 . . . . 0.0 110.77 -179.665 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.673 HG11 HD11 ' A' ' 30' ' ' LEU . 97.1 t -55.2 -39.0 49.24 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.649 0 O-C-N 121.145 -0.972 . . . . 0.0 110.38 -179.815 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.765 HD12 ' O ' ' A' ' 19' ' ' THR . 30.7 mt -88.65 -22.71 23.3 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.211 -0.931 . . . . 0.0 110.295 -179.88 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -81.24 -37.63 28.25 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.189 -0.945 . . . . 0.0 110.264 179.994 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 25' ' ' GLN . . . . . 0.508 ' NE2' ' CE1' ' A' ' 33' ' ' PHE . 0.0 OUTLIER -105.72 -20.19 13.53 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.18 -0.95 . . . . 0.0 110.34 179.84 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 26' ' ' GLN . . . . . 0.419 ' N ' ' HG3' ' A' ' 25' ' ' GLN . 0.9 OUTLIER 47.82 83.23 0.22 Allowed Pre-proline 0 N--CA 1.494 1.735 0 O-C-N 121.197 -0.939 . . . . 0.0 110.655 -179.983 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 46.1 Cg_endo -72.91 160.83 45.13 Favored 'Trans proline' 0 C--N 1.311 -1.416 0 O-C-N 123.749 1.394 . . . . 0.0 110.446 179.957 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 43.0 Cg_endo -69.52 -25.39 29.77 Favored 'Trans proline' 0 C--N 1.312 -1.367 0 O-C-N 123.653 1.344 . . . . 0.0 110.256 179.936 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 33.3 m-20 -148.9 114.03 5.49 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.418 -0.801 . . . . 0.0 109.935 179.851 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.673 HD11 HG11 ' A' ' 22' ' ' VAL . 0.1 OUTLIER -57.38 -52.2 66.31 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.33 -0.856 . . . . 0.0 110.11 -179.866 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.413 ' O ' HG23 ' A' ' 35' ' ' VAL . 60.8 t -49.01 -62.14 0.49 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.699 0 O-C-N 121.291 -0.881 . . . . 0.0 110.15 179.742 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -55.91 -36.49 67.74 Favored 'General case' 0 C--N 1.3 -1.565 0 O-C-N 121.548 -0.72 . . . . 0.0 109.658 179.491 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 33' ' ' PHE . . . . . 0.508 ' CE1' ' NE2' ' A' ' 25' ' ' GLN . 55.5 t80 -66.1 -50.53 63.73 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.269 -0.895 . . . . 0.0 109.537 179.393 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 34' ' ' ALA . . . . . 0.532 ' HB2' ' OH ' ' A' ' 18' ' ' TYR . . . -56.27 -38.51 71.29 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.397 -0.814 . . . . 0.0 109.798 179.535 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.543 HG13 ' OG1' ' B' ' 39' ' ' THR . 91.2 t -73.03 -34.57 46.05 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.339 0 O-C-N 121.373 -0.829 . . . . 0.0 109.993 179.782 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -80.43 -31.69 37.48 Favored 'General case' 0 C--N 1.303 -1.447 0 O-C-N 121.308 -0.87 . . . . 0.0 109.675 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 78.3 t80 -75.01 -65.3 0.89 Allowed 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.129 -0.982 . . . . 0.0 110.386 -179.859 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 12.9 m-85 -52.9 -49.56 65.69 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.228 -0.92 . . . . 0.0 110.626 -179.523 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' THR . . . . . 0.546 ' OG1' HG13 ' B' ' 35' ' ' VAL . 35.9 m -52.88 -37.71 60.81 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 120.989 -1.07 . . . . 0.0 110.037 179.944 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -72.35 -27.25 62.28 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.171 -0.955 . . . . 0.0 110.056 179.646 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 1.1 tt -65.35 -34.0 77.3 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.277 -0.89 . . . . 0.0 110.04 179.892 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.16 -24.15 62.8 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.299 -0.875 . . . . 0.0 109.894 179.72 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -76.7 -56.78 4.3 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.317 -0.864 . . . . 0.0 110.118 179.939 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.599 0 O-C-N 121.326 -0.859 . . . . 0.0 110.172 179.813 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 49.0 Cg_endo . . . . . 0 N--CA 1.485 1.013 0 N-CA-C 110.317 -0.686 . . . . 0.0 110.317 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' B' B ' 9' ' ' PRO . . . . . . . . . . . . . 49.5 Cg_endo -74.43 153.97 45.11 Favored 'Trans proline' 0 C--N 1.311 -1.397 0 O-C-N 123.497 1.261 . . . . 0.0 110.477 -179.968 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 111.58 -25.05 14.04 Favored Glycine 0 N--CA 1.49 2.292 0 N-CA-C 109.553 -1.419 . . . . 0.0 109.553 179.889 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -69.05 -22.91 64.0 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.224 -1.162 . . . . 0.0 110.214 -179.986 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 91.6 m -78.96 -35.11 43.65 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.159 -0.963 . . . . 0.0 110.281 -179.956 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 28.1 mt-10 -65.88 -44.25 85.88 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.191 -0.943 . . . . 0.0 110.389 -179.928 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -67.89 -32.87 73.65 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.239 -0.913 . . . . 0.0 110.545 -179.803 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 15' ' ' LEU . . . . . 0.533 HD21 HD12 ' A' ' 15' ' ' LEU . 2.5 mp -77.76 -42.32 34.51 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.192 -0.943 . . . . 0.0 110.559 -179.733 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 16' ' ' GLN . . . . . 0.735 ' O ' HG23 ' B' ' 20' ' ' VAL . 0.9 OUTLIER -53.16 -44.03 67.5 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.035 -1.041 . . . . 0.0 110.011 179.93 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 17' ' ' GLY . . . . . . . . . . . . . . . -62.26 -51.42 56.72 Favored Glycine 0 N--CA 1.489 2.2 0 N-CA-C 109.346 -1.502 . . . . 0.0 109.346 179.902 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 18' ' ' TYR . . . . . 0.564 ' O ' HG23 ' B' ' 22' ' ' VAL . 16.3 t80 -56.12 -33.78 65.46 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.341 -1.093 . . . . 0.0 110.279 179.895 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 62.6 m -71.55 -31.76 67.36 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.26 -0.9 . . . . 0.0 110.354 -179.887 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 20' ' ' VAL . . . . . 0.735 HG23 ' O ' ' B' ' 16' ' ' GLN . 48.6 t -75.14 -17.47 16.07 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.645 0 O-C-N 121.271 -0.893 . . . . 0.0 110.487 -179.885 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 21' ' ' GLU . . . . . 0.449 ' HG3' ' HA ' ' B' ' 18' ' ' TYR . 0.8 OUTLIER -89.15 -50.31 6.23 Favored 'General case' 0 N--CA 1.497 1.92 0 O-C-N 121.137 -0.977 . . . . 0.0 109.281 179.906 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 22' ' ' VAL . . . . . 0.564 HG23 ' O ' ' B' ' 18' ' ' TYR . 23.8 t -60.79 -24.59 32.81 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.515 0 O-C-N 121.776 -0.577 . . . . 0.0 110.323 -179.637 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 23' ' ' LEU . . . . . 0.476 HD23 ' HA ' ' B' ' 23' ' ' LEU . 6.8 mt -90.15 -31.65 16.99 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.214 -0.929 . . . . 0.0 110.492 -179.835 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -87.4 -51.71 5.79 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.189 -0.944 . . . . 0.0 110.591 -179.643 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 25' ' ' GLN . . . . . 0.425 ' O ' ' HG3' ' B' ' 26' ' ' GLN . 14.0 tp60 -85.15 -19.77 31.26 Favored 'General case' 0 N--CA 1.486 1.335 0 O-C-N 121.146 -0.971 . . . . 0.0 110.477 -179.557 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 26' ' ' GLN . . . . . 0.425 ' HG3' ' O ' ' B' ' 25' ' ' GLN . 9.0 pt20 36.26 74.82 0.55 Allowed Pre-proline 0 N--CA 1.507 2.376 0 O-C-N 121.81 -0.556 . . . . 0.0 111.893 -179.92 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 27' ' ' PRO . . . . . . . . . . . . . 44.4 Cg_endo -70.04 166.94 26.26 Favored 'Trans proline' 0 C--N 1.311 -1.429 0 O-C-N 123.532 1.28 . . . . 0.0 110.565 179.887 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 45.4 Cg_endo -71.79 -52.96 0.18 Allowed 'Trans proline' 0 C--N 1.313 -1.317 0 O-C-N 123.611 1.322 . . . . 0.0 110.551 -179.969 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -114.66 122.26 45.92 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.225 -0.922 . . . . 0.0 110.195 -179.899 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 3.8 tp -74.59 -39.44 62.2 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.194 -0.941 . . . . 0.0 110.264 179.957 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 86.2 t -49.73 -66.81 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.711 0 O-C-N 121.169 -0.957 . . . . 0.0 110.097 179.726 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 1.5 t0 -56.28 -38.44 71.19 Favored 'General case' 0 C--N 1.301 -1.536 0 O-C-N 121.626 -0.671 . . . . 0.0 110.101 179.744 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 33' ' ' PHE . . . . . . . . . . . . . 69.5 t80 -62.95 -44.38 96.22 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.215 -0.928 . . . . 0.0 109.845 179.747 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 34' ' ' ALA . . . . . 0.477 ' HB2' ' OH ' ' B' ' 18' ' ' TYR . . . -56.44 -31.93 64.42 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.206 -0.934 . . . . 0.0 109.78 179.65 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 35' ' ' VAL . . . . . 0.546 HG13 ' OG1' ' A' ' 39' ' ' THR . 89.9 t -73.91 -53.57 17.27 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.37 0 O-C-N 121.303 -0.873 . . . . 0.0 110.097 179.8 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -59.55 -24.75 63.97 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.342 -0.849 . . . . 0.0 110.491 -179.779 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 37' ' ' TYR . . . . . 0.432 ' CD2' ' CD1' ' B' ' 18' ' ' TYR . 14.2 t80 -78.66 -69.03 0.59 Allowed 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.191 -0.943 . . . . 0.0 110.54 -179.751 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 38' ' ' PHE . . . . . 0.411 ' HB2' HG22 ' A' ' 35' ' ' VAL . 26.0 m-85 -53.53 -39.24 64.53 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.2 -0.937 . . . . 0.0 110.165 -179.832 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 39' ' ' THR . . . . . 0.543 ' OG1' HG13 ' A' ' 35' ' ' VAL . 55.2 m -57.71 -49.91 74.97 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.145 -0.972 . . . . 0.0 109.901 179.835 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.0 -24.1 65.08 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.222 -0.924 . . . . 0.0 109.936 179.873 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -69.52 -31.48 69.74 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.352 -0.843 . . . . 0.0 110.128 179.807 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -74.26 -40.73 62.16 Favored 'General case' 0 C--N 1.305 -1.352 0 O-C-N 121.329 -0.857 . . . . 0.0 109.688 179.916 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 43' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 . . . . . 0 N--CA 1.492 1.627 0 O-C-N 121.329 -0.857 . . . . 0.0 110.36 179.838 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' C' C ' 2' ' ' LEU . . . . . 0.427 HD21 HD13 ' A' ' 23' ' ' LEU . 0.5 OUTLIER . . . . . 0 N--CA 1.492 1.654 0 CA-C-O 121.256 0.551 . . . . 0.0 110.159 . . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 3' ' ' ILE . . . . . . . . . . . . . 1.5 tt -70.09 -18.07 21.44 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.66 0 O-C-N 121.319 -0.863 . . . . 0.0 110.462 -179.878 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 4' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -78.95 -44.13 23.12 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.112 -0.993 . . . . 0.0 110.32 -179.861 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 5' ' ' THR . . . . . 0.509 HG23 ' N ' ' C' ' 6' ' ' ALA . 13.5 t -83.17 -41.83 18.01 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.269 -0.894 . . . . 0.0 110.211 -179.754 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 6' ' ' ALA . . . . . 0.509 ' N ' HG23 ' C' ' 5' ' ' THR . . . -54.58 -45.63 73.61 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.441 -0.787 . . . . 0.0 110.295 -179.998 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' C' C ' 7' ' ' SER . . . . . . . . . . . . . 61.4 p -75.69 -28.42 58.64 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.211 -0.931 . . . . 0.0 110.337 -179.944 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 8' ' ' SER . . . . . . . . . . . . . 12.6 t -79.5 -33.31 42.24 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.309 -0.869 . . . . 0.0 110.363 -179.953 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 9' ' ' LEU . . . . . . . . . . . . . 7.1 tt -66.52 -53.0 39.78 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.191 -0.943 . . . . 0.0 110.361 -179.83 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 10' ' ' VAL . . . . . . . . . . . . . 25.8 m -58.62 -26.15 30.48 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.693 0 O-C-N 121.282 -0.887 . . . . 0.0 110.291 -179.795 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 11' ' ' LYS . . . . . . . . . . . . . 1.2 ttmm -68.94 -52.39 29.72 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.328 -0.857 . . . . 0.0 110.311 -179.806 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' C' C ' 12' ' ' ASN . . . . . . . . . . . . . 13.8 t30 . . . . . 0 N--CA 1.491 1.622 0 O-C-N 121.195 -0.941 . . . . 0.0 110.513 -179.979 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.325 0 N-CA-C 109.63 -1.388 . . . . 0.0 109.63 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.466 HD21 HG11 ' B' ' 22' ' ' VAL . 0.1 OUTLIER -66.66 -32.48 73.83 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.218 -1.166 . . . . 0.0 110.242 179.997 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 12' ' ' THR . . . . . 0.408 HG23 HG11 ' C' ' 10' ' ' VAL . 65.9 m -57.42 -63.18 1.32 Allowed 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.268 -0.895 . . . . 0.0 110.355 -179.806 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -51.0 -41.15 59.58 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.295 -0.878 . . . . 0.0 110.533 -179.86 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -64.32 -42.79 96.15 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.317 -0.865 . . . . 0.0 110.28 -179.891 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.78 HD22 HD11 ' B' ' 15' ' ' LEU . 59.8 mt -70.24 -47.4 61.53 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.195 -0.941 . . . . 0.0 110.14 -179.934 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 16' ' ' GLN . . . . . 0.404 ' O ' HG23 ' A' ' 20' ' ' VAL . 0.0 OUTLIER -54.49 -39.91 68.0 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.158 -0.964 . . . . 0.0 109.947 179.882 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 17' ' ' GLY . . . . . 0.405 ' O ' ' HG3' ' A' ' 21' ' ' GLU . . . -57.04 -49.81 68.93 Favored Glycine 0 N--CA 1.49 2.266 0 N-CA-C 109.202 -1.559 . . . . 0.0 109.202 179.671 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 18' ' ' TYR . . . . . 0.603 ' O ' HG23 ' A' ' 22' ' ' VAL . 23.7 t80 -58.65 -21.39 53.88 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.358 -1.083 . . . . 0.0 110.109 179.729 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 1.3 m -82.77 -28.57 30.26 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.285 -0.884 . . . . 0.0 110.077 -179.992 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.404 HG23 ' O ' ' A' ' 16' ' ' GLN . 61.6 t -79.92 -18.1 12.6 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.701 0 O-C-N 121.356 -0.84 . . . . 0.0 110.294 179.997 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.405 ' HG3' ' O ' ' A' ' 17' ' ' GLY . 1.0 OUTLIER -90.79 -46.99 7.9 Favored 'General case' 0 N--CA 1.499 1.986 0 O-C-N 121.131 -0.981 . . . . 0.0 109.09 179.939 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.603 HG23 ' O ' ' A' ' 18' ' ' TYR . 86.1 t -59.71 -38.52 76.25 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.512 0 O-C-N 121.669 -0.644 . . . . 0.0 110.029 -179.976 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -75.87 -36.28 59.61 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.347 -0.846 . . . . 0.0 109.959 179.701 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.98 -26.12 53.54 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.288 -0.883 . . . . 0.0 110.233 179.928 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 73.4 mm-40 -97.96 -38.58 9.34 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.257 -0.902 . . . . 0.0 110.409 -179.856 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 1.7 mt-30 53.35 56.54 13.93 Favored Pre-proline 0 N--CA 1.492 1.634 0 O-C-N 121.247 -0.908 . . . . 0.0 110.028 -179.834 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 45.0 Cg_endo -71.09 156.9 58.96 Favored 'Trans proline' 0 C--N 1.312 -1.387 0 O-C-N 123.757 1.399 . . . . 0.0 110.606 -179.798 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 44.6 Cg_endo -70.93 -21.31 28.22 Favored 'Trans proline' 0 C--N 1.312 -1.371 0 O-C-N 123.768 1.404 . . . . 0.0 110.469 179.9 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 4.4 p-10 -139.36 123.61 18.03 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.28 -0.888 . . . . 0.0 110.204 179.987 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 5.3 tp -88.82 -31.04 18.52 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.2 -0.938 . . . . 0.0 110.125 179.851 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.435 HG23 ' H ' ' A' ' 31' ' ' VAL . 42.9 t -50.71 -58.4 1.83 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.769 0 O-C-N 121.27 -0.894 . . . . 0.0 110.124 179.865 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 8.0 t0 -64.23 -42.88 96.36 Favored 'General case' 0 C--N 1.302 -1.487 0 O-C-N 121.509 -0.745 . . . . 0.0 110.12 179.87 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 89.4 t80 -61.57 -40.32 94.31 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.212 -0.93 . . . . 0.0 109.904 179.722 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' ALA . . . . . 0.467 ' HB2' ' OH ' ' A' ' 18' ' ' TYR . . . -56.72 -37.28 70.74 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.279 -0.888 . . . . 0.0 110.204 179.905 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.467 HG13 ' OG1' ' B' ' 39' ' ' THR . 90.1 t -74.18 -37.79 46.93 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.346 0 O-C-N 121.277 -0.889 . . . . 0.0 110.403 -179.798 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -68.76 -37.95 79.74 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.187 -0.945 . . . . 0.0 110.507 -179.819 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 33.0 t80 -63.99 -56.76 12.74 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.222 -0.924 . . . . 0.0 110.592 -179.691 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 20.0 m-85 -68.15 -48.75 64.52 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.252 -0.905 . . . . 0.0 110.908 -179.391 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 39' ' ' THR . . . . . 0.508 ' OG1' HG13 ' B' ' 35' ' ' VAL . 55.5 m -52.17 -46.73 65.61 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.048 -1.033 . . . . 0.0 110.209 -179.786 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 7.1 ttt-85 -64.13 -29.0 70.15 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.199 -0.938 . . . . 0.0 110.018 179.83 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -64.82 -28.27 69.45 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.338 -0.851 . . . . 0.0 110.279 179.982 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.07 -22.02 62.17 Favored 'General case' 0 C--N 1.306 -1.307 0 O-C-N 121.212 -0.93 . . . . 0.0 109.853 179.871 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -106.8 -12.52 15.49 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.228 -0.92 . . . . 0.0 110.549 179.9 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.668 0 O-C-N 121.08 -1.012 . . . . 0.0 110.705 -179.782 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 48.8 Cg_endo . . . . . 0 N--CA 1.486 1.033 0 N-CA-C 110.614 -0.572 . . . . 0.0 110.614 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' B' B ' 9' ' ' PRO . . . . . . . . . . . . . 48.3 Cg_endo -75.14 -172.91 1.4 Allowed 'Trans proline' 0 C--N 1.312 -1.355 0 O-C-N 123.551 1.29 . . . . 0.0 110.33 179.797 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 94.37 -18.88 56.07 Favored Glycine 0 N--CA 1.491 2.335 0 N-CA-C 109.822 -1.311 . . . . 0.0 109.822 -179.963 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 11' ' ' LEU . . . . . 0.618 HD23 ' O ' ' B' ' 11' ' ' LEU . 3.3 tt -88.53 -19.32 26.53 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.183 -1.186 . . . . 0.0 110.367 -180.0 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 64.8 m -63.55 -50.55 69.05 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.193 -0.942 . . . . 0.0 110.398 -179.88 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -51.53 -34.52 36.67 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.302 -0.874 . . . . 0.0 110.34 -179.892 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -69.14 -55.69 9.92 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.294 -0.879 . . . . 0.0 110.145 179.983 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 15' ' ' LEU . . . . . 0.78 HD11 HD22 ' A' ' 15' ' ' LEU . 1.0 OUTLIER -55.35 -41.2 72.19 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.214 -0.929 . . . . 0.0 109.919 179.872 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 1.7 tt0 -59.29 -39.23 82.34 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.233 -0.917 . . . . 0.0 109.734 179.679 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 17' ' ' GLY . . . . . . . . . . . . . . . -62.39 -39.67 98.07 Favored Glycine 0 N--CA 1.489 2.225 0 N-CA-C 109.152 -1.579 . . . . 0.0 109.152 179.621 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 18' ' ' TYR . . . . . 0.607 ' OH ' ' HB2' ' B' ' 34' ' ' ALA . 16.8 t80 -71.56 -43.91 65.5 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.261 -1.14 . . . . 0.0 109.935 179.676 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 10.3 m -53.55 -35.42 60.72 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.346 -0.846 . . . . 0.0 109.919 179.683 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 42.2 t -69.76 -73.62 0.1 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.614 0 O-C-N 121.364 -0.835 . . . . 0.0 109.904 179.769 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 7.8 pt-20 -46.75 -42.96 17.66 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.449 -0.782 . . . . 0.0 110.912 -179.752 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 22' ' ' VAL . . . . . 0.51 HG23 ' O ' ' B' ' 18' ' ' TYR . 55.1 t -57.47 -36.25 52.71 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.622 0 O-C-N 121.108 -0.995 . . . . 0.0 109.506 179.445 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 8.2 tp -89.47 -22.32 22.54 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.347 -0.846 . . . . 0.0 109.964 179.612 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -86.85 -61.89 1.63 Allowed 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.268 -0.895 . . . . 0.0 110.139 179.782 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 29.5 mm-40 -58.84 -33.09 70.03 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.313 -0.867 . . . . 0.0 110.271 179.968 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER 49.7 59.92 16.05 Favored Pre-proline 0 N--CA 1.492 1.656 0 O-C-N 121.326 -0.859 . . . . 0.0 110.411 -179.903 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 27' ' ' PRO . . . . . . . . . . . . . 45.3 Cg_endo -71.52 158.52 53.67 Favored 'Trans proline' 0 C--N 1.311 -1.446 0 O-C-N 123.81 1.427 . . . . 0.0 110.523 -179.859 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 44.0 Cg_endo -70.16 -37.9 7.6 Favored 'Trans proline' 0 C--N 1.311 -1.435 0 O-C-N 123.704 1.371 . . . . 0.0 110.113 179.769 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -127.47 119.35 25.9 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.286 -0.884 . . . . 0.0 109.924 179.677 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 5.0 tp -73.49 -29.85 62.77 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.249 -0.907 . . . . 0.0 110.299 -179.731 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 42.0 t -52.19 -64.79 0.34 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.664 0 O-C-N 121.177 -0.952 . . . . 0.0 110.052 179.749 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 11.8 t0 -56.7 -42.6 79.41 Favored 'General case' 0 C--N 1.302 -1.458 0 O-C-N 121.444 -0.785 . . . . 0.0 110.171 179.806 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 33' ' ' PHE . . . . . . . . . . . . . 22.9 t80 -60.06 -53.58 56.1 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.163 -0.96 . . . . 0.0 109.783 179.497 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 34' ' ' ALA . . . . . 0.607 ' HB2' ' OH ' ' B' ' 18' ' ' TYR . . . -51.01 -33.31 24.39 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.369 -0.832 . . . . 0.0 110.296 179.679 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 35' ' ' VAL . . . . . 0.508 HG13 ' OG1' ' A' ' 39' ' ' THR . 88.9 t -79.44 -41.54 22.51 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.406 0 O-C-N 121.166 -0.959 . . . . 0.0 110.222 179.946 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -66.51 -39.04 88.47 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.307 -0.871 . . . . 0.0 110.548 -179.783 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 37' ' ' TYR . . . . . . . . . . . . . 61.1 t80 -67.14 -66.72 0.52 Allowed 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.136 -0.978 . . . . 0.0 110.423 -179.691 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 10.6 m-85 -51.26 -48.84 62.08 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.142 -0.974 . . . . 0.0 110.519 -179.586 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 39' ' ' THR . . . . . 0.467 ' OG1' HG13 ' A' ' 35' ' ' VAL . 45.6 m -53.75 -32.44 52.27 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.096 -1.003 . . . . 0.0 109.905 179.961 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -76.14 -30.5 58.18 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.174 -0.954 . . . . 0.0 109.775 179.589 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -61.9 -28.64 69.65 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.318 -0.864 . . . . 0.0 109.823 179.563 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.43 -22.11 65.53 Favored 'General case' 0 C--N 1.304 -1.391 0 O-C-N 121.363 -0.836 . . . . 0.0 109.91 179.793 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 43' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.491 1.608 0 O-C-N 121.27 -0.894 . . . . 0.0 110.198 -179.884 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 2' ' ' LEU . . . . . . . . . . . . . 1.1 pp . . . . . 0 N--CA 1.492 1.633 0 CA-C-O 121.31 0.576 . . . . 0.0 110.155 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' C' C ' 3' ' ' ILE . . . . . . . . . . . . . 5.3 mt -58.28 -58.05 8.17 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.64 0 O-C-N 121.295 -0.878 . . . . 0.0 110.176 179.912 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 4' ' ' GLU . . . . . . . . . . . . . 6.8 tm-20 -53.36 -41.18 65.56 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.204 -0.935 . . . . 0.0 109.968 179.976 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 5' ' ' THR . . . . . . . . . . . . . 1.3 m -63.32 -34.08 76.91 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.289 -0.882 . . . . 0.0 109.892 179.886 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 6' ' ' ALA . . . . . . . . . . . . . . . -75.77 -32.62 60.02 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.281 -0.887 . . . . 0.0 110.101 179.934 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 7' ' ' SER . . . . . . . . . . . . . 27.8 t -68.6 -34.53 75.93 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.192 -0.943 . . . . 0.0 110.187 179.899 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 8' ' ' SER . . . . . . . . . . . . . 46.7 t -67.94 -32.96 73.77 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.341 -0.85 . . . . 0.0 110.285 179.89 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' C' C ' 9' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -68.35 -36.02 78.62 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.176 -0.952 . . . . 0.0 110.17 179.919 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 10' ' ' VAL . . . . . 0.408 HG11 HG23 ' A' ' 12' ' ' THR . 95.0 t -57.53 -44.25 84.59 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 O-C-N 121.293 -0.879 . . . . 0.0 110.125 -179.978 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.18 -55.38 34.54 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.377 -0.827 . . . . 0.0 110.192 179.951 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' C' C ' 12' ' ' ASN . . . . . . . . . . . . . 1.2 m-80 . . . . . 0 N--CA 1.491 1.599 0 O-C-N 121.289 -0.882 . . . . 0.0 110.384 -179.877 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.294 0 N-CA-C 109.528 -1.429 . . . . 0.0 109.528 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 11.6 tp -52.88 -46.39 67.9 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.282 -1.128 . . . . 0.0 110.066 179.869 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 98.2 m -59.19 -47.07 86.68 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.193 -0.942 . . . . 0.0 110.151 179.864 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.6 tm-20 -57.47 -29.23 64.07 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.232 -0.917 . . . . 0.0 110.057 179.846 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.672 HD21 ' CE1' ' A' ' 38' ' ' PHE . 4.0 tt -78.41 -44.56 24.51 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.267 -0.895 . . . . 0.0 110.242 179.924 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.638 HD22 HD11 ' B' ' 15' ' ' LEU . 98.4 mt -70.39 -50.53 37.78 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.288 -0.883 . . . . 0.0 110.271 -179.859 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 1.2 tt0 -53.3 -46.81 69.53 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.164 -0.96 . . . . 0.0 110.052 179.959 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -56.89 -40.35 90.08 Favored Glycine 0 N--CA 1.491 2.301 0 N-CA-C 109.137 -1.585 . . . . 0.0 109.137 179.613 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' TYR . . . . . 0.605 ' O ' HG23 ' A' ' 22' ' ' VAL . 22.8 t80 -66.64 -44.74 81.16 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.309 -1.113 . . . . 0.0 109.812 179.668 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 52.4 m -57.3 -26.85 61.54 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.366 -0.834 . . . . 0.0 109.902 179.632 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 44.2 t -73.53 -72.27 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.569 0 O-C-N 121.381 -0.824 . . . . 0.0 110.258 179.995 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.443 ' OE2' ' CD1' ' A' ' 37' ' ' TYR . 10.1 pt-20 -46.42 -43.56 16.5 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.39 -0.819 . . . . 0.0 111.144 -179.476 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.605 HG23 ' O ' ' A' ' 18' ' ' TYR . 99.6 t -58.52 -37.34 64.08 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.657 0 O-C-N 120.914 -1.116 . . . . 0.0 110.004 179.955 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.487 HD13 ' HG ' ' C' ' 2' ' ' LEU . 0.4 OUTLIER -78.57 -20.63 50.12 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.362 -0.836 . . . . 0.0 110.298 179.939 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -95.23 -58.33 2.17 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.284 -0.885 . . . . 0.0 110.462 -179.736 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 25' ' ' GLN . . . . . 0.43 ' O ' ' CG ' ' A' ' 26' ' ' GLN . 7.9 mp0 -63.11 -22.34 66.79 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.218 -0.926 . . . . 0.0 110.531 -179.73 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 26' ' ' GLN . . . . . 0.43 ' CG ' ' O ' ' A' ' 25' ' ' GLN . 3.4 pt20 36.49 59.24 3.46 Favored Pre-proline 0 N--CA 1.505 2.279 0 O-C-N 122.013 -0.429 . . . . 0.0 111.589 -179.9 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo -69.95 161.22 46.78 Favored 'Trans proline' 0 C--N 1.31 -1.459 0 O-C-N 123.796 1.419 . . . . 0.0 110.763 -179.735 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 43.4 Cg_endo -69.81 -46.34 1.24 Allowed 'Trans proline' 0 C--N 1.311 -1.398 0 O-C-N 123.84 1.442 . . . . 0.0 110.33 179.975 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -120.54 116.45 25.4 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.355 -0.84 . . . . 0.0 110.048 179.86 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 6.7 tp -70.22 -30.8 67.98 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.391 -0.818 . . . . 0.0 110.273 -179.992 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.416 HG23 ' H ' ' A' ' 31' ' ' VAL . 41.5 t -51.3 -64.8 0.31 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.663 0 O-C-N 121.239 -0.913 . . . . 0.0 109.956 179.929 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 1.4 t0 -55.3 -39.36 69.8 Favored 'General case' 0 C--N 1.302 -1.467 0 O-C-N 121.429 -0.794 . . . . 0.0 110.022 179.654 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' PHE . . . . . 0.401 ' CZ ' ' OE2' ' A' ' 21' ' ' GLU . 66.4 t80 -62.35 -44.69 95.89 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.267 -0.896 . . . . 0.0 109.876 179.63 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 34' ' ' ALA . . . . . 0.463 ' HB2' ' OH ' ' A' ' 18' ' ' TYR . . . -59.34 -42.9 92.58 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.31 -0.868 . . . . 0.0 110.116 179.887 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.508 HG13 ' OG1' ' B' ' 39' ' ' THR . 71.9 t -73.09 -24.39 20.8 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.382 0 O-C-N 121.209 -0.932 . . . . 0.0 109.977 179.903 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -80.98 -36.64 30.51 Favored 'General case' 0 C--N 1.304 -1.398 0 O-C-N 121.288 -0.883 . . . . 0.0 109.793 -179.911 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' TYR . . . . . 0.443 ' CD1' ' OE2' ' A' ' 21' ' ' GLU . 61.4 t80 -74.94 -61.28 1.94 Allowed 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.15 -0.969 . . . . 0.0 110.318 -179.826 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 38' ' ' PHE . . . . . 0.672 ' CE1' HD21 ' A' ' 14' ' ' LEU . 14.9 m-85 -52.15 -51.36 58.47 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.316 -0.865 . . . . 0.0 110.415 -179.925 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 39' ' ' THR . . . . . 0.507 ' OG1' HG13 ' B' ' 35' ' ' VAL . 21.2 m -51.91 -43.25 63.32 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.189 -0.944 . . . . 0.0 110.069 179.914 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.73 -30.52 70.03 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.232 -0.918 . . . . 0.0 110.14 179.829 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -57.86 -36.5 72.44 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.235 -0.916 . . . . 0.0 109.966 179.917 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 8.4 mtm180 -50.61 -26.86 5.86 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.321 -0.862 . . . . 0.0 109.933 179.563 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 43' ' ' GLU . . . . . 0.604 ' O ' ' HB3' ' A' ' 44' ' ' ALA . 1.4 mm-40 -104.16 -61.22 1.47 Allowed 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.501 -0.749 . . . . 0.0 109.855 179.679 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 44' ' ' ALA . . . . . 0.604 ' HB3' ' O ' ' A' ' 43' ' ' GLU . . . . . . . . 0 N--CA 1.501 2.104 0 O-C-N 121.525 -0.734 . . . . 0.0 110.78 179.816 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 48.8 Cg_endo . . . . . 0 N--CA 1.482 0.806 0 N-CA-C 110.32 -0.684 . . . . 0.0 110.32 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' B' B ' 9' ' ' PRO . . . . . . . . . . . . . 46.1 Cg_endo -73.27 153.83 51.18 Favored 'Trans proline' 0 C--N 1.312 -1.36 0 O-C-N 123.535 1.282 . . . . 0.0 110.396 -179.854 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 117.76 -23.38 9.5 Favored Glycine 0 N--CA 1.49 2.282 0 N-CA-C 109.508 -1.437 . . . . 0.0 109.508 -179.863 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 11' ' ' LEU . . . . . 0.432 HD21 HG11 ' A' ' 22' ' ' VAL . 0.2 OUTLIER -73.5 -46.74 46.11 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.229 -1.16 . . . . 0.0 110.215 -179.961 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 95.6 m -54.78 -30.0 55.72 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.156 -0.965 . . . . 0.0 110.138 -179.955 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 4.4 tt0 -64.59 -48.77 73.71 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.314 -0.866 . . . . 0.0 110.18 179.999 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -68.82 -31.02 69.7 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.3 -0.875 . . . . 0.0 110.23 179.901 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 15' ' ' LEU . . . . . 0.638 HD11 HD22 ' A' ' 15' ' ' LEU . 2.1 mm? -65.27 -55.38 18.69 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.223 -0.923 . . . . 0.0 110.254 -179.978 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -53.11 -45.16 68.16 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.26 -0.9 . . . . 0.0 110.177 179.837 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 17' ' ' GLY . . . . . . . . . . . . . . . -56.35 -36.88 71.22 Favored Glycine 0 N--CA 1.49 2.285 0 N-CA-C 109.256 -1.538 . . . . 0.0 109.256 179.733 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 18' ' ' TYR . . . . . . . . . . . . . 38.5 t80 -73.41 -44.88 57.47 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.386 -1.067 . . . . 0.0 110.063 179.811 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 19' ' ' THR . . . . . 0.801 ' O ' HD23 ' B' ' 23' ' ' LEU . 52.2 m -57.28 -23.31 47.55 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.239 -0.913 . . . . 0.0 110.05 179.923 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 37.6 t -78.58 -70.34 0.38 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.649 0 O-C-N 121.409 -0.807 . . . . 0.0 110.143 -179.982 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 21' ' ' GLU . . . . . 0.444 ' HG3' HG23 ' B' ' 22' ' ' VAL . 10.2 pt-20 -44.58 -42.81 7.63 Favored 'General case' 0 N--CA 1.497 1.906 0 O-C-N 121.514 -0.741 . . . . 0.0 111.065 -179.507 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 22' ' ' VAL . . . . . 0.444 HG23 ' HG3' ' B' ' 21' ' ' GLU . 84.7 t -66.23 -34.59 71.21 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.551 0 O-C-N 121.051 -1.031 . . . . 0.0 109.64 179.556 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 23' ' ' LEU . . . . . 0.801 HD23 ' O ' ' B' ' 19' ' ' THR . 1.8 mm? -75.47 -28.72 59.36 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.342 -0.849 . . . . 0.0 109.923 179.802 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -90.58 -65.2 1.04 Allowed 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.377 -0.827 . . . . 0.0 110.187 -179.876 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 25' ' ' GLN . . . . . 0.446 ' CG ' ' O ' ' B' ' 25' ' ' GLN . 1.9 tt0 -85.29 56.56 4.0 Favored 'General case' 0 C--N 1.305 -1.35 0 O-C-N 121.114 -0.991 . . . . 0.0 109.845 179.911 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 10.1 mt-30 -38.29 98.8 0.17 Allowed Pre-proline 0 N--CA 1.499 1.986 0 O-C-N 121.896 -0.503 . . . . 0.0 111.56 -179.717 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 27' ' ' PRO . . . . . . . . . . . . . 47.3 Cg_endo -74.26 160.05 42.86 Favored 'Trans proline' 0 C--N 1.311 -1.421 0 O-C-N 123.909 1.478 . . . . 0.0 110.41 -179.909 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 44.4 Cg_endo -71.39 -28.16 18.41 Favored 'Trans proline' 0 C--N 1.312 -1.363 0 O-C-N 123.677 1.356 . . . . 0.0 109.967 179.691 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -146.59 112.38 5.67 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.392 -0.818 . . . . 0.0 109.926 179.695 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 30' ' ' LEU . . . . . 0.471 HD23 HD13 ' A' ' 14' ' ' LEU . 1.7 tp -57.09 -33.74 67.61 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.226 -0.921 . . . . 0.0 109.882 -179.994 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 47.5 t -53.55 -55.9 11.13 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.653 0 O-C-N 121.353 -0.842 . . . . 0.0 109.898 179.59 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -65.21 -40.35 94.03 Favored 'General case' 0 C--N 1.301 -1.506 0 O-C-N 121.58 -0.7 . . . . 0.0 110.191 -179.93 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 33' ' ' PHE . . . . . 0.443 ' CE2' HG22 ' B' ' 22' ' ' VAL . 79.3 t80 -63.83 -43.29 96.64 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.214 -0.928 . . . . 0.0 109.757 179.642 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -59.01 -38.69 79.8 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.31 -0.868 . . . . 0.0 110.109 179.846 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 35' ' ' VAL . . . . . 0.507 HG13 ' OG1' ' A' ' 39' ' ' THR . 70.7 t -79.84 -25.57 12.1 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.358 0 O-C-N 121.245 -0.909 . . . . 0.0 109.901 179.791 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -81.88 -36.83 27.76 Favored 'General case' 0 C--N 1.304 -1.391 0 O-C-N 121.297 -0.877 . . . . 0.0 110.112 -179.791 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 37' ' ' TYR . . . . . 0.429 ' CZ ' ' OE1' ' B' ' 21' ' ' GLU . 87.5 t80 -76.1 -59.52 2.73 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.043 -1.036 . . . . 0.0 110.629 -179.658 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 38' ' ' PHE . . . . . 0.457 ' HB3' ' CG2' ' A' ' 35' ' ' VAL . 4.3 m-85 -55.48 -46.38 76.87 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.232 -0.917 . . . . 0.0 110.655 -179.554 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 39' ' ' THR . . . . . 0.508 ' OG1' HG13 ' A' ' 35' ' ' VAL . 8.7 m -53.23 -48.73 67.94 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 120.939 -1.101 . . . . 0.0 109.975 179.993 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -55.74 -42.46 75.43 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.222 -0.924 . . . . 0.0 110.255 179.989 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 1.6 mt -54.56 -40.96 69.25 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.206 -0.934 . . . . 0.0 109.913 179.75 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.16 -25.46 67.77 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.233 -0.917 . . . . 0.0 109.907 179.79 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 43' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 . . . . . 0 N--CA 1.491 1.614 0 O-C-N 121.364 -0.835 . . . . 0.0 110.103 179.798 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' C' C ' 2' ' ' LEU . . . . . 0.487 ' HG ' HD13 ' A' ' 23' ' ' LEU . 0.6 OUTLIER . . . . . 0 N--CA 1.501 2.111 0 CA-C-O 121.191 0.519 . . . . 0.0 110.419 . . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 3' ' ' ILE . . . . . . . . . . . . . 49.3 mm -66.3 -53.93 31.57 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.636 0 O-C-N 121.078 -1.014 . . . . 0.0 110.254 -179.895 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 4' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -51.77 -38.03 53.85 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.248 -0.908 . . . . 0.0 110.327 -179.981 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 5' ' ' THR . . . . . . . . . . . . . 93.1 m -72.62 -48.42 39.75 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.387 -0.821 . . . . 0.0 110.364 -179.921 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 6' ' ' ALA . . . . . 0.433 ' O ' HG12 ' C' ' 10' ' ' VAL . . . -56.35 -25.65 49.99 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.254 -0.903 . . . . 0.0 110.477 -179.781 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 7' ' ' SER . . . . . . . . . . . . . 63.1 m -83.79 -39.12 20.41 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.124 -0.985 . . . . 0.0 110.267 -179.897 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 8' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -75.39 -37.43 60.52 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.18 -0.95 . . . . 0.0 110.107 179.923 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 9' ' ' LEU . . . . . . . . . . . . . 2.6 tp -66.34 -56.68 9.96 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.246 -0.909 . . . . 0.0 110.065 179.85 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 10' ' ' VAL . . . . . 0.433 HG12 ' O ' ' C' ' 6' ' ' ALA . 10.9 p -51.64 -28.38 8.9 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.597 0 O-C-N 121.309 -0.869 . . . . 0.0 110.405 179.966 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' C' C ' 11' ' ' LYS . . . . . . . . . . . . . 8.9 mttm -67.98 -49.0 64.25 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.266 -0.897 . . . . 0.0 110.269 179.969 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' C' C ' 12' ' ' ASN . . . . . . . . . . . . . 28.4 m-20 . . . . . 0 N--CA 1.492 1.65 0 O-C-N 121.269 -0.895 . . . . 0.0 110.761 179.985 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.314 0 N-CA-C 109.807 -1.317 . . . . 0.0 109.807 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.46 HD11 HD13 ' B' ' 30' ' ' LEU . 1.7 mp -84.36 -24.36 29.74 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.152 -1.205 . . . . 0.0 110.492 -179.739 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 71.5 m -54.8 -57.14 12.77 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.153 -0.967 . . . . 0.0 110.589 -179.754 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -56.94 -48.71 77.65 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.276 -0.89 . . . . 0.0 110.631 -179.593 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.617 HD22 ' CD2' ' B' ' 30' ' ' LEU . 3.5 tp -50.75 -58.13 6.66 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.277 -0.889 . . . . 0.0 110.692 -179.489 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 2.4 mp -56.36 -49.41 74.49 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.199 -0.938 . . . . 0.0 110.389 -179.752 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' GLN . . . . . 0.65 ' OE1' HG21 ' C' ' 10' ' ' VAL . 0.9 OUTLIER -50.41 -49.15 55.44 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.185 -0.947 . . . . 0.0 110.324 179.981 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -55.25 -38.84 69.24 Favored Glycine 0 N--CA 1.491 2.333 0 N-CA-C 109.055 -1.618 . . . . 0.0 109.055 179.658 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' TYR . . . . . 0.763 ' O ' HG23 ' A' ' 22' ' ' VAL . 24.7 t80 -67.42 -50.65 58.53 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.407 -1.055 . . . . 0.0 109.708 179.492 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 70.9 m -57.01 -32.83 66.54 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.282 -0.886 . . . . 0.0 109.807 179.621 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.571 HG23 ' O ' ' A' ' 16' ' ' GLN . 44.8 t -63.46 -73.76 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.545 0 O-C-N 121.357 -0.839 . . . . 0.0 110.22 179.959 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.414 ' OE1' ' CE1' ' A' ' 37' ' ' TYR . 10.3 pt-20 -45.06 -43.26 9.3 Favored 'General case' 0 N--CA 1.498 1.931 0 O-C-N 121.461 -0.774 . . . . 0.0 111.035 -179.575 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.763 HG23 ' O ' ' A' ' 18' ' ' TYR . 94.6 t -51.92 -53.84 15.99 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.713 0 O-C-N 121.1 -1.0 . . . . 0.0 110.144 179.888 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.434 HD22 HD21 ' C' ' 2' ' ' LEU . 0.9 OUTLIER -56.81 -35.27 68.57 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.271 -0.893 . . . . 0.0 110.115 179.874 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 1.4 mmt180 -77.34 -62.9 1.5 Allowed 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.31 -0.869 . . . . 0.0 110.331 -179.925 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 34.9 mm-40 -57.84 -39.34 77.45 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.218 -0.926 . . . . 0.0 110.26 -179.955 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 51.79 56.93 16.34 Favored Pre-proline 0 N--CA 1.492 1.661 0 O-C-N 121.235 -0.916 . . . . 0.0 110.102 -179.794 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 43.8 Cg_endo -70.06 161.06 47.39 Favored 'Trans proline' 0 C--N 1.311 -1.403 0 O-C-N 123.735 1.387 . . . . 0.0 110.51 -179.996 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 45.4 Cg_endo -71.5 -34.04 10.0 Favored 'Trans proline' 0 C--N 1.311 -1.401 0 O-C-N 123.694 1.365 . . . . 0.0 110.23 -179.976 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -130.12 119.45 23.04 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.325 -0.859 . . . . 0.0 110.264 -179.847 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 5.3 tp -75.28 -35.57 61.29 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.342 -0.848 . . . . 0.0 109.816 179.802 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.611 HG12 ' HD2' ' B' ' 42' ' ' ARG . 44.9 t -51.55 -59.18 1.46 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.695 0 O-C-N 121.279 -0.888 . . . . 0.0 109.855 179.564 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 6.0 t0 -58.55 -40.1 82.08 Favored 'General case' 0 C--N 1.301 -1.529 0 O-C-N 121.683 -0.636 . . . . 0.0 109.932 179.753 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 42.4 t80 -62.05 -48.78 78.7 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.157 -0.965 . . . . 0.0 109.511 179.448 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' ALA . . . . . 0.627 ' HB2' ' OH ' ' A' ' 18' ' ' TYR . . . -52.97 -38.2 61.94 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.389 -0.819 . . . . 0.0 110.121 179.716 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.546 HG13 ' OG1' ' B' ' 39' ' ' THR . 97.1 t -70.06 -35.73 65.24 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.367 0 O-C-N 121.25 -0.906 . . . . 0.0 110.174 -179.958 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -83.14 -20.17 35.28 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.294 -0.879 . . . . 0.0 110.444 -179.989 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' TYR . . . . . 0.414 ' CE1' ' OE1' ' A' ' 21' ' ' GLU . 33.7 t80 -73.31 -62.21 1.55 Allowed 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.205 -0.935 . . . . 0.0 110.565 -179.665 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 38' ' ' PHE . . . . . 0.45 ' CE1' HD21 ' A' ' 14' ' ' LEU . 29.3 m-85 -67.18 -45.21 77.63 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.204 -0.935 . . . . 0.0 110.644 -179.571 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 39' ' ' THR . . . . . 0.542 ' OG1' HG13 ' B' ' 35' ' ' VAL . 42.7 m -52.53 -39.28 61.21 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.156 -0.965 . . . . 0.0 110.252 -179.939 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 3.6 mtp85 -74.37 -34.59 63.41 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.204 -0.935 . . . . 0.0 110.008 179.773 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 10.5 tp -65.97 -19.95 66.04 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.38 -0.825 . . . . 0.0 110.396 -179.939 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -82.69 -21.91 34.73 Favored 'General case' 0 C--N 1.305 -1.367 0 O-C-N 121.139 -0.976 . . . . 0.0 109.915 179.977 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 12.2 mt-10 -104.21 -4.99 22.35 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.194 -0.941 . . . . 0.0 110.816 -179.983 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.652 0 O-C-N 120.933 -1.104 . . . . 0.0 110.318 179.93 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 45.0 Cg_endo . . . . . 0 N--CA 1.485 1.027 0 N-CA-C 110.628 -0.566 . . . . 0.0 110.628 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' B' B ' 9' ' ' PRO . . . . . . . . . . . . . 47.9 Cg_endo -73.72 156.82 48.68 Favored 'Trans proline' 0 C--N 1.312 -1.369 0 O-C-N 123.654 1.344 . . . . 0.0 110.248 179.675 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 135.25 -31.27 2.71 Favored Glycine 0 N--CA 1.49 2.28 0 N-CA-C 109.606 -1.398 . . . . 0.0 109.606 179.884 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 1.8 mp -78.32 -22.96 47.32 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.276 -1.132 . . . . 0.0 110.151 179.941 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 89.3 m -54.4 -42.15 70.08 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.378 -0.826 . . . . 0.0 110.302 179.985 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -79.4 -36.09 39.68 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.282 -0.886 . . . . 0.0 110.274 179.976 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 2.8 tp -65.2 -49.95 67.78 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.235 -0.916 . . . . 0.0 110.151 -179.994 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 6.0 mp -62.78 -50.29 71.62 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.319 -0.863 . . . . 0.0 110.391 -179.971 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 16' ' ' GLN . . . . . 0.713 ' O ' HG23 ' B' ' 20' ' ' VAL . 1.1 mt-30 -52.04 -40.5 61.18 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.153 -0.967 . . . . 0.0 110.139 179.972 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 17' ' ' GLY . . . . . . . . . . . . . . . -57.6 -51.67 56.51 Favored Glycine 0 N--CA 1.491 2.301 0 N-CA-C 109.169 -1.572 . . . . 0.0 109.169 179.649 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 18' ' ' TYR . . . . . 0.904 ' OH ' ' HB2' ' B' ' 34' ' ' ALA . 12.0 t80 -54.04 -38.99 65.8 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.369 -1.077 . . . . 0.0 110.19 179.891 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 51.9 m -71.03 -32.94 69.84 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.391 -0.818 . . . . 0.0 110.307 -179.862 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 20' ' ' VAL . . . . . 0.713 HG23 ' O ' ' B' ' 16' ' ' GLN . 90.3 t -70.1 -17.38 20.91 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.625 0 O-C-N 121.216 -0.927 . . . . 0.0 110.473 -179.892 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 21' ' ' GLU . . . . . 0.472 ' OE1' ' CD1' ' B' ' 37' ' ' TYR . 0.7 OUTLIER -92.23 -57.79 2.59 Favored 'General case' 0 N--CA 1.497 1.905 0 O-C-N 121.09 -1.006 . . . . 0.0 109.439 -179.927 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 22' ' ' VAL . . . . . . . . . . . . . 96.5 t -49.85 -26.34 2.76 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.528 0 O-C-N 121.565 -0.71 . . . . 0.0 110.476 -179.952 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 1.2 mt -84.78 -47.34 10.49 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.214 -0.929 . . . . 0.0 110.076 179.722 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.47 -66.6 0.64 Allowed 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.205 -0.934 . . . . 0.0 110.178 179.82 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 25' ' ' GLN . . . . . 0.429 ' O ' ' CG ' ' B' ' 25' ' ' GLN . 0.2 OUTLIER -91.68 59.69 3.8 Favored 'General case' 0 C--N 1.306 -1.292 0 O-C-N 121.039 -1.038 . . . . 0.0 109.917 179.903 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 21.2 mt-30 -38.42 98.63 0.17 Allowed Pre-proline 0 N--CA 1.5 2.056 0 O-C-N 122.042 -0.411 . . . . 0.0 111.676 -179.646 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 27' ' ' PRO . . . . . 0.515 ' HG3' ' CD2' ' B' ' 33' ' ' PHE . 49.4 Cg_endo -77.42 163.66 29.57 Favored 'Trans proline' 0 C--N 1.311 -1.422 0 O-C-N 123.821 1.432 . . . . 0.0 110.55 -179.986 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 45.1 Cg_endo -71.84 -52.65 0.19 Allowed 'Trans proline' 0 C--N 1.313 -1.34 0 O-C-N 123.679 1.357 . . . . 0.0 110.745 -179.946 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 58.0 m-20 -117.53 116.83 27.89 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.12 -0.988 . . . . 0.0 110.31 -179.826 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 30' ' ' LEU . . . . . 0.617 ' CD2' HD22 ' A' ' 14' ' ' LEU . 0.5 OUTLIER -60.5 -45.49 93.59 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.28 -0.888 . . . . 0.0 110.169 179.991 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 31' ' ' VAL . . . . . 0.504 ' O ' HG23 ' B' ' 35' ' ' VAL . 43.5 t -50.6 -63.05 0.44 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.761 0 O-C-N 121.233 -0.917 . . . . 0.0 109.964 179.737 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 4.8 t0 -57.92 -33.37 68.72 Favored 'General case' 0 C--N 1.303 -1.43 0 O-C-N 121.477 -0.764 . . . . 0.0 109.855 179.711 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 33' ' ' PHE . . . . . 0.515 ' CD2' ' HG3' ' B' ' 27' ' ' PRO . 32.7 t80 -67.24 -51.32 54.56 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.316 -0.865 . . . . 0.0 109.477 179.38 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 34' ' ' ALA . . . . . 0.904 ' HB2' ' OH ' ' B' ' 18' ' ' TYR . . . -54.05 -32.14 53.67 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.399 -0.813 . . . . 0.0 109.961 179.698 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 35' ' ' VAL . . . . . 0.542 HG13 ' OG1' ' A' ' 39' ' ' THR . 87.5 t -71.8 -38.19 64.69 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.355 0 O-C-N 121.277 -0.889 . . . . 0.0 110.117 -179.981 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -73.45 -34.36 65.36 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.182 -0.949 . . . . 0.0 110.23 179.922 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 37' ' ' TYR . . . . . 0.472 ' CD1' ' OE1' ' B' ' 21' ' ' GLU . 19.1 t80 -70.57 -66.62 0.58 Allowed 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.24 -0.913 . . . . 0.0 110.328 -179.945 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 24.8 m-85 -51.36 -53.49 35.78 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.24 -0.912 . . . . 0.0 110.428 -179.877 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 39' ' ' THR . . . . . 0.546 ' OG1' HG13 ' A' ' 35' ' ' VAL . 51.6 m -51.27 -30.88 19.25 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.152 -0.968 . . . . 0.0 110.006 179.79 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -82.83 -28.19 30.33 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.306 -0.871 . . . . 0.0 109.799 179.642 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -54.09 -43.87 70.71 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.4 -0.813 . . . . 0.0 110.094 179.817 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 42' ' ' ARG . . . . . 0.611 ' HD2' HG12 ' A' ' 31' ' ' VAL . 0.0 OUTLIER -51.9 -30.3 23.62 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.27 -0.894 . . . . 0.0 110.645 -179.733 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 43' ' ' GLU . . . . . . . . . . . . . 18.4 mm-40 . . . . . 0 N--CA 1.493 1.687 0 O-C-N 121.126 -0.984 . . . . 0.0 110.803 -179.738 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' C' C ' 2' ' ' LEU . . . . . 0.434 HD21 HD22 ' A' ' 23' ' ' LEU . 0.5 OUTLIER . . . . . 0 N--CA 1.499 2.013 0 CA-C-O 121.086 0.47 . . . . 0.0 110.528 . . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 3' ' ' ILE . . . . . . . . . . . . . 15.1 tt -55.03 -22.97 12.05 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.68 0 O-C-N 121.235 -0.916 . . . . 0.0 110.684 -179.78 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 4' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -86.34 -0.23 55.42 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.121 -0.987 . . . . 0.0 110.841 -179.769 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 5' ' ' THR . . . . . . . . . . . . . 86.2 m -125.01 -34.84 2.73 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.043 -1.036 . . . . 0.0 110.369 -179.913 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 6' ' ' ALA . . . . . . . . . . . . . . . -72.28 -38.06 68.88 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.154 -0.966 . . . . 0.0 110.383 -179.811 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 7' ' ' SER . . . . . . . . . . . . . 16.2 m -62.42 -45.84 91.28 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.216 -0.927 . . . . 0.0 110.479 -179.794 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 8' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -72.63 -25.2 61.21 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.2 -0.938 . . . . 0.0 110.37 -179.742 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 9' ' ' LEU . . . . . . . . . . . . . 1.7 tp -61.88 -51.21 69.13 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.296 -0.878 . . . . 0.0 110.194 179.978 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' C' C ' 10' ' ' VAL . . . . . 0.65 HG21 ' OE1' ' A' ' 16' ' ' GLN . 88.5 t -54.31 -47.97 68.3 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.645 0 O-C-N 121.232 -0.918 . . . . 0.0 110.162 179.881 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.98 -46.14 68.13 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.309 -0.869 . . . . 0.0 110.328 179.996 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' C' C ' 12' ' ' ASN . . . . . . . . . . . . . 48.6 t-20 . . . . . 0 N--CA 1.49 1.547 0 O-C-N 121.221 -0.924 . . . . 0.0 110.424 -179.86 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.321 0 N-CA-C 109.729 -1.348 . . . . 0.0 109.729 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -70.37 -29.68 66.41 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.2 -1.176 . . . . 0.0 110.352 -179.898 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 21.9 m -62.14 -60.65 3.28 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.229 -0.919 . . . . 0.0 110.317 -179.885 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' GLU . . . . . 0.425 ' HG3' ' N ' ' A' ' 14' ' ' LEU . 4.5 pt-20 -52.24 -25.22 8.75 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.278 -0.889 . . . . 0.0 110.391 -179.857 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.66 HD13 HD23 ' B' ' 30' ' ' LEU . 9.0 mt -79.48 -50.1 11.27 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.235 -0.916 . . . . 0.0 110.508 -179.889 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.532 ' CD1' HD22 ' B' ' 15' ' ' LEU . 3.9 mm? -70.75 -50.0 40.72 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.212 -0.93 . . . . 0.0 110.269 -179.853 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 16' ' ' GLN . . . . . 0.728 ' HG2' ' HB1' ' C' ' 6' ' ' ALA . 1.2 tt0 -57.42 -42.49 82.44 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.274 -0.891 . . . . 0.0 109.949 179.929 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -59.04 -41.49 96.49 Favored Glycine 0 N--CA 1.492 2.371 0 N-CA-C 109.592 -1.403 . . . . 0.0 109.592 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' TYR . . . . . 0.59 ' O ' HG23 ' A' ' 22' ' ' VAL . 60.4 t80 -68.99 -43.74 74.26 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.159 -1.201 . . . . 0.0 109.959 179.868 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 86.0 m -58.69 -28.27 65.6 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.361 -0.837 . . . . 0.0 110.136 179.883 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 25.4 t -75.4 -70.89 0.28 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.653 0 O-C-N 121.265 -0.897 . . . . 0.0 110.031 179.961 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -47.08 -45.59 21.97 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.341 -0.849 . . . . 0.0 111.032 -179.433 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.59 HG23 ' O ' ' A' ' 18' ' ' TYR . 81.8 t -54.8 -57.63 6.17 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.586 0 O-C-N 120.912 -1.118 . . . . 0.0 110.13 179.96 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 8.4 mt -68.07 -15.15 63.47 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.369 -0.832 . . . . 0.0 110.686 -179.799 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 5.5 tpt180 -80.37 -58.85 2.94 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.088 -1.008 . . . . 0.0 110.47 -179.832 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 5.9 pt20 -81.65 -22.18 37.71 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.241 -0.912 . . . . 0.0 110.443 -179.738 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER 53.22 75.65 0.61 Allowed Pre-proline 0 N--CA 1.491 1.582 0 O-C-N 121.165 -0.959 . . . . 0.0 110.162 -179.837 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 45.0 Cg_endo -71.95 156.86 55.78 Favored 'Trans proline' 0 C--N 1.312 -1.369 0 O-C-N 123.563 1.296 . . . . 0.0 110.415 -179.899 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 43.2 Cg_endo -69.74 -24.36 29.87 Favored 'Trans proline' 0 C--N 1.311 -1.43 0 O-C-N 123.712 1.375 . . . . 0.0 110.043 179.693 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -143.44 117.71 9.59 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.353 -0.842 . . . . 0.0 109.902 179.585 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.41 ' CD1' ' OH ' ' A' ' 18' ' ' TYR . 17.4 tp -72.67 -39.11 67.34 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.269 -0.894 . . . . 0.0 110.307 -179.851 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.583 HG12 ' HG2' ' B' ' 42' ' ' ARG . 45.0 t -49.74 -61.71 0.57 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.767 0 O-C-N 121.242 -0.911 . . . . 0.0 110.22 179.933 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 32' ' ' ASP . . . . . 0.408 ' OD2' ' NH2' ' B' ' 42' ' ' ARG . 7.1 t0 -58.07 -34.73 70.45 Favored 'General case' 0 C--N 1.302 -1.459 0 O-C-N 121.454 -0.779 . . . . 0.0 110.206 -179.906 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 33' ' ' PHE . . . . . 0.519 ' CE2' HG22 ' A' ' 22' ' ' VAL . 68.6 t80 -66.64 -44.19 82.64 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.173 -0.954 . . . . 0.0 109.557 179.533 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -56.62 -40.53 75.53 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.429 -0.794 . . . . 0.0 110.257 179.685 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.541 HG13 ' OG1' ' B' ' 39' ' ' THR . 90.5 t -75.7 -26.67 18.17 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.423 0 O-C-N 121.232 -0.917 . . . . 0.0 110.164 -179.999 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 36' ' ' GLU . . . . . 0.428 ' OE1' ' CA ' ' A' ' 36' ' ' GLU . 1.5 tp10 -81.73 -41.94 20.54 Favored 'General case' 0 C--N 1.303 -1.452 0 O-C-N 121.336 -0.853 . . . . 0.0 109.759 -179.88 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 88.4 t80 -69.39 -59.35 3.05 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.211 -0.931 . . . . 0.0 110.356 -179.836 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 38' ' ' PHE . . . . . 0.403 ' HB3' ' CG2' ' B' ' 35' ' ' VAL . 6.1 m-85 -54.1 -52.42 61.07 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.231 -0.918 . . . . 0.0 110.451 -179.789 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 39' ' ' THR . . . . . 0.51 ' OG1' HG13 ' B' ' 35' ' ' VAL . 24.3 m -52.82 -27.51 18.55 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.135 -0.978 . . . . 0.0 109.988 179.973 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.97 -26.53 60.53 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.21 -0.931 . . . . 0.0 109.986 179.758 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -77.67 -34.75 52.88 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.232 -0.917 . . . . 0.0 110.064 179.82 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -55.7 -28.99 58.61 Favored 'General case' 0 C--N 1.306 -1.297 0 O-C-N 121.226 -0.921 . . . . 0.0 109.271 179.484 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 43' ' ' GLU . . . . . 0.612 ' O ' ' HB3' ' A' ' 44' ' ' ALA . 0.6 OUTLIER -99.32 -59.56 1.7 Allowed 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.522 -0.736 . . . . 0.0 109.638 179.417 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 44' ' ' ALA . . . . . 0.612 ' HB3' ' O ' ' A' ' 43' ' ' GLU . . . . . . . . 0 N--CA 1.497 1.88 0 CA-C-O 121.734 0.778 . . . . 0.0 110.275 179.822 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 8' ' ' PRO . . . . . 0.47 ' HB2' ' CB ' ' B' ' 11' ' ' LEU . 44.1 Cg_endo . . . . . 0 N--CA 1.487 1.132 0 N-CA-C 110.662 -0.553 . . . . 0.0 110.662 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 9' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_endo -86.27 123.38 2.26 Favored 'Trans proline' 0 C--N 1.313 -1.322 0 O-C-N 123.597 1.314 . . . . 0.0 111.246 -179.619 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 73.74 2.27 60.49 Favored Glycine 0 N--CA 1.492 2.411 0 C-N-CA 120.262 -0.97 . . . . 0.0 110.887 179.055 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 11' ' ' LEU . . . . . 0.47 ' CB ' ' HB2' ' B' ' 8' ' ' PRO . 0.1 OUTLIER -90.38 -28.86 18.4 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 120.728 -1.454 . . . . 0.0 110.44 -179.935 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 82.0 m -58.13 -39.87 79.83 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.139 -0.976 . . . . 0.0 110.202 179.891 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -60.64 -40.07 90.6 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.351 -0.843 . . . . 0.0 110.106 179.969 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 14' ' ' LEU . . . . . 0.441 ' HA ' HD13 ' B' ' 14' ' ' LEU . 0.5 OUTLIER -60.19 -42.15 94.44 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.254 -0.903 . . . . 0.0 110.252 -179.975 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 15' ' ' LEU . . . . . 0.532 HD22 ' CD1' ' A' ' 15' ' ' LEU . 65.1 mt -74.64 -44.21 51.6 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.241 -0.912 . . . . 0.0 109.963 179.956 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 16' ' ' GLN . . . . . 0.563 ' O ' HG23 ' B' ' 20' ' ' VAL . 0.9 OUTLIER -54.09 -37.7 64.54 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.308 -0.87 . . . . 0.0 109.956 179.837 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 17' ' ' GLY . . . . . . . . . . . . . . . -67.99 -49.64 46.34 Favored Glycine 0 N--CA 1.49 2.264 0 N-CA-C 109.397 -1.481 . . . . 0.0 109.397 179.862 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 18' ' ' TYR . . . . . 0.44 ' HA ' ' HG3' ' B' ' 21' ' ' GLU . 18.4 t80 -60.02 -34.89 73.98 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.345 -1.091 . . . . 0.0 110.181 179.895 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 95.4 m -63.87 -33.64 76.14 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.18 -0.95 . . . . 0.0 110.525 -179.912 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 20' ' ' VAL . . . . . 0.563 HG23 ' O ' ' B' ' 16' ' ' GLN . 59.4 t -75.46 -22.68 16.53 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.751 0 O-C-N 121.147 -0.971 . . . . 0.0 110.29 -179.811 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 21' ' ' GLU . . . . . 0.44 ' HG3' ' HA ' ' B' ' 18' ' ' TYR . 0.6 OUTLIER -88.92 -52.89 4.86 Favored 'General case' 0 N--CA 1.497 1.915 0 O-C-N 121.153 -0.967 . . . . 0.0 108.702 179.685 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 22' ' ' VAL . . . . . 0.436 HG13 HD13 ' B' ' 30' ' ' LEU . 57.0 t -50.38 -31.8 8.98 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.5 0 O-C-N 121.665 -0.647 . . . . 0.0 110.07 179.498 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -86.34 -39.26 16.64 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.275 -0.891 . . . . 0.0 110.057 179.758 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 1.8 tpt180 -75.86 -52.23 10.8 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.278 -0.889 . . . . 0.0 110.271 -179.95 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 1.9 mm100 -64.04 -40.58 96.61 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.247 -0.908 . . . . 0.0 110.28 -179.961 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 26' ' ' GLN . . . . . 0.401 ' N ' ' CD ' ' B' ' 27' ' ' PRO . 0.2 OUTLIER 51.83 55.71 15.55 Favored Pre-proline 0 N--CA 1.491 1.624 0 O-C-N 121.278 -0.888 . . . . 0.0 110.026 -179.856 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 27' ' ' PRO . . . . . 0.401 ' CD ' ' N ' ' B' ' 26' ' ' GLN . 43.3 Cg_endo -69.6 158.97 55.28 Favored 'Trans proline' 0 C--N 1.313 -1.336 0 O-C-N 123.789 1.415 . . . . 0.0 110.687 -179.629 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_endo -70.0 -22.35 31.11 Favored 'Trans proline' 0 C--N 1.311 -1.406 0 O-C-N 123.724 1.381 . . . . 0.0 110.182 179.811 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 10.4 m-20 -140.2 115.56 9.95 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.369 -0.832 . . . . 0.0 110.123 179.709 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 30' ' ' LEU . . . . . 0.66 HD23 HD13 ' A' ' 14' ' ' LEU . 7.0 tp -72.2 -32.95 67.25 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.297 -0.877 . . . . 0.0 110.008 179.886 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 31' ' ' VAL . . . . . 0.406 ' H ' HG23 ' B' ' 31' ' ' VAL . 33.2 t -57.05 -65.3 0.42 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.715 0 O-C-N 121.316 -0.865 . . . . 0.0 109.879 179.656 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -56.25 -31.74 63.85 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.477 -0.764 . . . . 0.0 109.984 179.868 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 33' ' ' PHE . . . . . . . . . . . . . 47.8 t80 -68.88 -45.48 70.88 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.305 -0.872 . . . . 0.0 109.691 179.462 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -58.49 -37.1 74.84 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.495 -0.753 . . . . 0.0 110.124 179.772 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 35' ' ' VAL . . . . . 0.51 HG13 ' OG1' ' A' ' 39' ' ' THR . 98.3 t -73.2 -46.7 49.7 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.399 0 O-C-N 121.161 -0.962 . . . . 0.0 110.311 179.975 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -60.14 -44.37 94.99 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.165 -0.959 . . . . 0.0 110.416 -179.85 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 37' ' ' TYR . . . . . . . . . . . . . 28.1 t80 -64.45 -67.94 0.39 Allowed 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.209 -0.932 . . . . 0.0 110.606 -179.72 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 13.1 m-85 -51.12 -48.78 61.69 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.279 -0.888 . . . . 0.0 110.776 -179.552 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 39' ' ' THR . . . . . 0.541 ' OG1' HG13 ' A' ' 35' ' ' VAL . 35.7 m -52.35 -32.86 40.34 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 120.959 -1.088 . . . . 0.0 110.002 -179.816 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -68.59 -41.65 79.33 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.266 -0.896 . . . . 0.0 109.848 179.651 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -55.39 -28.31 53.2 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.261 -0.9 . . . . 0.0 109.818 179.658 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 42' ' ' ARG . . . . . 0.583 ' HG2' HG12 ' A' ' 31' ' ' VAL . 7.2 mmm180 -78.63 -19.85 51.71 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.276 -0.89 . . . . 0.0 110.297 179.843 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 43' ' ' GLU . . . . . . . . . . . . . 7.3 mm-40 . . . . . 0 N--CA 1.492 1.665 0 O-C-N 121.136 -0.978 . . . . 0.0 110.649 -179.95 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' C' C ' 2' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.491 1.62 0 CA-C-O 121.16 0.505 . . . . 0.0 110.276 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 3' ' ' ILE . . . . . . . . . . . . . 97.0 mt -63.67 -38.53 82.53 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.629 0 O-C-N 121.19 -0.944 . . . . 0.0 110.3 -179.946 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 4' ' ' GLU . . . . . . . . . . . . . 6.5 mt-10 -66.38 -36.9 84.03 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.229 -0.919 . . . . 0.0 110.397 -179.873 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 5' ' ' THR . . . . . . . . . . . . . 99.0 m -76.46 -56.05 4.98 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.207 -0.933 . . . . 0.0 110.24 -179.956 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 6' ' ' ALA . . . . . 0.728 ' HB1' ' HG2' ' A' ' 16' ' ' GLN . . . -54.42 -35.25 62.71 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.284 -0.885 . . . . 0.0 110.187 -179.983 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 7' ' ' SER . . . . . . . . . . . . . 84.0 p -69.78 -30.25 67.76 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.28 -0.887 . . . . 0.0 110.18 -179.992 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 8' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -96.68 -21.08 17.82 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.29 -0.882 . . . . 0.0 110.215 179.97 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 9' ' ' LEU . . . . . . . . . . . . . 9.3 tt -69.56 -47.47 63.53 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.32 -0.862 . . . . 0.0 110.179 -179.938 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' C' C ' 10' ' ' VAL . . . . . 0.52 HG23 ' N ' ' C' ' 11' ' ' LYS . 33.6 m -57.63 -40.61 76.18 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.66 0 O-C-N 121.184 -0.948 . . . . 0.0 110.038 179.996 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 11' ' ' LYS . . . . . 0.52 ' N ' HG23 ' C' ' 10' ' ' VAL . 18.4 mttt -59.46 -38.61 81.23 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.299 -0.875 . . . . 0.0 110.038 179.817 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' C' C ' 12' ' ' ASN . . . . . . . . . . . . . 8.0 m-20 . . . . . 0 N--CA 1.491 1.613 0 O-C-N 121.31 -0.869 . . . . 0.0 110.053 179.861 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.338 0 N-CA-C 109.748 -1.341 . . . . 0.0 109.748 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 6.8 tp -53.58 -55.58 24.48 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.131 -1.217 . . . . 0.0 110.211 -179.932 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' THR . . . . . 0.748 HG23 HG21 ' C' ' 10' ' ' VAL . 57.0 m -53.53 -56.33 17.92 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.259 -0.901 . . . . 0.0 110.411 -179.851 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -53.75 -41.09 66.75 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.302 -0.874 . . . . 0.0 110.498 -179.698 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -75.19 -27.67 59.73 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.179 -0.951 . . . . 0.0 110.419 -179.761 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 5.3 mp -86.44 -55.38 3.92 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.1 -1.0 . . . . 0.0 110.307 -179.967 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' GLN . . . . . 0.721 ' O ' HG23 ' A' ' 20' ' ' VAL . 1.6 mt-30 -51.48 -37.73 50.43 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.14 -0.975 . . . . 0.0 109.877 179.694 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 17' ' ' GLY . . . . . 0.421 ' O ' ' CG ' ' A' ' 21' ' ' GLU . . . -69.18 -55.5 10.35 Favored Glycine 0 N--CA 1.489 2.232 0 N-CA-C 108.988 -1.645 . . . . 0.0 108.988 179.45 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 18' ' ' TYR . . . . . 0.497 ' O ' HG23 ' A' ' 22' ' ' VAL . 21.5 t80 -50.48 -32.12 17.18 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.349 -1.089 . . . . 0.0 110.088 179.673 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 19' ' ' THR . . . . . 0.477 HG21 ' HA ' ' C' ' 6' ' ' ALA . 94.4 m -76.25 -32.45 58.87 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.465 -0.772 . . . . 0.0 110.053 179.936 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.721 HG23 ' O ' ' A' ' 16' ' ' GLN . 95.1 t -78.5 -18.78 13.4 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.62 0 O-C-N 121.296 -0.877 . . . . 0.0 110.673 -179.858 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.44 ' HG3' ' HA ' ' A' ' 18' ' ' TYR . 1.3 mt-10 -84.87 -57.99 2.88 Favored 'General case' 0 N--CA 1.498 1.933 0 O-C-N 121.008 -1.057 . . . . 0.0 109.036 179.91 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.497 HG23 ' O ' ' A' ' 18' ' ' TYR . 39.8 t -51.65 -34.25 15.92 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.477 0 O-C-N 121.643 -0.661 . . . . 0.0 109.94 179.821 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.466 ' HB3' HD21 ' C' ' 2' ' ' LEU . 2.4 mp -76.53 -37.94 55.9 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.389 -0.82 . . . . 0.0 109.774 179.51 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 24' ' ' ARG . . . . . 0.405 ' HG3' ' O ' ' A' ' 20' ' ' VAL . 0.4 OUTLIER -66.36 -24.67 66.54 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.37 -0.831 . . . . 0.0 110.002 179.874 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 25' ' ' GLN . . . . . 0.405 ' O ' ' C ' ' A' ' 26' ' ' GLN . 0.8 OUTLIER -143.81 59.45 1.37 Allowed 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.265 -0.897 . . . . 0.0 110.212 -179.991 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 26' ' ' GLN . . . . . 0.405 ' C ' ' O ' ' A' ' 25' ' ' GLN . 6.2 pt20 -34.72 95.56 0.09 OUTLIER Pre-proline 0 N--CA 1.505 2.28 0 CA-C-O 120.959 0.409 . . . . 0.0 111.741 -179.75 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 27' ' ' PRO . . . . . 0.401 ' HD3' ' O ' ' A' ' 25' ' ' GLN . 46.7 Cg_endo -73.72 161.01 42.77 Favored 'Trans proline' 0 C--N 1.312 -1.348 0 O-C-N 123.876 1.461 . . . . 0.0 110.515 -179.614 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 43.5 Cg_endo -70.18 -29.54 21.73 Favored 'Trans proline' 0 C--N 1.31 -1.451 0 O-C-N 123.689 1.363 . . . . 0.0 110.224 179.79 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -142.83 118.46 10.42 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.207 -0.933 . . . . 0.0 110.086 179.712 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.574 ' CD2' HD13 ' B' ' 14' ' ' LEU . 4.9 tp -76.79 -24.58 52.86 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.264 -0.897 . . . . 0.0 109.937 179.934 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.421 HG23 ' H ' ' A' ' 31' ' ' VAL . 43.7 t -52.83 -62.96 0.53 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.61 0 O-C-N 121.313 -0.867 . . . . 0.0 110.05 179.791 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -60.82 -43.03 98.78 Favored 'General case' 0 C--N 1.302 -1.457 0 O-C-N 121.504 -0.748 . . . . 0.0 110.02 179.826 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 33' ' ' PHE . . . . . 0.421 ' CE2' HG22 ' A' ' 22' ' ' VAL . 90.7 t80 -59.79 -43.71 94.27 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.128 -0.983 . . . . 0.0 109.678 179.502 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 34' ' ' ALA . . . . . 0.579 ' HB1' ' CD2' ' B' ' 38' ' ' PHE . . . -54.68 -43.99 72.96 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.311 -0.868 . . . . 0.0 109.735 179.626 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.55 HG13 ' OG1' ' B' ' 39' ' ' THR . 54.5 t -71.77 -49.28 46.58 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.335 0 O-C-N 121.309 -0.87 . . . . 0.0 109.94 179.741 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -62.04 -27.65 69.03 Favored 'General case' 0 N--CA 1.487 1.38 0 O-C-N 121.276 -0.89 . . . . 0.0 109.812 179.829 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 73.7 t80 -72.67 -72.04 0.26 Allowed 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.215 -0.928 . . . . 0.0 110.414 -179.734 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 38' ' ' PHE . . . . . 0.431 ' CD2' ' HB1' ' B' ' 34' ' ' ALA . 27.3 m-85 -54.63 -47.79 73.04 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.209 -0.932 . . . . 0.0 110.446 -179.796 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 39' ' ' THR . . . . . 0.509 ' OG1' HG13 ' B' ' 35' ' ' VAL . 99.1 m -52.39 -34.19 46.94 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.102 -0.999 . . . . 0.0 109.94 179.84 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 1.9 tpt85 -75.92 -23.05 55.46 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.312 -0.867 . . . . 0.0 109.902 179.645 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.446 ' HA ' HD22 ' A' ' 41' ' ' LEU . 0.2 OUTLIER -65.54 -40.7 93.21 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.253 -0.904 . . . . 0.0 110.189 179.967 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.78 -22.29 34.81 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.321 -0.862 . . . . 0.0 110.431 -179.847 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 -83.25 -31.87 26.74 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.252 -0.905 . . . . 0.0 110.457 -179.725 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 1.682 0 O-C-N 121.213 -0.929 . . . . 0.0 110.764 -179.782 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 46.5 Cg_endo . . . . . 0 N--CA 1.485 0.975 0 N-CA-C 110.626 -0.567 . . . . 0.0 110.626 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' B' B ' 9' ' ' PRO . . . . . . . . . . . . . 45.9 Cg_endo -72.93 -176.61 2.45 Favored 'Trans proline' 0 C--N 1.313 -1.339 0 O-C-N 123.592 1.311 . . . . 0.0 110.386 179.986 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 118.51 -26.97 7.46 Favored Glycine 0 N--CA 1.491 2.337 0 N-CA-C 109.573 -1.411 . . . . 0.0 109.573 179.969 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 11' ' ' LEU . . . . . 0.43 ' HG ' HD23 ' B' ' 15' ' ' LEU . 4.5 tt -73.64 -24.07 59.96 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.279 -1.13 . . . . 0.0 110.314 -179.921 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 23.4 m -57.94 -58.75 7.03 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.227 -0.921 . . . . 0.0 110.119 -179.989 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 4.5 mt-10 -53.9 -44.7 70.74 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.415 -0.803 . . . . 0.0 110.195 -179.975 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 14' ' ' LEU . . . . . 0.574 HD13 ' CD2' ' A' ' 30' ' ' LEU . 6.5 mt -55.71 -57.94 9.92 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.209 -0.932 . . . . 0.0 110.124 179.967 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 15' ' ' LEU . . . . . 0.51 ' HA ' HD13 ' B' ' 15' ' ' LEU . 3.6 mm? -60.86 -37.94 83.86 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.315 -0.866 . . . . 0.0 110.122 179.92 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 16' ' ' GLN . . . . . 0.472 ' O ' HG23 ' B' ' 20' ' ' VAL . 2.3 tt0 -51.94 -52.01 53.09 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.241 -0.912 . . . . 0.0 110.314 179.899 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 17' ' ' GLY . . . . . 0.409 ' O ' ' HG3' ' B' ' 21' ' ' GLU . . . -56.14 -51.53 55.21 Favored Glycine 0 N--CA 1.49 2.249 0 N-CA-C 109.142 -1.583 . . . . 0.0 109.142 179.665 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 18' ' ' TYR . . . . . 0.673 ' OH ' ' HB2' ' B' ' 34' ' ' ALA . 14.8 t80 -53.98 -40.16 66.67 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.332 -1.099 . . . . 0.0 110.083 179.684 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 54.1 m -62.75 -41.4 99.19 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.435 -0.79 . . . . 0.0 110.386 -179.844 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 20' ' ' VAL . . . . . 0.472 HG23 ' O ' ' B' ' 16' ' ' GLN . 48.9 t -65.42 -18.81 24.54 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.66 0 O-C-N 121.148 -0.97 . . . . 0.0 110.378 -179.938 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 21' ' ' GLU . . . . . 0.468 ' HG3' ' HA ' ' B' ' 18' ' ' TYR . 1.4 mt-10 -93.32 -49.84 5.75 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.126 -0.984 . . . . 0.0 109.051 179.793 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 22' ' ' VAL . . . . . 0.604 ' CG1' HD11 ' B' ' 30' ' ' LEU . 85.7 t -58.92 -28.4 38.15 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.461 0 O-C-N 121.719 -0.613 . . . . 0.0 110.02 179.962 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 8.5 tp -85.18 -43.47 13.79 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.26 -0.9 . . . . 0.0 109.891 179.583 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -78.34 -64.16 1.23 Allowed 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.36 -0.838 . . . . 0.0 110.1 179.874 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 25' ' ' GLN . . . . . 0.404 ' HB3' ' HD3' ' B' ' 27' ' ' PRO . 0.0 OUTLIER -55.06 -37.88 67.3 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.323 -0.86 . . . . 0.0 110.127 179.824 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 2.0 tt0 52.16 60.54 13.31 Favored Pre-proline 0 N--CA 1.491 1.61 0 O-C-N 121.246 -0.908 . . . . 0.0 110.306 -179.947 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 27' ' ' PRO . . . . . 0.404 ' HD3' ' HB3' ' B' ' 25' ' ' GLN . 45.2 Cg_endo -71.35 151.5 60.01 Favored 'Trans proline' 0 C--N 1.313 -1.341 0 O-C-N 123.586 1.308 . . . . 0.0 110.505 -179.973 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 45.2 Cg_endo -70.62 -33.25 13.62 Favored 'Trans proline' 0 C--N 1.311 -1.421 0 O-C-N 123.637 1.335 . . . . 0.0 110.392 179.873 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 29' ' ' ASP . . . . . 0.403 ' O ' ' HB2' ' B' ' 33' ' ' PHE . 2.1 m-20 -118.35 117.13 28.24 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.304 -0.873 . . . . 0.0 110.207 -179.998 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 30' ' ' LEU . . . . . 0.604 HD11 ' CG1' ' B' ' 22' ' ' VAL . 0.1 OUTLIER -82.3 -46.49 13.58 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.296 -0.877 . . . . 0.0 110.013 179.9 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 31' ' ' VAL . . . . . 0.58 ' O ' HG23 ' B' ' 35' ' ' VAL . 40.7 t -53.62 -51.83 39.39 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.695 0 O-C-N 121.384 -0.823 . . . . 0.0 109.608 179.569 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 7.9 t0 -67.95 -35.78 78.98 Favored 'General case' 0 C--N 1.303 -1.45 0 O-C-N 121.648 -0.657 . . . . 0.0 109.782 179.812 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 33' ' ' PHE . . . . . 0.403 ' HB2' ' O ' ' B' ' 29' ' ' ASP . 44.0 t80 -67.03 -44.69 79.58 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.23 -0.919 . . . . 0.0 109.396 179.359 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 34' ' ' ALA . . . . . 0.673 ' HB2' ' OH ' ' B' ' 18' ' ' TYR . . . -57.49 -36.89 72.07 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.363 -0.835 . . . . 0.0 109.777 179.604 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 35' ' ' VAL . . . . . 0.58 HG23 ' O ' ' B' ' 31' ' ' VAL . 99.4 t -69.5 -43.91 80.28 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.301 0 O-C-N 121.298 -0.876 . . . . 0.0 110.018 179.79 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -67.28 -30.47 70.35 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.244 -0.91 . . . . 0.0 110.046 179.755 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 37' ' ' TYR . . . . . 0.468 ' CE1' ' OE1' ' B' ' 21' ' ' GLU . 82.9 t80 -73.67 -63.39 1.21 Allowed 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.349 -0.844 . . . . 0.0 110.185 179.977 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 38' ' ' PHE . . . . . 0.579 ' CD2' ' HB1' ' A' ' 34' ' ' ALA . 9.3 m-85 -57.04 -48.7 77.9 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.259 -0.901 . . . . 0.0 110.413 -179.976 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 39' ' ' THR . . . . . 0.55 ' OG1' HG13 ' A' ' 35' ' ' VAL . 57.4 m -53.93 -36.63 62.98 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.139 -0.976 . . . . 0.0 110.013 179.848 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.36 -25.85 61.68 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.292 -0.88 . . . . 0.0 109.923 179.706 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 4.7 mt -72.79 -28.87 62.85 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.254 -0.904 . . . . 0.0 110.025 179.879 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -76.5 -23.46 53.73 Favored 'General case' 0 C--N 1.306 -1.284 0 O-C-N 121.302 -0.874 . . . . 0.0 109.717 179.882 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 43' ' ' GLU . . . . . . . . . . . . . 26.3 mt-10 . . . . . 0 N--CA 1.491 1.599 0 O-C-N 121.297 -0.877 . . . . 0.0 110.188 179.907 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' C' C ' 2' ' ' LEU . . . . . 0.466 HD21 ' HB3' ' A' ' 23' ' ' LEU . 5.5 mp . . . . . 0 N--CA 1.493 1.688 0 CA-C-O 121.192 0.52 . . . . 0.0 110.585 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 3' ' ' ILE . . . . . . . . . . . . . 19.3 tt -88.27 -18.87 7.92 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.636 0 O-C-N 121.165 -0.96 . . . . 0.0 110.295 179.894 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 4' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -98.35 -9.22 25.68 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.179 -0.951 . . . . 0.0 110.785 -179.892 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 5' ' ' THR . . . . . 0.528 HG22 ' CD1' ' C' ' 9' ' ' LEU . 65.9 m -113.29 -54.12 2.64 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 120.983 -1.073 . . . . 0.0 110.511 -179.807 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 6' ' ' ALA . . . . . 0.477 ' HA ' HG21 ' A' ' 19' ' ' THR . . . -61.76 -56.95 14.14 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.124 -0.985 . . . . 0.0 110.316 -179.785 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 7' ' ' SER . . . . . 0.4 ' O ' ' HB2' ' C' ' 11' ' ' LYS . 47.4 m -65.4 -25.2 67.44 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.224 -0.923 . . . . 0.0 110.339 -179.857 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 8' ' ' SER . . . . . . . . . . . . . 1.1 t -82.87 -39.49 21.54 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.206 -0.934 . . . . 0.0 110.403 -179.916 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' C' C ' 9' ' ' LEU . . . . . 0.528 ' CD1' HG22 ' C' ' 5' ' ' THR . 29.7 mt -61.06 -55.39 33.17 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.207 -0.933 . . . . 0.0 110.399 -179.891 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 10' ' ' VAL . . . . . 0.748 HG21 HG23 ' A' ' 12' ' ' THR . 12.3 p -58.17 -38.97 71.19 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.601 0 O-C-N 121.163 -0.961 . . . . 0.0 110.213 -179.941 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 11' ' ' LYS . . . . . 0.515 ' N ' HG13 ' C' ' 10' ' ' VAL . 5.2 tttm -54.76 -57.79 10.13 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.239 -0.913 . . . . 0.0 110.211 -179.927 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' C' C ' 12' ' ' ASN . . . . . . . . . . . . . 2.8 m-20 . . . . . 0 N--CA 1.49 1.567 0 O-C-N 121.161 -0.962 . . . . 0.0 110.064 179.917 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 2.1 t-160 . . . . . 0 N--CA 1.492 1.633 0 CA-C-O 121.288 0.566 . . . . 0.0 110.29 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -151.22 121.42 7.24 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.287 -0.883 . . . . 0.0 110.128 179.947 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 108.91 59.06 0.53 Allowed Glycine 0 N--CA 1.491 2.308 0 N-CA-C 109.577 -1.409 . . . . 0.0 109.577 -179.983 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -162.49 158.42 23.63 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.254 -1.145 . . . . 0.0 110.091 179.932 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 5.8 tp -102.2 155.25 4.98 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.621 0 O-C-N 121.291 -0.881 . . . . 0.0 110.075 179.985 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -135.24 105.75 6.43 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.297 -0.877 . . . . 0.0 110.338 -179.981 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 31.2 mm -101.34 108.72 56.39 Favored Pre-proline 0 N--CA 1.49 1.561 0 O-C-N 121.283 -0.886 . . . . 0.0 109.986 179.849 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 44.5 Cg_endo -70.4 131.01 19.49 Favored 'Trans proline' 0 C--N 1.312 -1.355 0 O-C-N 123.484 1.255 . . . . 0.0 110.467 -179.948 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 48.1 Cg_endo -74.73 155.41 44.25 Favored 'Trans proline' 0 C--N 1.313 -1.332 0 O-C-N 123.531 1.279 . . . . 0.0 110.401 -179.979 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 121.68 -23.99 7.3 Favored Glycine 0 N--CA 1.49 2.238 0 N-CA-C 109.498 -1.441 . . . . 0.0 109.498 -179.922 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.676 HD22 HD11 ' A' ' 15' ' ' LEU . 0.8 OUTLIER -76.0 -21.98 56.32 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.232 -1.158 . . . . 0.0 110.099 179.937 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 92.6 m -74.07 -37.35 64.26 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.236 -0.915 . . . . 0.0 110.213 -179.97 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -82.04 -47.46 12.6 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.367 -0.833 . . . . 0.0 110.208 179.986 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -53.45 -41.72 66.41 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.177 -0.952 . . . . 0.0 110.115 179.86 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.891 HD22 HD11 ' B' ' 15' ' ' LEU . 71.0 mt -71.48 -37.53 71.29 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.191 -0.943 . . . . 0.0 109.989 179.789 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 16' ' ' GLN . . . . . 0.723 ' O ' HG23 ' A' ' 20' ' ' VAL . 0.0 OUTLIER -64.38 -34.13 77.46 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.275 -0.891 . . . . 0.0 110.137 179.893 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -67.43 -45.23 80.38 Favored Glycine 0 N--CA 1.491 2.315 0 N-CA-C 109.218 -1.553 . . . . 0.0 109.218 179.721 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' TYR . . . . . 0.629 ' OH ' ' HB2' ' A' ' 34' ' ' ALA . 20.4 t80 -63.6 -47.22 82.33 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.346 -1.091 . . . . 0.0 109.697 179.581 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 59.4 m -57.42 -27.1 62.1 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.329 -0.857 . . . . 0.0 110.139 179.715 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.723 HG23 ' O ' ' A' ' 16' ' ' GLN . 46.1 t -74.74 -73.91 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.59 0 O-C-N 121.396 -0.815 . . . . 0.0 110.316 -179.959 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.469 ' OE1' ' CE1' ' A' ' 37' ' ' TYR . 10.3 pt-20 -44.7 -44.32 9.05 Favored 'General case' 0 N--CA 1.497 1.898 0 O-C-N 121.482 -0.761 . . . . 0.0 111.319 -179.443 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.588 HG23 ' O ' ' A' ' 18' ' ' TYR . 89.6 t -55.21 -50.84 61.08 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.638 0 O-C-N 120.96 -1.087 . . . . 0.0 110.188 179.969 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.53 HD13 HD11 ' C' ' 2' ' ' LEU . 88.8 mt -77.34 -3.64 41.05 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.319 -0.863 . . . . 0.0 110.892 -179.734 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -106.72 -52.78 2.72 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 120.923 -1.111 . . . . 0.0 110.388 -179.919 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 3.3 tp-100 -78.89 -24.98 43.83 Favored 'General case' 0 C--N 1.306 -1.322 0 O-C-N 121.278 -0.889 . . . . 0.0 109.831 -179.999 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 2.7 mt-30 52.77 70.85 1.64 Allowed Pre-proline 0 N--CA 1.491 1.59 0 O-C-N 121.192 -0.942 . . . . 0.0 110.091 179.996 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 45.4 Cg_endo -70.3 159.7 52.08 Favored 'Trans proline' 0 C--N 1.31 -1.485 0 O-C-N 123.67 1.353 . . . . 0.0 110.5 -179.95 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 44.4 Cg_endo -71.22 -30.4 15.95 Favored 'Trans proline' 0 C--N 1.311 -1.402 0 O-C-N 123.761 1.4 . . . . 0.0 110.278 179.96 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -140.26 116.01 10.23 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.267 -0.896 . . . . 0.0 110.17 179.864 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 16.7 tp -67.45 -38.73 84.92 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.221 -0.924 . . . . 0.0 109.955 179.972 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 42.6 t -55.06 -66.55 0.26 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.632 0 O-C-N 121.379 -0.825 . . . . 0.0 109.837 179.796 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -56.78 -34.63 67.81 Favored 'General case' 0 N--CA 1.487 1.406 0 O-C-N 121.48 -0.763 . . . . 0.0 109.819 179.735 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 46.1 t80 -64.18 -47.71 78.76 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.269 -0.895 . . . . 0.0 109.609 179.337 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.629 ' HB2' ' OH ' ' A' ' 18' ' ' TYR . . . -52.53 -32.07 38.7 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.369 -0.832 . . . . 0.0 110.132 179.762 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.471 HG13 ' OG1' ' B' ' 39' ' ' THR . 58.5 t -74.86 -39.04 45.0 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.388 0 O-C-N 121.379 -0.826 . . . . 0.0 110.356 -179.963 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 39.5 mm-40 -72.23 -32.0 66.33 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.148 -0.97 . . . . 0.0 110.479 -179.763 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' TYR . . . . . 0.469 ' CE1' ' OE1' ' A' ' 21' ' ' GLU . 34.1 t80 -73.37 -68.88 0.46 Allowed 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.256 -0.902 . . . . 0.0 110.594 -179.686 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 38' ' ' PHE . . . . . 0.471 ' CD2' ' O ' ' A' ' 34' ' ' ALA . 24.1 m-85 -50.28 -49.51 53.16 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.207 -0.933 . . . . 0.0 110.665 -179.565 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 39' ' ' THR . . . . . 0.464 ' OG1' HG13 ' B' ' 35' ' ' VAL . 45.5 m -52.35 -40.51 62.05 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.151 -0.968 . . . . 0.0 109.941 179.912 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 12.0 mtt85 -74.93 -27.0 60.03 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.253 -0.904 . . . . 0.0 109.717 179.562 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -58.23 -32.38 68.27 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.317 -0.865 . . . . 0.0 109.745 179.655 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.417 ' NH2' ' OD1' ' B' ' 32' ' ' ASP . 5.0 ttp180 -53.09 -43.42 66.77 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.385 -0.822 . . . . 0.0 110.158 179.945 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 5.5 mt-10 -75.32 -30.88 60.46 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.327 -0.858 . . . . 0.0 110.468 -179.748 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -56.86 -75.99 0.04 OUTLIER 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.185 -0.947 . . . . 0.0 110.663 -179.787 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -49.54 157.51 0.52 Allowed 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.404 -0.81 . . . . 0.0 110.731 -179.118 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.493 1.678 0 CA-C-O 117.88 -1.057 . . . . 0.0 110.22 -179.948 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 1' ' ' HIS . . . . . . . . . . . . . 3.7 m170 . . . . . 0 N--CA 1.492 1.644 0 CA-C-O 121.085 0.469 . . . . 0.0 110.263 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 2' ' ' MET . . . . . . . . . . . . . 2.5 ttm -62.62 155.95 24.68 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.278 -0.888 . . . . 0.0 110.206 -179.996 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 3' ' ' GLY . . . . . . . . . . . . . . . 108.11 -122.85 6.87 Favored Glycine 0 N--CA 1.491 2.304 0 N-CA-C 109.51 -1.436 . . . . 0.0 109.51 179.985 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 4' ' ' HIS . . . . . . . . . . . . . 1.2 t-80 -165.16 -65.72 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.218 -1.166 . . . . 0.0 110.222 -179.951 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 5' ' ' ILE . . . . . . . . . . . . . 35.5 mm -117.22 148.89 19.67 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.622 0 O-C-N 121.253 -0.904 . . . . 0.0 110.206 179.929 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 6' ' ' GLN . . . . . . . . . . . . . 5.2 mt-30 -137.19 179.93 6.1 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.232 -0.918 . . . . 0.0 110.338 179.998 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 7' ' ' ILE . . . . . 0.485 HD11 HD12 ' C' ' 2' ' ' LEU . 38.6 mm -53.16 109.36 1.44 Allowed Pre-proline 0 N--CA 1.492 1.66 0 O-C-N 121.285 -0.884 . . . . 0.0 110.394 -179.839 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 47.8 Cg_endo -72.6 134.94 23.11 Favored 'Trans proline' 0 C--N 1.313 -1.315 0 O-C-N 123.562 1.296 . . . . 0.0 110.671 179.997 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 9' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_endo -76.82 165.21 28.95 Favored 'Trans proline' 0 C--N 1.313 -1.34 0 O-C-N 123.594 1.312 . . . . 0.0 110.378 179.848 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 108.65 -26.09 17.21 Favored Glycine 0 N--CA 1.491 2.33 0 N-CA-C 109.93 -1.268 . . . . 0.0 109.93 179.64 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 11' ' ' LEU . . . . . 0.626 HD23 HD23 ' B' ' 15' ' ' LEU . 0.4 OUTLIER -80.2 -26.8 39.04 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.16 -1.2 . . . . 0.0 110.267 -179.89 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 88.8 m -68.53 -36.99 79.61 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.194 -0.941 . . . . 0.0 110.344 179.993 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -74.27 -40.48 62.3 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.28 -0.888 . . . . 0.0 110.111 179.923 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 14' ' ' LEU . . . . . 0.44 HD23 ' HA ' ' B' ' 14' ' ' LEU . 3.2 mt -62.68 -37.6 87.1 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.183 -0.948 . . . . 0.0 110.055 179.786 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 15' ' ' LEU . . . . . 0.891 HD11 HD22 ' A' ' 15' ' ' LEU . 1.3 mm? -72.84 -49.07 32.45 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.324 -0.86 . . . . 0.0 110.054 179.859 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 16' ' ' GLN . . . . . 0.793 ' O ' HG23 ' B' ' 20' ' ' VAL . 2.1 mt-30 -55.52 -37.54 68.04 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.282 -0.886 . . . . 0.0 110.013 179.789 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 17' ' ' GLY . . . . . . . . . . . . . . . -62.59 -40.29 98.95 Favored Glycine 0 N--CA 1.489 2.224 0 N-CA-C 109.0 -1.64 . . . . 0.0 109.0 179.769 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 18' ' ' TYR . . . . . 0.621 ' OH ' ' HB2' ' B' ' 34' ' ' ALA . 34.1 t80 -71.17 -53.71 13.53 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.304 -1.116 . . . . 0.0 109.722 179.572 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 90.6 m -51.1 -27.07 7.48 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.239 -0.913 . . . . 0.0 110.185 179.721 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 20' ' ' VAL . . . . . 0.793 HG23 ' O ' ' B' ' 16' ' ' GLN . 55.7 t -73.88 -75.44 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.651 0 O-C-N 121.316 -0.865 . . . . 0.0 109.829 179.669 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 21' ' ' GLU . . . . . 0.443 ' HG3' ' N ' ' B' ' 22' ' ' VAL . 11.0 pt-20 -47.09 -41.5 17.28 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.459 -0.775 . . . . 0.0 110.793 -179.849 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 22' ' ' VAL . . . . . 0.72 ' CG1' HD11 ' B' ' 30' ' ' LEU . 78.7 t -55.94 -44.9 79.59 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.575 0 O-C-N 121.176 -0.953 . . . . 0.0 110.116 179.912 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -73.22 -26.18 61.03 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.196 -0.94 . . . . 0.0 110.4 -179.86 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.55 -55.47 4.11 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.113 -0.992 . . . . 0.0 110.425 -179.868 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 25' ' ' GLN . . . . . 0.437 ' O ' ' CG ' ' B' ' 26' ' ' GLN . 5.6 mp0 -65.67 -20.35 66.26 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.147 -0.97 . . . . 0.0 110.657 -179.708 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 26' ' ' GLN . . . . . 0.437 ' CG ' ' O ' ' B' ' 25' ' ' GLN . 12.7 pt20 36.45 55.22 2.91 Favored Pre-proline 0 N--CA 1.507 2.38 0 O-C-N 122.058 -0.401 . . . . 0.0 111.534 -179.791 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 27' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_endo -68.09 152.02 76.82 Favored 'Trans proline' 0 C--N 1.31 -1.488 0 O-C-N 123.678 1.357 . . . . 0.0 110.526 -179.798 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 44.3 Cg_endo -71.06 -14.41 31.96 Favored 'Trans proline' 0 C--N 1.312 -1.392 0 O-C-N 123.755 1.397 . . . . 0.0 110.503 -179.958 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 12.5 m-20 -137.46 111.2 8.16 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.066 -1.021 . . . . 0.0 110.282 179.915 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 30' ' ' LEU . . . . . 0.72 HD11 ' CG1' ' B' ' 22' ' ' VAL . 0.2 OUTLIER -76.73 -34.19 58.11 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.345 -0.847 . . . . 0.0 109.492 179.641 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 21.6 t -61.93 -50.8 78.65 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.603 0 CA-C-O 121.658 0.742 . . . . 0.0 109.468 179.484 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 32' ' ' ASP . . . . . 0.417 ' OD1' ' NH2' ' A' ' 42' ' ' ARG . 10.5 t70 -67.61 -30.25 69.78 Favored 'General case' 0 C--N 1.303 -1.456 0 O-C-N 121.643 -0.661 . . . . 0.0 109.97 179.775 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 33' ' ' PHE . . . . . . . . . . . . . 83.5 t80 -72.68 -39.48 67.03 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.273 -0.892 . . . . 0.0 109.501 179.284 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 34' ' ' ALA . . . . . 0.621 ' HB2' ' OH ' ' B' ' 18' ' ' TYR . . . -65.83 -38.35 88.67 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.376 -0.827 . . . . 0.0 109.938 179.633 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 35' ' ' VAL . . . . . 0.464 HG13 ' OG1' ' A' ' 39' ' ' THR . 96.8 t -73.8 -32.58 35.01 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.325 0 O-C-N 121.309 -0.87 . . . . 0.0 110.195 179.886 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -80.13 -30.18 38.98 Favored 'General case' 0 N--CA 1.487 1.42 0 O-C-N 121.262 -0.899 . . . . 0.0 109.592 179.892 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 37' ' ' TYR . . . . . . . . . . . . . 16.5 t80 -76.96 -64.14 1.2 Allowed 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.18 -0.95 . . . . 0.0 110.205 -179.957 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 12.7 m-85 -51.95 -50.27 61.54 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.255 -0.903 . . . . 0.0 110.444 -179.845 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 39' ' ' THR . . . . . 0.471 ' OG1' HG13 ' A' ' 35' ' ' VAL . 43.1 m -53.19 -40.98 64.82 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.2 -0.938 . . . . 0.0 110.031 179.853 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 16.6 ttt85 -72.13 -25.27 61.66 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.266 -0.896 . . . . 0.0 110.076 179.766 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -57.68 -55.27 37.02 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.262 -0.899 . . . . 0.0 110.089 179.856 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.93 -36.22 26.95 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.16 -0.963 . . . . 0.0 110.633 -179.958 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 43' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -75.77 -21.01 57.83 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.211 -0.931 . . . . 0.0 110.371 -179.844 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -71.18 -69.3 0.38 Allowed 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.171 -0.956 . . . . 0.0 110.28 179.949 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 45' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.16 -30.68 7.1 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.56 -0.713 . . . . 0.0 110.684 -179.233 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.491 1.617 0 CA-C-O 118.024 -0.988 . . . . 0.0 110.174 -179.979 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 1' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.618 0 CA-C-O 121.331 0.586 . . . . 0.0 110.185 . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 2' ' ' LEU . . . . . 0.53 HD11 HD13 ' A' ' 23' ' ' LEU . 4.0 tp -130.03 -43.87 1.19 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.237 -0.914 . . . . 0.0 110.222 179.933 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 3' ' ' ILE . . . . . . . . . . . . . 1.8 pp -63.09 -23.16 32.55 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.591 0 O-C-N 121.339 -0.851 . . . . 0.0 110.239 -179.977 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 4' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 -78.6 -32.35 47.54 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.235 -0.916 . . . . 0.0 110.329 -179.918 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 5' ' ' THR . . . . . . . . . . . . . 93.1 m -74.82 -34.57 62.38 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.221 -0.924 . . . . 0.0 110.262 -179.958 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 6' ' ' ALA . . . . . 0.436 ' HA ' ' HB2' ' C' ' 9' ' ' LEU . . . -77.7 -37.92 48.48 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.243 -0.911 . . . . 0.0 110.306 -179.895 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 7' ' ' SER . . . . . . . . . . . . . 31.9 m -52.44 -69.85 0.1 Allowed 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.157 -0.964 . . . . 0.0 110.204 -179.885 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 8' ' ' SER . . . . . . . . . . . . . 1.9 m -58.68 -24.54 61.52 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.262 -0.899 . . . . 0.0 110.265 179.908 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 9' ' ' LEU . . . . . 0.436 ' HB2' ' HA ' ' C' ' 6' ' ' ALA . 0.4 OUTLIER -52.24 -43.14 64.15 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.248 -0.907 . . . . 0.0 110.301 -179.923 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' C' C ' 10' ' ' VAL . . . . . . . . . . . . . 71.1 t -71.95 -30.11 35.73 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.595 0 O-C-N 121.166 -0.959 . . . . 0.0 110.309 -179.887 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 11' ' ' LYS . . . . . . . . . . . . . 34.4 mmtm -66.05 -48.6 70.51 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.19 -0.944 . . . . 0.0 110.361 -179.901 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 12' ' ' ASN . . . . . . . . . . . . . 28.7 m-80 -65.89 -27.11 67.96 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.288 -0.882 . . . . 0.0 110.262 -179.918 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 13' ' ' ALA . . . . . . . . . . . . . . . -71.32 -41.17 70.22 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.192 -0.943 . . . . 0.0 110.284 -179.958 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 14' ' ' ILE . . . . . . . . . . . . . 91.7 mt -66.86 -46.6 84.86 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.658 0 O-C-N 121.232 -0.917 . . . . 0.0 110.202 -179.943 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 15' ' ' GLN . . . . . 0.42 ' O ' ' N ' ' C' ' 17' ' ' SER . 2.1 mm-40 -58.61 -58.32 9.08 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.153 -0.967 . . . . 0.0 110.249 179.944 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 16' ' ' LEU . . . . . . . . . . . . . 1.4 tp -68.81 65.5 0.13 Allowed 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.415 -0.803 . . . . 0.0 110.175 179.939 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 17' ' ' SER . . . . . 0.42 ' N ' ' O ' ' C' ' 15' ' ' GLN . 7.5 t -175.06 -57.74 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.178 -0.952 . . . . 0.0 110.144 -179.864 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 18' ' ' ILE . . . . . 0.423 ' O ' ' N ' ' C' ' 20' ' ' GLN . 1.3 pp -80.84 -20.45 11.4 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.615 0 O-C-N 121.288 -0.882 . . . . 0.0 110.381 -179.909 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 19' ' ' GLU . . . . . 0.626 ' O ' HG23 ' C' ' 22' ' ' VAL . 14.2 tt0 -70.68 64.41 0.3 Allowed 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.247 -0.908 . . . . 0.0 109.251 179.409 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 20' ' ' GLN . . . . . 0.423 ' N ' ' O ' ' C' ' 18' ' ' ILE . 0.2 OUTLIER 55.53 25.99 8.54 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.257 -0.902 . . . . 0.0 109.135 -179.003 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' C' C ' 21' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER 56.18 47.97 18.35 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.526 -0.734 . . . . 0.0 109.818 -179.599 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 22' ' ' VAL . . . . . 0.626 HG23 ' O ' ' C' ' 19' ' ' GLU . 69.5 t . . . . . 0 N--CA 1.491 1.622 0 CA-C-O 118.005 -0.998 . . . . 0.0 110.002 -179.987 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 2.6 t60 . . . . . 0 N--CA 1.492 1.629 0 CA-C-O 121.232 0.539 . . . . 0.0 110.2 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 3.2 mtt -99.47 40.55 1.21 Allowed 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.279 -0.888 . . . . 0.0 110.075 179.862 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 76.19 109.9 0.12 Allowed Glycine 0 N--CA 1.49 2.284 0 N-CA-C 109.506 -1.437 . . . . 0.0 109.506 -179.903 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 25.5 p80 -119.96 27.52 8.63 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.248 -1.148 . . . . 0.0 110.295 -179.959 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -128.1 151.52 35.02 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.591 0 O-C-N 121.179 -0.951 . . . . 0.0 110.491 -179.79 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 16.2 tt0 -146.65 63.52 1.2 Allowed 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.262 -0.899 . . . . 0.0 110.185 179.845 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 8.2 mt -114.19 104.16 54.86 Favored Pre-proline 0 N--CA 1.491 1.591 0 O-C-N 121.266 -0.896 . . . . 0.0 110.3 179.994 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 46.7 Cg_endo -72.19 124.2 9.81 Favored 'Trans proline' 0 C--N 1.311 -1.421 0 O-C-N 123.633 1.333 . . . . 0.0 110.52 179.996 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 47.4 Cg_endo -72.78 157.25 52.17 Favored 'Trans proline' 0 C--N 1.314 -1.254 0 O-C-N 123.522 1.275 . . . . 0.0 110.465 179.88 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 109.48 -26.33 15.03 Favored Glycine 0 N--CA 1.492 2.396 0 N-CA-C 109.608 -1.397 . . . . 0.0 109.608 179.924 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -69.06 -23.14 64.0 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.236 -1.156 . . . . 0.0 110.35 -179.881 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 31.9 m -76.91 -51.15 11.72 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.221 -0.925 . . . . 0.0 110.259 -179.96 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -57.77 -31.71 66.79 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.262 -0.899 . . . . 0.0 110.272 -179.923 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.1 mp -72.29 -40.35 67.64 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.357 -0.84 . . . . 0.0 110.282 -179.882 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 5.8 mp -77.79 -52.76 8.4 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.284 -0.885 . . . . 0.0 110.246 -179.94 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' GLN . . . . . 0.435 ' O ' HG23 ' A' ' 20' ' ' VAL . 1.0 OUTLIER -51.79 -44.27 63.38 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.185 -0.947 . . . . 0.0 110.257 179.956 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -58.38 -47.76 87.82 Favored Glycine 0 N--CA 1.49 2.297 0 N-CA-C 109.149 -1.58 . . . . 0.0 109.149 179.729 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' TYR . . . . . 0.645 ' O ' HG23 ' A' ' 22' ' ' VAL . 46.8 t80 -61.15 -47.19 87.37 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.271 -1.135 . . . . 0.0 109.629 179.466 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 7.9 m -56.58 -36.11 68.97 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.361 -0.837 . . . . 0.0 110.147 179.743 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.435 HG23 ' O ' ' A' ' 16' ' ' GLN . 41.6 t -67.15 -71.95 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.674 0 O-C-N 121.293 -0.879 . . . . 0.0 110.216 -179.981 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 5.4 pt-20 -46.58 -49.11 19.33 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.357 -0.839 . . . . 0.0 111.425 -179.392 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.746 HG11 HD11 ' B' ' 11' ' ' LEU . 93.5 t -50.8 -44.28 26.16 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.717 0 O-C-N 120.774 -1.204 . . . . 0.0 110.529 -179.777 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.42 ' HB3' HD11 ' C' ' 2' ' ' LEU . 0.2 OUTLIER -73.26 -25.1 60.56 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.218 -0.926 . . . . 0.0 110.252 -179.987 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -76.49 -69.39 0.51 Allowed 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.255 -0.903 . . . . 0.0 110.417 -179.929 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 25' ' ' GLN . . . . . 0.407 ' HG3' ' HD3' ' A' ' 27' ' ' PRO . 2.7 pt20 -71.94 -33.67 68.42 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.126 -0.984 . . . . 0.0 110.285 -179.845 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 52.13 81.38 0.26 Allowed Pre-proline 0 N--CA 1.492 1.662 0 O-C-N 121.275 -0.891 . . . . 0.0 110.18 179.965 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 27' ' ' PRO . . . . . 0.407 ' HD3' ' HG3' ' A' ' 25' ' ' GLN . 44.8 Cg_endo -71.82 162.3 42.4 Favored 'Trans proline' 0 C--N 1.311 -1.442 0 O-C-N 123.727 1.383 . . . . 0.0 110.528 -179.82 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo -70.14 -26.4 25.81 Favored 'Trans proline' 0 C--N 1.311 -1.44 0 O-C-N 123.803 1.423 . . . . 0.0 110.142 179.828 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 9.6 m-20 -139.15 112.22 8.0 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.361 -0.837 . . . . 0.0 109.726 179.588 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 3.5 tp -74.7 -33.49 62.44 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.32 -0.862 . . . . 0.0 110.29 -179.7 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.417 ' H ' HG23 ' A' ' 31' ' ' VAL . 43.2 t -50.78 -54.66 9.12 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.714 0 O-C-N 121.275 -0.89 . . . . 0.0 110.112 179.812 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -66.19 -44.18 84.7 Favored 'General case' 0 C--N 1.301 -1.533 0 O-C-N 121.565 -0.709 . . . . 0.0 110.148 179.911 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 36.7 t80 -58.18 -50.3 74.0 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.082 -1.011 . . . . 0.0 109.756 179.532 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.416 ' HB2' ' OH ' ' A' ' 18' ' ' TYR . . . -49.22 -39.48 30.04 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.42 -0.8 . . . . 0.0 110.515 179.891 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.556 HG13 ' OG1' ' B' ' 39' ' ' THR . 90.3 t -73.88 -38.85 51.01 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.366 0 O-C-N 121.221 -0.924 . . . . 0.0 110.423 -179.883 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -74.17 -20.56 60.17 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.201 -0.937 . . . . 0.0 110.548 -179.661 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 26.6 t80 -75.65 -59.61 2.67 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.191 -0.943 . . . . 0.0 110.466 -179.899 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' PHE . . . . . 0.407 ' CD2' ' HB1' ' B' ' 34' ' ' ALA . 23.6 m-85 -67.44 -48.69 66.5 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.225 -0.922 . . . . 0.0 110.51 -179.824 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 39' ' ' THR . . . . . 0.484 ' OG1' HG13 ' B' ' 35' ' ' VAL . 94.8 m -50.42 -41.56 52.62 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.174 -0.954 . . . . 0.0 110.29 -179.943 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 1.5 ttt180 -70.25 -25.2 63.26 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.177 -0.952 . . . . 0.0 110.13 179.697 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -62.54 -34.23 76.5 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.258 -0.901 . . . . 0.0 109.954 179.888 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.421 ' HD3' HG12 ' B' ' 31' ' ' VAL . 0.0 OUTLIER -54.64 -37.49 65.73 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.352 -0.843 . . . . 0.0 110.275 179.92 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -84.01 -25.53 29.87 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.217 -0.927 . . . . 0.0 110.4 -179.887 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -57.66 -78.52 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.169 -0.957 . . . . 0.0 110.345 -179.983 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER 45.33 -152.78 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.68 -0.637 . . . . 0.0 111.013 -179.695 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 3.2 ptt180 . . . . . 0 N--CA 1.492 1.635 0 CA-C-O 118.062 -0.971 . . . . 0.0 110.175 179.945 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 1' ' ' HIS . . . . . . . . . . . . . 23.8 p-80 . . . . . 0 N--CA 1.492 1.671 0 CA-C-O 121.189 0.518 . . . . 0.0 110.24 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 2' ' ' MET . . . . . . . . . . . . . 3.9 ttt -134.67 -62.21 0.74 Allowed 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.276 -0.89 . . . . 0.0 110.388 -179.834 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 3' ' ' GLY . . . . . . . . . . . . . . . -103.96 -164.88 24.97 Favored Glycine 0 N--CA 1.49 2.286 0 N-CA-C 109.684 -1.367 . . . . 0.0 109.684 -179.833 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 4' ' ' HIS . . . . . . . . . . . . . 27.1 p80 -169.01 -172.38 1.54 Allowed 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.364 -1.08 . . . . 0.0 110.205 -179.99 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 5' ' ' ILE . . . . . 0.406 HG13 ' N ' ' B' ' 6' ' ' GLN . 9.8 tp -124.57 164.79 22.53 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.548 0 O-C-N 121.237 -0.914 . . . . 0.0 110.26 -179.936 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 6' ' ' GLN . . . . . 0.406 ' N ' HG13 ' B' ' 5' ' ' ILE . 12.0 tp60 -139.14 79.42 1.72 Allowed 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.225 -0.922 . . . . 0.0 110.198 -179.983 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 7' ' ' ILE . . . . . 0.618 ' CD1' HG21 ' C' ' 5' ' ' THR . 14.4 mt -146.69 108.59 4.08 Favored Pre-proline 0 N--CA 1.491 1.601 0 O-C-N 121.239 -0.913 . . . . 0.0 110.198 -179.983 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 47.7 Cg_endo -72.44 127.32 12.43 Favored 'Trans proline' 0 C--N 1.311 -1.409 0 O-C-N 123.591 1.311 . . . . 0.0 110.349 179.927 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 9' ' ' PRO . . . . . . . . . . . . . 45.3 Cg_endo -72.53 177.8 7.01 Favored 'Trans proline' 0 C--N 1.313 -1.34 0 O-C-N 123.522 1.275 . . . . 0.0 110.49 179.967 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 99.28 -40.28 2.49 Favored Glycine 0 N--CA 1.491 2.3 0 N-CA-C 109.473 -1.451 . . . . 0.0 109.473 -179.943 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 11' ' ' LEU . . . . . 0.746 HD11 HG11 ' A' ' 22' ' ' VAL . 0.2 OUTLIER -63.22 -23.94 67.65 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.306 -1.114 . . . . 0.0 110.26 179.994 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 95.5 m -62.94 -61.38 2.43 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.223 -0.923 . . . . 0.0 110.214 179.929 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 -52.3 -32.81 39.38 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.342 -0.849 . . . . 0.0 110.248 -179.979 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 14.1 mt -66.59 -56.94 8.41 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.285 -0.884 . . . . 0.0 110.429 -179.852 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 15' ' ' LEU . . . . . 0.657 HD11 ' CD2' ' B' ' 11' ' ' LEU . 14.3 mt -66.03 -48.95 69.41 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.218 -0.926 . . . . 0.0 110.27 -179.943 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -52.02 -47.49 64.98 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.139 -0.976 . . . . 0.0 110.028 179.826 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 17' ' ' GLY . . . . . 0.404 ' O ' ' HB ' ' B' ' 20' ' ' VAL . . . -55.14 -42.54 82.04 Favored Glycine 0 N--CA 1.49 2.3 0 N-CA-C 109.066 -1.614 . . . . 0.0 109.066 179.508 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 18' ' ' TYR . . . . . 0.453 ' O ' HG23 ' B' ' 22' ' ' VAL . 19.0 t80 -64.87 -45.27 86.73 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.323 -1.104 . . . . 0.0 109.561 179.365 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 19' ' ' THR . . . . . 0.603 HG21 ' O ' ' C' ' 13' ' ' ALA . 6.6 m -58.28 -24.08 58.36 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.424 -0.798 . . . . 0.0 110.022 179.675 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 20' ' ' VAL . . . . . 0.404 ' HB ' ' O ' ' B' ' 17' ' ' GLY . 51.2 t -78.07 -74.07 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.608 0 O-C-N 121.351 -0.843 . . . . 0.0 110.413 -179.828 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -45.28 -44.62 11.52 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.464 -0.772 . . . . 0.0 111.194 -179.305 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 22' ' ' VAL . . . . . 0.502 HG22 ' CE2' ' B' ' 33' ' ' PHE . 86.0 t -59.24 -47.17 91.25 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.6 0 O-C-N 120.947 -1.096 . . . . 0.0 109.737 179.808 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 3.0 tp -72.65 -19.45 61.44 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.293 -0.879 . . . . 0.0 110.038 179.594 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 24' ' ' ARG . . . . . 0.6 ' HD3' HG11 ' C' ' 22' ' ' VAL . 0.0 OUTLIER -81.5 -59.07 2.75 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.297 -0.877 . . . . 0.0 110.33 -179.913 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 25' ' ' GLN . . . . . 0.438 ' HG3' ' N ' ' B' ' 26' ' ' GLN . 0.0 OUTLIER -89.82 -23.01 21.82 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.206 -0.934 . . . . 0.0 110.586 -179.653 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 26' ' ' GLN . . . . . 0.438 ' N ' ' HG3' ' B' ' 25' ' ' GLN . 7.6 mt-30 47.96 81.78 0.25 Allowed Pre-proline 0 N--CA 1.494 1.76 0 O-C-N 121.159 -0.963 . . . . 0.0 110.674 179.752 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 27' ' ' PRO . . . . . . . . . . . . . 44.9 Cg_endo -73.09 166.55 29.71 Favored 'Trans proline' 0 C--N 1.31 -1.483 0 O-C-N 123.615 1.324 . . . . 0.0 110.598 -179.815 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 44.3 Cg_endo -70.52 -49.17 0.47 Allowed 'Trans proline' 0 C--N 1.311 -1.41 0 O-C-N 123.749 1.394 . . . . 0.0 110.176 179.785 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 10.0 m-20 -119.37 116.87 27.08 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.237 -0.914 . . . . 0.0 110.081 179.718 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 30' ' ' LEU . . . . . 0.448 ' HG ' ' HH ' ' B' ' 18' ' ' TYR . 0.6 OUTLIER -71.46 -29.26 64.65 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.27 -0.894 . . . . 0.0 110.444 -179.708 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 31' ' ' VAL . . . . . 0.421 HG12 ' HD3' ' A' ' 42' ' ' ARG . 43.4 t -49.9 -65.39 0.24 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.784 0 O-C-N 121.189 -0.945 . . . . 0.0 110.054 179.83 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 4.3 t0 -56.54 -46.54 80.59 Favored 'General case' 0 C--N 1.302 -1.492 0 O-C-N 121.466 -0.771 . . . . 0.0 109.961 179.679 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 33' ' ' PHE . . . . . 0.502 ' CE2' HG22 ' B' ' 22' ' ' VAL . 67.7 t80 -54.83 -47.35 74.21 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.174 -0.954 . . . . 0.0 109.832 179.68 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 34' ' ' ALA . . . . . 0.417 ' HB2' ' OH ' ' B' ' 18' ' ' TYR . . . -56.1 -40.19 73.31 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.324 -0.86 . . . . 0.0 109.935 179.74 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 35' ' ' VAL . . . . . 0.484 HG13 ' OG1' ' A' ' 39' ' ' THR . 76.9 t -77.32 -45.65 29.31 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.323 0 O-C-N 121.306 -0.871 . . . . 0.0 109.82 179.77 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -61.23 -36.26 79.48 Favored 'General case' 0 N--CA 1.487 1.403 0 O-C-N 121.3 -0.875 . . . . 0.0 109.329 179.495 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 37' ' ' TYR . . . . . . . . . . . . . 61.6 t80 -68.9 -59.34 3.13 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.295 -0.878 . . . . 0.0 110.141 179.872 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 12.1 m-85 -64.19 -49.57 71.52 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.257 -0.902 . . . . 0.0 110.576 -179.65 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 39' ' ' THR . . . . . 0.556 ' OG1' HG13 ' A' ' 35' ' ' VAL . 94.2 m -51.53 -27.7 11.54 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.1 -1.0 . . . . 0.0 110.056 179.953 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -75.49 -35.65 60.76 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.295 -0.878 . . . . 0.0 109.77 179.528 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.02 -27.83 68.61 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.389 -0.82 . . . . 0.0 110.301 179.926 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.26 -28.28 63.02 Favored 'General case' 0 N--CA 1.486 1.343 0 O-C-N 121.263 -0.898 . . . . 0.0 110.04 -179.922 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 43' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -104.88 13.56 30.95 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.125 -0.984 . . . . 0.0 110.565 179.937 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -120.42 -70.44 0.79 Allowed 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.107 -0.996 . . . . 0.0 110.369 179.956 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 45' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -49.96 102.86 0.04 OUTLIER 'General case' 0 N--CA 1.488 1.435 0 O-C-N 121.525 -0.734 . . . . 0.0 110.608 -179.147 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.588 0 CA-C-O 117.948 -1.025 . . . . 0.0 110.226 -179.981 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 1' ' ' LEU . . . . . 0.438 ' O ' ' N ' ' C' ' 3' ' ' ILE . 0.8 OUTLIER . . . . . 0 N--CA 1.492 1.643 0 CA-C-O 120.906 0.384 . . . . 0.0 110.634 . . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 2' ' ' LEU . . . . . 0.42 HD11 ' HB3' ' A' ' 23' ' ' LEU . 0.1 OUTLIER 63.96 -72.87 0.05 Allowed 'General case' 0 N--CA 1.498 1.972 0 O-C-N 121.346 -0.846 . . . . 0.0 110.553 -179.938 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' C' C ' 3' ' ' ILE . . . . . 0.438 ' N ' ' O ' ' C' ' 1' ' ' LEU . 2.9 mp -55.48 -23.37 13.97 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.61 0 O-C-N 121.083 -1.011 . . . . 0.0 110.321 -179.888 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 4' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -103.62 20.49 17.87 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.278 -0.889 . . . . 0.0 110.306 -179.883 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 5' ' ' THR . . . . . 0.618 HG21 ' CD1' ' B' ' 7' ' ' ILE . 78.7 m -138.34 -47.93 0.53 Allowed 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.189 -0.944 . . . . 0.0 110.078 179.825 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 6' ' ' ALA . . . . . 0.581 ' O ' HG22 ' C' ' 10' ' ' VAL . . . -61.39 -36.18 79.55 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.235 -0.916 . . . . 0.0 110.065 179.877 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 7' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -60.79 -45.43 94.4 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.28 -0.888 . . . . 0.0 110.117 179.884 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 8' ' ' SER . . . . . . . . . . . . . 6.3 t -70.92 -29.62 65.72 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.276 -0.89 . . . . 0.0 110.095 179.8 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 9' ' ' LEU . . . . . . . . . . . . . 3.2 tp -68.68 -62.8 1.23 Allowed 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.277 -0.89 . . . . 0.0 110.158 179.945 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 10' ' ' VAL . . . . . 0.742 ' O ' HD12 ' C' ' 14' ' ' ILE . 35.2 m -53.85 -27.78 16.07 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.628 0 O-C-N 121.314 -0.866 . . . . 0.0 110.173 -179.94 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 11' ' ' LYS . . . . . . . . . . . . . 1.8 tppt? -70.37 -38.72 74.8 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.291 -0.881 . . . . 0.0 110.255 -179.951 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 12' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 -81.94 -25.83 34.54 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.241 -0.912 . . . . 0.0 110.139 179.937 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 13' ' ' ALA . . . . . 0.603 ' O ' HG21 ' B' ' 19' ' ' THR . . . -69.75 -29.88 67.34 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.255 -0.903 . . . . 0.0 110.176 179.868 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 14' ' ' ILE . . . . . 0.742 HD12 ' O ' ' C' ' 10' ' ' VAL . 19.6 mt -87.17 -42.26 15.19 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.616 0 O-C-N 121.289 -0.882 . . . . 0.0 110.127 179.988 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 15' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -65.87 -80.92 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.249 -0.907 . . . . 0.0 110.246 -179.969 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 16' ' ' LEU . . . . . 0.409 ' HA ' HD22 ' C' ' 16' ' ' LEU . 0.1 OUTLIER 52.79 28.84 6.78 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.2 -0.937 . . . . 0.0 110.179 -179.948 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' C' C ' 17' ' ' SER . . . . . . . . . . . . . 6.2 t 53.08 62.11 2.84 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.135 -0.978 . . . . 0.0 110.061 -179.901 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 18' ' ' ILE . . . . . 0.524 HG22 ' O ' ' C' ' 18' ' ' ILE . 55.1 mt 54.45 40.37 0.31 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.694 0 O-C-N 121.328 -0.858 . . . . 0.0 110.084 -179.737 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 19' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER 51.89 55.58 9.07 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 120.935 -1.103 . . . . 0.0 109.02 -179.194 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 20' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 54.84 24.79 6.03 Favored 'General case' 0 N--CA 1.49 1.57 0 N-CA-C 108.382 -0.97 . . . . 0.0 108.382 -177.811 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 21' ' ' LEU . . . . . 0.633 HD23 ' O ' ' C' ' 21' ' ' LEU . 1.6 tt 46.32 42.04 9.87 Favored 'General case' 0 N--CA 1.49 1.55 0 CA-C-O 121.887 0.851 . . . . 0.0 109.999 -179.238 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 22' ' ' VAL . . . . . 0.6 HG11 ' HD3' ' B' ' 24' ' ' ARG . 8.7 p . . . . . 0 N--CA 1.489 1.492 0 CA-C-O 117.993 -1.004 . . . . 0.0 110.676 -179.96 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 99.3 m-70 . . . . . 0 N--CA 1.492 1.673 0 CA-C-O 121.248 0.547 . . . . 0.0 110.172 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 7.3 ttp 52.96 69.82 0.65 Allowed 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.242 -0.911 . . . . 0.0 110.063 -179.847 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 90.4 21.3 38.27 Favored Glycine 0 N--CA 1.491 2.339 0 N-CA-C 109.588 -1.405 . . . . 0.0 109.588 -179.844 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 84.2 t60 -119.91 -34.15 3.8 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.276 -1.132 . . . . 0.0 109.936 179.912 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 8.8 tp -101.26 143.39 14.45 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.625 0 O-C-N 121.344 -0.847 . . . . 0.0 109.989 179.844 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -121.81 -150.35 0.45 Allowed 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.211 -0.931 . . . . 0.0 110.226 -179.845 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 7' ' ' ILE . . . . . 0.434 HD13 ' N ' ' A' ' 8' ' ' PRO . 0.2 OUTLIER -47.21 123.6 8.44 Favored Pre-proline 0 N--CA 1.489 1.508 0 O-C-N 121.357 -0.84 . . . . 0.0 110.579 -179.734 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.434 ' N ' HD13 ' A' ' 7' ' ' ILE . 48.8 Cg_endo -74.13 136.42 22.33 Favored 'Trans proline' 0 C--N 1.314 -1.255 0 O-C-N 123.441 1.232 . . . . 0.0 110.448 -179.632 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 47.9 Cg_endo -76.08 152.2 35.61 Favored 'Trans proline' 0 C--N 1.312 -1.393 0 O-C-N 123.546 1.287 . . . . 0.0 110.357 179.885 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 120.57 -29.53 5.85 Favored Glycine 0 N--CA 1.492 2.414 0 N-CA-C 109.615 -1.394 . . . . 0.0 109.615 179.955 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 22.3 tp -64.36 -23.15 67.19 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.239 -1.154 . . . . 0.0 110.338 -179.904 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 7.5 m -63.25 -62.81 1.45 Allowed 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.218 -0.926 . . . . 0.0 110.231 -179.987 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 31.6 tt0 -54.77 -30.49 56.79 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.352 -0.843 . . . . 0.0 110.223 -179.99 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -72.65 -49.82 29.22 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.205 -0.935 . . . . 0.0 110.222 179.93 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -70.7 -56.58 6.08 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.141 -0.974 . . . . 0.0 110.113 179.944 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 16' ' ' GLN . . . . . 0.583 ' HG3' HG11 ' C' ' 10' ' ' VAL . 0.0 OUTLIER -54.38 -41.67 69.49 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.147 -0.971 . . . . 0.0 109.646 179.607 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -55.57 -41.03 80.53 Favored Glycine 0 N--CA 1.489 2.205 0 N-CA-C 109.248 -1.541 . . . . 0.0 109.248 179.554 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' TYR . . . . . 0.559 ' O ' HG23 ' A' ' 22' ' ' VAL . 63.7 t80 -67.08 -43.15 83.35 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.296 -1.12 . . . . 0.0 109.736 179.624 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 1.6 m -54.41 -29.19 48.16 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.198 -0.939 . . . . 0.0 109.88 179.557 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 45.0 t -76.86 -71.68 0.26 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.593 0 O-C-N 121.407 -0.808 . . . . 0.0 110.238 -179.955 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.409 ' HG3' ' N ' ' A' ' 22' ' ' VAL . 10.0 pt-20 -45.31 -43.09 10.43 Favored 'General case' 0 N--CA 1.497 1.903 0 O-C-N 121.447 -0.783 . . . . 0.0 111.094 -179.489 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.559 HG23 ' O ' ' A' ' 18' ' ' TYR . 71.2 t -55.94 -54.07 31.06 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.581 0 O-C-N 121.001 -1.062 . . . . 0.0 109.596 179.706 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.676 ' HB3' HD11 ' C' ' 2' ' ' LEU . 4.0 mt -66.73 -23.79 66.15 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.311 -0.868 . . . . 0.0 109.976 179.713 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 24' ' ' ARG . . . . . 0.482 ' NH1' HD13 ' C' ' 2' ' ' LEU . 0.0 OUTLIER -81.34 -71.15 0.49 Allowed 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.258 -0.901 . . . . 0.0 109.944 179.899 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -55.18 -35.26 64.63 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.381 -0.824 . . . . 0.0 110.199 179.907 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER 51.25 64.61 7.77 Favored Pre-proline 0 N--CA 1.491 1.612 0 O-C-N 121.173 -0.954 . . . . 0.0 110.272 -179.944 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 46.2 Cg_endo -70.69 159.44 52.7 Favored 'Trans proline' 0 C--N 1.31 -1.452 0 O-C-N 123.76 1.4 . . . . 0.0 110.475 -179.953 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 43.7 Cg_endo -70.63 -23.03 27.29 Favored 'Trans proline' 0 C--N 1.31 -1.461 0 O-C-N 123.713 1.375 . . . . 0.0 110.149 179.876 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' ASP . . . . . 0.425 ' OD2' ' CB ' ' A' ' 32' ' ' ASP . 32.8 p-10 -142.4 115.26 8.7 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.384 -0.823 . . . . 0.0 109.917 179.697 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.415 ' CD1' ' OH ' ' A' ' 18' ' ' TYR . 10.8 tp -70.61 -34.93 72.66 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.273 -0.892 . . . . 0.0 110.318 -179.691 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 42.4 t -49.83 -59.9 0.92 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.832 0 O-C-N 121.261 -0.899 . . . . 0.0 109.925 179.714 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' ASP . . . . . 0.425 ' CB ' ' OD2' ' A' ' 29' ' ' ASP . 6.4 t0 -60.1 -46.1 90.72 Favored 'General case' 0 C--N 1.301 -1.503 0 O-C-N 121.619 -0.675 . . . . 0.0 109.972 179.801 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 53.3 t80 -56.56 -48.79 76.57 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.169 -0.957 . . . . 0.0 109.568 179.524 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -55.06 -43.45 73.85 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.329 -0.857 . . . . 0.0 109.659 179.579 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.43 HG13 ' OG1' ' B' ' 39' ' ' THR . 69.2 t -72.34 -23.42 21.34 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.36 0 O-C-N 121.486 -0.759 . . . . 0.0 109.878 179.712 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -81.7 -44.07 17.61 Favored 'General case' 0 C--N 1.303 -1.418 0 O-C-N 121.23 -0.919 . . . . 0.0 109.782 -179.749 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 51.5 t80 -62.71 -61.47 2.39 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.182 -0.949 . . . . 0.0 110.752 -179.63 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 29.7 m-85 -57.51 -52.95 63.32 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.241 -0.912 . . . . 0.0 111.123 -179.321 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' THR . . . . . 0.662 ' OG1' HG13 ' B' ' 35' ' ' VAL . 22.8 m -49.73 -41.79 44.55 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 121.065 -1.022 . . . . 0.0 110.195 -179.656 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 34.4 ttt-85 -71.59 -20.87 61.94 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.187 -0.946 . . . . 0.0 109.843 179.473 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -63.49 -43.21 97.91 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.302 -0.874 . . . . 0.0 110.242 179.998 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.498 ' HD2' HG12 ' B' ' 31' ' ' VAL . 0.0 OUTLIER -49.44 -25.71 2.77 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.198 -0.939 . . . . 0.0 110.22 179.771 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 43' ' ' GLU . . . . . 0.589 ' O ' ' HB3' ' A' ' 44' ' ' ALA . 1.0 OUTLIER -106.29 -58.26 1.94 Allowed 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.433 -0.792 . . . . 0.0 109.777 179.611 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 44' ' ' ALA . . . . . 0.589 ' HB3' ' O ' ' A' ' 43' ' ' GLU . . . 67.05 -61.52 0.33 Allowed 'General case' 0 N--CA 1.501 2.098 0 O-C-N 121.624 -0.672 . . . . 0.0 110.73 179.835 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.45 ' N ' ' O ' ' A' ' 43' ' ' GLU . 0.0 OUTLIER -53.23 169.54 0.11 Allowed 'General case' 0 C--N 1.299 -1.616 0 O-C-N 121.512 -0.742 . . . . 0.0 110.51 -178.998 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.493 1.679 0 CA-C-O 118.036 -0.983 . . . . 0.0 110.286 179.975 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 1' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.491 1.614 0 CA-C-O 121.206 0.527 . . . . 0.0 110.262 . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 2' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -94.9 48.39 1.19 Allowed 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.274 -0.891 . . . . 0.0 110.117 179.949 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 3' ' ' GLY . . . . . . . . . . . . . . . 67.04 168.7 3.51 Favored Glycine 0 N--CA 1.49 2.258 0 N-CA-C 109.459 -1.456 . . . . 0.0 109.459 -179.923 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 4' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -101.84 -10.7 19.65 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.322 -1.104 . . . . 0.0 110.636 -179.906 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 5' ' ' ILE . . . . . 0.404 HG23 HD12 ' B' ' 5' ' ' ILE . 47.6 mm -111.64 158.12 12.22 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.612 0 O-C-N 121.044 -1.035 . . . . 0.0 110.368 -179.941 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 6' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -152.41 -167.46 2.76 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.247 -0.908 . . . . 0.0 110.28 179.954 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 7' ' ' ILE . . . . . 0.669 HG13 HD21 ' A' ' 23' ' ' LEU . 4.3 mp -80.18 114.56 47.89 Favored Pre-proline 0 N--CA 1.492 1.632 0 O-C-N 121.151 -0.968 . . . . 0.0 109.806 179.929 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_endo -70.99 136.61 30.12 Favored 'Trans proline' 0 C--N 1.313 -1.32 0 O-C-N 123.482 1.254 . . . . 0.0 110.518 -179.802 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 9' ' ' PRO . . . . . . . . . . . . . 49.3 Cg_endo -78.61 2.17 8.39 Favored 'Trans proline' 0 C--N 1.313 -1.294 0 O-C-N 123.661 1.348 . . . . 0.0 111.418 -179.943 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . -72.03 -20.2 78.82 Favored Glycine 0 N--CA 1.491 2.3 0 N-CA-C 109.664 -1.374 . . . . 0.0 109.664 179.982 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 11' ' ' LEU . . . . . 0.503 HD11 HG11 ' A' ' 22' ' ' VAL . 0.4 OUTLIER -81.12 -16.92 51.66 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.272 -1.134 . . . . 0.0 110.519 -179.891 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 12' ' ' THR . . . . . 0.525 ' OG1' HD11 ' C' ' 9' ' ' LEU . 78.4 m -73.12 -36.21 66.68 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.074 -1.016 . . . . 0.0 110.374 -179.881 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -75.06 -25.23 58.49 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.277 -0.889 . . . . 0.0 110.156 179.999 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -74.02 -47.56 36.14 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.277 -0.89 . . . . 0.0 110.166 179.922 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 84.5 mt -64.08 -49.78 70.94 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.224 -0.922 . . . . 0.0 110.021 179.882 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 16' ' ' GLN . . . . . 0.535 ' OE1' HD22 ' C' ' 16' ' ' LEU . 0.0 OUTLIER -56.04 -42.35 76.43 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.264 -0.898 . . . . 0.0 109.871 179.764 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 17' ' ' GLY . . . . . 0.406 ' O ' ' CG ' ' B' ' 21' ' ' GLU . . . -57.92 -46.47 92.42 Favored Glycine 0 N--CA 1.49 2.257 0 N-CA-C 109.271 -1.532 . . . . 0.0 109.271 179.774 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 18' ' ' TYR . . . . . 0.492 ' OH ' ' HB2' ' B' ' 34' ' ' ALA . 39.4 t80 -63.38 -30.64 71.74 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.313 -1.11 . . . . 0.0 109.957 179.726 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 62.4 m -74.85 -27.69 60.37 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.343 -0.848 . . . . 0.0 110.237 179.993 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 20' ' ' VAL . . . . . 0.477 HG23 ' O ' ' B' ' 16' ' ' GLN . 87.1 t -78.1 -19.56 13.63 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.616 0 O-C-N 121.166 -0.958 . . . . 0.0 110.28 179.941 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 21' ' ' GLU . . . . . 0.456 ' HG3' ' HA ' ' B' ' 18' ' ' TYR . 0.6 OUTLIER -86.38 -45.79 10.86 Favored 'General case' 0 N--CA 1.499 1.991 0 O-C-N 121.138 -0.976 . . . . 0.0 108.895 179.605 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 22' ' ' VAL . . . . . 0.422 HG23 ' O ' ' B' ' 18' ' ' TYR . 78.2 t -63.31 -25.67 39.0 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.541 0 CA-C-O 121.308 0.575 . . . . 0.0 110.056 179.978 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 23' ' ' LEU . . . . . 0.44 HD23 ' HA ' ' B' ' 23' ' ' LEU . 4.4 mt -84.22 -31.6 24.95 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.26 -0.9 . . . . 0.0 110.09 179.777 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -87.6 -40.27 14.36 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.26 -0.9 . . . . 0.0 110.442 -179.847 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 1.8 tt0 -88.44 -40.85 13.17 Favored 'General case' 0 C--N 1.306 -1.303 0 O-C-N 121.28 -0.887 . . . . 0.0 110.298 -179.711 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 52.8 67.36 3.94 Favored Pre-proline 0 N--CA 1.492 1.628 0 O-C-N 121.318 -0.864 . . . . 0.0 110.211 179.945 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 27' ' ' PRO . . . . . . . . . . . . . 45.1 Cg_endo -70.94 167.45 25.95 Favored 'Trans proline' 0 C--N 1.312 -1.383 0 O-C-N 123.571 1.301 . . . . 0.0 110.558 -179.955 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 44.3 Cg_endo -71.26 -41.89 2.28 Favored 'Trans proline' 0 C--N 1.312 -1.359 0 O-C-N 123.734 1.386 . . . . 0.0 110.38 179.826 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 10.9 m-20 -123.22 120.88 34.45 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.222 -0.924 . . . . 0.0 110.164 179.935 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 2.7 tp -78.65 -31.55 46.86 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.289 -0.882 . . . . 0.0 109.898 179.747 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 31' ' ' VAL . . . . . 0.498 HG12 ' HD2' ' A' ' 42' ' ' ARG . 46.8 t -52.63 -67.38 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.678 0 O-C-N 121.278 -0.889 . . . . 0.0 109.967 179.787 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 1.6 t0 -55.5 -41.53 73.18 Favored 'General case' 0 C--N 1.303 -1.456 0 O-C-N 121.39 -0.819 . . . . 0.0 109.764 179.709 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 33' ' ' PHE . . . . . . . . . . . . . 59.4 t80 -58.2 -47.72 82.57 Favored 'General case' 0 N--CA 1.488 1.446 0 O-C-N 121.169 -0.957 . . . . 0.0 109.369 179.32 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 34' ' ' ALA . . . . . 0.492 ' HB2' ' OH ' ' B' ' 18' ' ' TYR . . . -58.54 -36.92 74.63 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.346 -0.846 . . . . 0.0 109.512 179.313 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 35' ' ' VAL . . . . . 0.662 HG13 ' OG1' ' A' ' 39' ' ' THR . 89.1 t -75.2 -51.43 21.38 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.32 0 O-C-N 121.471 -0.768 . . . . 0.0 109.994 179.704 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 36' ' ' GLU . . . . . 0.409 ' O ' ' HB2' ' B' ' 40' ' ' ARG . 3.0 mm-40 -58.96 -35.79 73.74 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.268 -0.895 . . . . 0.0 110.116 179.995 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 37' ' ' TYR . . . . . 0.447 ' CE1' ' OE2' ' B' ' 21' ' ' GLU . 43.2 t80 -62.29 -73.64 0.1 Allowed 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.295 -0.878 . . . . 0.0 110.107 179.957 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 20.9 m-85 -51.88 -45.36 64.09 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.242 -0.911 . . . . 0.0 110.521 -179.888 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 39' ' ' THR . . . . . 0.43 ' OG1' HG13 ' A' ' 35' ' ' VAL . 45.2 m -53.16 -28.53 26.67 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.174 -0.954 . . . . 0.0 110.032 179.835 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 40' ' ' ARG . . . . . 0.409 ' HB2' ' O ' ' B' ' 36' ' ' GLU . 0.0 OUTLIER -82.57 -30.61 29.52 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.292 -0.88 . . . . 0.0 109.953 179.686 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.69 -36.14 75.88 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.311 -0.868 . . . . 0.0 110.123 179.922 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 42' ' ' ARG . . . . . 0.415 ' NH1' ' OD2' ' A' ' 32' ' ' ASP . 0.0 OUTLIER -52.11 -38.0 55.94 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.221 -0.924 . . . . 0.0 110.194 179.934 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 43' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -80.05 -18.78 49.19 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.272 -0.893 . . . . 0.0 110.276 179.896 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -65.04 -72.19 0.16 Allowed 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.204 -0.935 . . . . 0.0 110.377 -179.958 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 45' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.62 113.54 0.85 Allowed 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.462 -0.774 . . . . 0.0 110.587 -179.348 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.616 0 CA-C-O 118.001 -1.0 . . . . 0.0 110.239 -179.905 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 1' ' ' LEU . . . . . 0.435 HD23 ' HB2' ' C' ' 4' ' ' GLU . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.657 0 CA-C-O 121.192 0.52 . . . . 0.0 110.248 . . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 2' ' ' LEU . . . . . 0.676 HD11 ' HB3' ' A' ' 23' ' ' LEU . 0.1 OUTLIER -174.43 -37.46 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.234 -0.916 . . . . 0.0 110.392 -179.881 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' C' C ' 3' ' ' ILE . . . . . . . . . . . . . 10.5 mt -63.44 -28.86 45.86 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.651 0 O-C-N 121.294 -0.879 . . . . 0.0 110.316 -179.918 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 4' ' ' GLU . . . . . 0.435 ' HB2' HD23 ' C' ' 1' ' ' LEU . 26.2 mt-10 -94.92 -20.23 19.58 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.175 -0.953 . . . . 0.0 110.352 -179.921 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 5' ' ' THR . . . . . . . . . . . . . 9.2 m -98.56 -19.67 17.47 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.29 -0.881 . . . . 0.0 110.448 -179.83 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 6' ' ' ALA . . . . . 0.449 ' O ' HG23 ' C' ' 10' ' ' VAL . . . -77.27 -58.95 2.99 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.088 -1.007 . . . . 0.0 110.445 -179.826 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 7' ' ' SER . . . . . . . . . . . . . 2.9 t -62.19 -36.24 81.29 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.179 -0.951 . . . . 0.0 110.537 -179.718 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 8' ' ' SER . . . . . . . . . . . . . 4.2 t -65.17 -42.35 93.75 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.134 -0.978 . . . . 0.0 110.341 -179.863 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 9' ' ' LEU . . . . . 0.525 HD11 ' OG1' ' B' ' 12' ' ' THR . 3.3 tt -70.03 -48.56 57.46 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.205 -0.934 . . . . 0.0 110.236 179.991 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 10' ' ' VAL . . . . . 0.583 HG11 ' HG3' ' A' ' 16' ' ' GLN . 87.7 t -58.77 -56.34 17.31 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.669 0 O-C-N 121.221 -0.925 . . . . 0.0 110.317 -179.923 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 11' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -52.2 -40.02 60.98 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.28 -0.887 . . . . 0.0 110.474 -179.795 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 12' ' ' ASN . . . . . . . . . . . . . 28.7 t30 -65.5 -29.32 69.96 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.174 -0.954 . . . . 0.0 110.381 -179.895 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 13' ' ' ALA . . . . . . . . . . . . . . . -79.57 -26.75 41.25 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.212 -0.93 . . . . 0.0 110.369 -179.915 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 14' ' ' ILE . . . . . 0.409 ' HA ' HD13 ' C' ' 14' ' ' ILE . 38.9 mm -89.21 -17.62 8.14 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.613 0 O-C-N 121.259 -0.901 . . . . 0.0 110.544 -179.995 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 15' ' ' GLN . . . . . . . . . . . . . 7.6 mm100 -94.21 -80.6 0.39 Allowed 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.048 -1.033 . . . . 0.0 110.348 -179.958 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 16' ' ' LEU . . . . . 0.535 HD22 ' OE1' ' B' ' 16' ' ' GLN . 0.6 OUTLIER 52.11 -161.7 0.09 Allowed 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.264 -0.898 . . . . 0.0 110.149 -179.819 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' C' C ' 17' ' ' SER . . . . . . . . . . . . . 32.9 p -84.69 4.39 32.81 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.183 -0.948 . . . . 0.0 110.691 -179.889 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 18' ' ' ILE . . . . . . . . . . . . . 82.7 mt -81.35 -45.84 20.56 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.609 0 O-C-N 121.022 -1.049 . . . . 0.0 110.121 179.84 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 19' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -98.77 35.61 1.82 Allowed 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.313 -0.867 . . . . 0.0 110.26 -179.978 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 20' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -142.38 -42.48 0.33 Allowed 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.229 -0.919 . . . . 0.0 110.265 -179.999 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 21' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -79.51 -50.31 10.94 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.307 -0.871 . . . . 0.0 110.145 -179.959 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 22' ' ' VAL . . . . . . . . . . . . . 98.5 t . . . . . 0 N--CA 1.491 1.582 0 CA-C-O 117.975 -1.012 . . . . 0.0 110.25 -179.981 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 57.8 m80 . . . . . 0 N--CA 1.492 1.665 0 CA-C-O 121.216 0.531 . . . . 0.0 110.277 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 55.29 172.44 0.03 OUTLIER 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.282 -0.886 . . . . 0.0 110.432 179.804 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -64.27 147.75 50.89 Favored Glycine 0 N--CA 1.49 2.252 0 N-CA-C 109.646 -1.382 . . . . 0.0 109.646 -179.973 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' HIS . . . . . 0.601 ' C ' HD12 ' A' ' 5' ' ' ILE . 0.2 OUTLIER -146.07 120.69 9.79 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.287 -1.125 . . . . 0.0 110.051 179.925 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 0.601 HD12 ' C ' ' A' ' 4' ' ' HIS . 4.6 mp -143.5 110.37 1.58 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.526 0 O-C-N 121.214 -0.929 . . . . 0.0 110.445 -179.874 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 1.5 mt-30 -124.24 37.61 4.37 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.361 -0.837 . . . . 0.0 109.931 179.73 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' ILE . . . . . 0.622 HG23 ' O ' ' A' ' 7' ' ' ILE . 3.3 tp -106.64 93.05 7.98 Favored Pre-proline 0 N--CA 1.487 1.388 0 O-C-N 121.333 -0.854 . . . . 0.0 110.323 -179.789 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 47.6 Cg_endo -73.46 112.56 3.56 Favored 'Trans proline' 0 C--N 1.312 -1.353 0 O-C-N 123.558 1.294 . . . . 0.0 110.512 179.903 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 49.3 Cg_endo -76.5 160.36 35.27 Favored 'Trans proline' 0 C--N 1.313 -1.331 0 O-C-N 123.562 1.296 . . . . 0.0 110.638 -179.99 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 135.76 -25.49 3.23 Favored Glycine 0 N--CA 1.491 2.333 0 N-CA-C 109.65 -1.38 . . . . 0.0 109.65 179.795 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 49.0 tp -58.52 -27.2 64.3 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.294 -1.121 . . . . 0.0 110.538 -179.889 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' THR . . . . . 0.709 HG23 HG23 ' C' ' 10' ' ' VAL . 86.6 m -68.37 -30.78 69.8 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.218 -0.926 . . . . 0.0 110.74 -179.658 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -76.8 -39.74 50.42 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.119 -0.988 . . . . 0.0 110.507 -179.66 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.719 HD21 ' CE1' ' A' ' 38' ' ' PHE . 7.7 tt -71.46 -36.76 71.31 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.13 -0.981 . . . . 0.0 110.511 -179.741 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.434 HD12 ' HA ' ' A' ' 15' ' ' LEU . 2.0 tp -65.55 -57.43 8.22 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.182 -0.949 . . . . 0.0 110.587 -179.708 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 16' ' ' GLN . . . . . 0.501 ' O ' HG23 ' A' ' 20' ' ' VAL . 0.9 OUTLIER -50.58 -34.88 27.48 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.129 -0.982 . . . . 0.0 110.242 -179.901 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -62.89 -50.13 66.42 Favored Glycine 0 N--CA 1.49 2.236 0 N-CA-C 109.245 -1.542 . . . . 0.0 109.245 179.651 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' TYR . . . . . 0.451 ' HA ' ' HG3' ' A' ' 21' ' ' GLU . 30.6 t80 -56.12 -41.46 75.33 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.244 -1.15 . . . . 0.0 110.119 179.807 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 57.6 m -61.52 -37.67 84.57 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.321 -0.862 . . . . 0.0 110.59 -179.803 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.501 HG23 ' O ' ' A' ' 16' ' ' GLN . 98.5 t -69.12 -22.09 25.82 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.72 0 O-C-N 121.264 -0.897 . . . . 0.0 110.437 -179.705 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.451 ' HG3' ' HA ' ' A' ' 18' ' ' TYR . 1.2 mt-10 -88.18 -48.48 7.67 Favored 'General case' 0 N--CA 1.499 2.016 0 O-C-N 121.209 -0.932 . . . . 0.0 108.818 179.666 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.447 HG23 ' O ' ' A' ' 18' ' ' TYR . 64.7 t -48.98 -31.63 4.2 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.473 0 O-C-N 121.75 -0.594 . . . . 0.0 110.339 179.936 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 1.036 HD22 HD13 ' C' ' 2' ' ' LEU . 0.1 OUTLIER -85.76 -40.15 16.38 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.268 -0.895 . . . . 0.0 110.158 -179.956 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -74.81 -52.66 10.83 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.169 -0.957 . . . . 0.0 110.289 179.933 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 25' ' ' GLN . . . . . 0.434 ' O ' ' CG ' ' A' ' 26' ' ' GLN . 3.8 mp0 -73.89 -19.4 60.72 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.225 -0.922 . . . . 0.0 110.603 -179.914 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 26' ' ' GLN . . . . . 0.434 ' CG ' ' O ' ' A' ' 25' ' ' GLN . 21.5 pt20 36.64 61.38 3.31 Favored Pre-proline 0 N--CA 1.506 2.343 0 O-C-N 121.937 -0.477 . . . . 0.0 111.912 -179.936 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 27' ' ' PRO . . . . . 0.504 ' HG3' ' CD2' ' A' ' 33' ' ' PHE . 44.1 Cg_endo -71.08 154.69 62.32 Favored 'Trans proline' 0 C--N 1.311 -1.4 0 O-C-N 123.564 1.297 . . . . 0.0 110.537 -179.957 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 46.2 Cg_endo -72.77 -42.69 1.05 Allowed 'Trans proline' 0 C--N 1.312 -1.387 0 O-C-N 123.734 1.386 . . . . 0.0 110.37 179.876 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 14.2 m-20 -113.85 122.89 48.4 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.31 -0.868 . . . . 0.0 110.14 179.887 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.7 HD21 HD12 ' B' ' 11' ' ' LEU . 0.2 OUTLIER -75.48 -47.11 28.57 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.169 -0.957 . . . . 0.0 110.195 179.971 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 39.9 t -50.28 -60.98 0.69 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.786 0 O-C-N 121.177 -0.952 . . . . 0.0 109.797 179.702 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 5.1 t0 -58.86 -39.51 81.56 Favored 'General case' 0 C--N 1.302 -1.49 0 O-C-N 121.653 -0.655 . . . . 0.0 109.808 179.526 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' PHE . . . . . 0.504 ' CD2' ' HG3' ' A' ' 27' ' ' PRO . 36.9 t80 -62.54 -46.58 87.74 Favored 'General case' 0 N--CA 1.488 1.436 0 O-C-N 121.163 -0.961 . . . . 0.0 109.526 179.44 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -56.13 -40.94 74.56 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.388 -0.82 . . . . 0.0 110.123 179.79 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.407 HG13 ' OG1' ' B' ' 39' ' ' THR . 97.9 t -64.74 -43.95 96.51 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.337 0 O-C-N 121.151 -0.968 . . . . 0.0 110.146 -179.979 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -63.04 -35.0 78.77 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.28 -0.887 . . . . 0.0 110.103 179.859 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' TYR . . . . . 0.419 ' CE1' ' OE2' ' A' ' 21' ' ' GLU . 20.4 t80 -69.08 -60.42 2.37 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.233 -0.917 . . . . 0.0 110.367 -179.841 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 38' ' ' PHE . . . . . 0.719 ' CE1' HD21 ' A' ' 14' ' ' LEU . 28.5 m-85 -61.68 -49.2 77.43 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.282 -0.886 . . . . 0.0 110.322 -179.791 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 39' ' ' THR . . . . . 0.493 ' OG1' HG13 ' B' ' 35' ' ' VAL . 55.7 m -51.79 -41.39 61.65 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.195 -0.941 . . . . 0.0 110.22 179.965 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 2.9 mtp180 -72.61 -30.22 64.17 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.235 -0.916 . . . . 0.0 109.963 179.766 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.443 ' O ' HD23 ' A' ' 41' ' ' LEU . 1.4 tt -56.73 -40.89 76.51 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.353 -0.842 . . . . 0.0 110.085 179.914 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -51.54 -29.02 15.4 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.227 -0.92 . . . . 0.0 110.438 179.999 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 -106.86 -2.93 20.86 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.232 -0.917 . . . . 0.0 110.88 -179.931 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -59.31 -75.86 0.05 Allowed 'General case' 0 N--CA 1.493 1.684 0 O-C-N 120.947 -1.095 . . . . 0.0 110.28 179.928 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 1.2 mmt-85 -51.44 -79.4 0.02 OUTLIER 'General case' 0 N--CA 1.487 1.403 0 O-C-N 121.544 -0.722 . . . . 0.0 110.3 -179.504 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 5.8 ptp180 . . . . . 0 N--CA 1.49 1.575 0 CA-C-O 118.049 -0.977 . . . . 0.0 110.104 179.721 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 1' ' ' HIS . . . . . . . . . . . . . 1.2 t-80 . . . . . 0 N--CA 1.491 1.589 0 CA-C-O 121.243 0.544 . . . . 0.0 110.251 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 2' ' ' MET . . . . . . . . . . . . . 3.3 mtm -92.03 -52.52 4.67 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.219 -0.925 . . . . 0.0 110.156 -179.989 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 3' ' ' GLY . . . . . . . . . . . . . . . -66.45 -121.21 0.01 OUTLIER Glycine 0 N--CA 1.489 2.208 0 N-CA-C 109.495 -1.442 . . . . 0.0 109.495 179.888 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 4' ' ' HIS . . . . . . . . . . . . . 43.5 t60 -168.13 57.63 0.06 Allowed 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.218 -1.166 . . . . 0.0 110.28 179.923 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 5' ' ' ILE . . . . . 0.4 HG22 ' H ' ' B' ' 5' ' ' ILE . 2.0 tp -101.97 145.15 12.25 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.599 0 O-C-N 121.216 -0.928 . . . . 0.0 110.09 179.934 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 6' ' ' GLN . . . . . . . . . . . . . 1.8 tp60 -142.06 67.85 1.32 Allowed 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.271 -0.893 . . . . 0.0 110.345 -179.877 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 7' ' ' ILE . . . . . . . . . . . . . 48.3 mm -121.57 98.37 46.06 Favored Pre-proline 0 N--CA 1.491 1.577 0 O-C-N 121.26 -0.9 . . . . 0.0 110.091 179.853 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 46.0 Cg_endo -71.82 113.33 3.62 Favored 'Trans proline' 0 C--N 1.31 -1.499 0 O-C-N 123.676 1.356 . . . . 0.0 110.417 -179.878 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 9' ' ' PRO . . . . . . . . . . . . . 48.2 Cg_endo -72.81 -174.88 1.65 Allowed 'Trans proline' 0 C--N 1.312 -1.345 0 O-C-N 123.559 1.294 . . . . 0.0 110.273 179.931 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 102.59 -38.28 3.28 Favored Glycine 0 N--CA 1.491 2.328 0 N-CA-C 109.296 -1.522 . . . . 0.0 109.296 -179.985 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 11' ' ' LEU . . . . . 0.7 HD12 HD21 ' A' ' 30' ' ' LEU . 0.7 OUTLIER -59.03 -36.49 75.08 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.327 -1.102 . . . . 0.0 110.09 179.962 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 22.1 m -51.93 -63.04 1.27 Allowed 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.234 -0.916 . . . . 0.0 110.302 179.895 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -57.6 -23.34 50.37 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.324 -0.86 . . . . 0.0 110.19 179.943 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 14' ' ' LEU . . . . . 0.561 HD23 ' HE1' ' B' ' 38' ' ' PHE . 0.0 OUTLIER -78.97 -33.74 44.86 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.234 -0.916 . . . . 0.0 110.087 179.965 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 15' ' ' LEU . . . . . 0.611 HD13 ' HG ' ' B' ' 11' ' ' LEU . 4.9 mp -80.27 -47.13 15.05 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.237 -0.914 . . . . 0.0 110.122 179.963 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 16' ' ' GLN . . . . . 0.761 ' O ' HG23 ' B' ' 20' ' ' VAL . 0.0 OUTLIER -53.73 -45.87 70.66 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.268 -0.895 . . . . 0.0 109.818 179.648 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 17' ' ' GLY . . . . . 0.412 ' O ' ' CG ' ' B' ' 21' ' ' GLU . . . -60.93 -50.96 61.78 Favored Glycine 0 N--CA 1.49 2.247 0 N-CA-C 109.293 -1.523 . . . . 0.0 109.293 179.632 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 18' ' ' TYR . . . . . 0.699 ' O ' HG23 ' B' ' 22' ' ' VAL . 25.8 t80 -53.72 -31.95 50.19 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.322 -1.104 . . . . 0.0 110.103 179.809 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 88.8 m -75.83 -29.31 58.58 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.37 -0.831 . . . . 0.0 110.13 179.949 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 20' ' ' VAL . . . . . 0.761 HG23 ' O ' ' B' ' 16' ' ' GLN . 39.9 t -78.5 -19.58 13.3 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.664 0 O-C-N 121.327 -0.858 . . . . 0.0 110.252 -179.982 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 21' ' ' GLU . . . . . 0.448 ' OE1' ' CE1' ' B' ' 37' ' ' TYR . 1.3 mt-10 -87.07 -42.62 12.93 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.243 -0.911 . . . . 0.0 108.868 179.851 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 22' ' ' VAL . . . . . 0.699 HG23 ' O ' ' B' ' 18' ' ' TYR . 51.9 t -64.52 -29.37 47.16 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.508 0 O-C-N 121.743 -0.598 . . . . 0.0 110.13 -179.918 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 23' ' ' LEU . . . . . 0.576 HD21 HD13 ' A' ' 7' ' ' ILE . 1.4 mt -75.78 -48.13 22.96 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.315 -0.866 . . . . 0.0 110.064 179.798 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 7.1 mpt_? -69.3 -70.68 0.26 Allowed 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.249 -0.907 . . . . 0.0 110.113 179.898 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -51.83 -41.02 61.47 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.237 -0.914 . . . . 0.0 110.408 179.94 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 52.15 66.21 5.34 Favored Pre-proline 0 N--CA 1.491 1.601 0 O-C-N 121.408 -0.808 . . . . 0.0 110.381 179.945 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 27' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_endo -71.35 159.99 50.05 Favored 'Trans proline' 0 C--N 1.311 -1.44 0 O-C-N 123.638 1.336 . . . . 0.0 110.531 179.873 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 44.7 Cg_endo -71.49 -35.23 8.39 Favored 'Trans proline' 0 C--N 1.311 -1.445 0 O-C-N 123.742 1.39 . . . . 0.0 110.27 179.771 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 29' ' ' ASP . . . . . 0.418 ' OD1' ' N ' ' B' ' 29' ' ' ASP . 38.2 p-10 -132.5 114.53 14.39 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.357 -0.839 . . . . 0.0 110.256 179.722 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 4.2 tp -67.91 -31.34 71.05 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.325 -0.86 . . . . 0.0 110.444 -179.829 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 31' ' ' VAL . . . . . 0.431 ' H ' HG23 ' B' ' 31' ' ' VAL . 44.6 t -49.77 -56.51 3.21 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.751 0 O-C-N 121.174 -0.954 . . . . 0.0 110.088 179.718 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 32' ' ' ASP . . . . . 0.403 ' HB2' ' OD2' ' B' ' 29' ' ' ASP . 0.9 OUTLIER -64.0 -45.63 88.12 Favored 'General case' 0 C--N 1.302 -1.482 0 O-C-N 121.577 -0.702 . . . . 0.0 110.102 179.919 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 33' ' ' PHE . . . . . . . . . . . . . 74.8 t80 -57.56 -40.07 78.1 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.045 -1.034 . . . . 0.0 109.628 179.519 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 34' ' ' ALA . . . . . 0.514 ' HB2' ' OH ' ' B' ' 18' ' ' TYR . . . -60.99 -43.67 98.51 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.338 -0.851 . . . . 0.0 109.992 179.668 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 35' ' ' VAL . . . . . 0.493 HG13 ' OG1' ' A' ' 39' ' ' THR . 58.9 t -70.53 -40.79 77.75 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.289 0 O-C-N 121.251 -0.906 . . . . 0.0 110.072 179.77 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -74.03 -21.58 59.9 Favored 'General case' 0 N--CA 1.487 1.404 0 O-C-N 121.293 -0.879 . . . . 0.0 109.712 179.961 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 37' ' ' TYR . . . . . 0.448 ' CE1' ' OE1' ' B' ' 21' ' ' GLU . 28.3 t80 -79.58 -64.46 1.18 Allowed 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.119 -0.988 . . . . 0.0 110.515 -179.864 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 38' ' ' PHE . . . . . 0.561 ' HE1' HD23 ' B' ' 14' ' ' LEU . 22.8 m-85 -60.04 -46.88 88.06 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.265 -0.897 . . . . 0.0 110.656 -179.613 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 39' ' ' THR . . . . . 0.407 ' OG1' HG13 ' A' ' 35' ' ' VAL . 72.9 m -53.68 -54.89 31.47 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.096 -1.002 . . . . 0.0 110.152 179.952 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 41.8 ttt180 -62.7 -22.62 66.63 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.225 -0.922 . . . . 0.0 110.019 179.688 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -59.67 -51.01 71.63 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.317 -0.864 . . . . 0.0 110.063 179.943 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -50.41 -24.93 3.39 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.22 -0.925 . . . . 0.0 110.545 179.969 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 43' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -102.02 13.49 34.6 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.248 -0.907 . . . . 0.0 110.872 -179.669 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -65.44 -75.05 0.09 Allowed 'General case' 0 N--CA 1.493 1.697 0 O-C-N 120.998 -1.064 . . . . 0.0 110.313 179.868 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 45' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -48.61 -61.88 1.8 Allowed 'General case' 0 N--CA 1.488 1.475 0 O-C-N 121.579 -0.701 . . . . 0.0 110.797 -179.203 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.54 0 CA-C-O 117.975 -1.012 . . . . 0.0 110.383 -179.793 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 1' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.492 1.659 0 CA-C-O 121.251 0.548 . . . . 0.0 110.193 . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 2' ' ' LEU . . . . . 1.036 HD13 HD22 ' A' ' 23' ' ' LEU . 67.7 tp -81.96 -21.02 37.41 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.261 -0.899 . . . . 0.0 110.162 -179.96 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 3' ' ' ILE . . . . . . . . . . . . . 47.2 mm -75.71 -36.73 34.42 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.576 0 O-C-N 121.213 -0.929 . . . . 0.0 110.19 -179.969 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 4' ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 -74.98 -3.91 35.12 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.34 -0.85 . . . . 0.0 110.747 -179.971 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 5' ' ' THR . . . . . . . . . . . . . 2.3 p -105.72 -66.58 0.98 Allowed 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.051 -1.03 . . . . 0.0 110.209 -179.915 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 6' ' ' ALA . . . . . . . . . . . . . . . -54.26 -43.78 71.27 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.318 -0.864 . . . . 0.0 110.205 -179.928 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 7' ' ' SER . . . . . 0.53 ' O ' HG12 ' C' ' 10' ' ' VAL . 8.5 t -57.64 -25.31 59.98 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.202 -0.936 . . . . 0.0 110.106 179.951 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 8' ' ' SER . . . . . . . . . . . . . 47.4 t -83.27 -24.5 32.23 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.268 -0.895 . . . . 0.0 110.051 179.84 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 9' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -75.97 -34.61 59.79 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.352 -0.843 . . . . 0.0 110.098 179.993 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 10' ' ' VAL . . . . . 0.709 HG23 HG23 ' A' ' 12' ' ' THR . 6.4 p -67.7 -24.21 30.63 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.56 0 O-C-N 121.311 -0.868 . . . . 0.0 110.072 179.916 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 11' ' ' LYS . . . . . . . . . . . . . 1.2 ttmt -76.17 -47.01 25.79 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.264 -0.898 . . . . 0.0 110.039 179.776 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 12' ' ' ASN . . . . . 0.508 ' O ' HD23 ' C' ' 16' ' ' LEU . 96.2 m-20 -67.32 -15.48 63.71 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.286 -0.884 . . . . 0.0 110.407 179.68 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 13' ' ' ALA . . . . . . . . . . . . . . . -101.44 -50.05 3.86 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.13 -0.981 . . . . 0.0 110.252 -179.953 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 14' ' ' ILE . . . . . 0.547 HG22 ' O ' ' C' ' 10' ' ' VAL . 2.5 tp -52.67 -23.67 5.37 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.629 0 O-C-N 121.278 -0.889 . . . . 0.0 110.265 -179.82 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 15' ' ' GLN . . . . . . . . . . . . . 17.7 mt-30 -85.26 -42.2 14.88 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.25 -0.906 . . . . 0.0 110.201 179.917 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 16' ' ' LEU . . . . . 0.508 HD23 ' O ' ' C' ' 12' ' ' ASN . 1.0 OUTLIER -53.22 -22.85 7.34 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.178 -0.951 . . . . 0.0 110.144 -179.989 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' C' C ' 17' ' ' SER . . . . . 0.431 ' C ' ' CG1' ' C' ' 18' ' ' ILE . 0.2 OUTLIER -85.83 53.41 2.77 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.31 -0.869 . . . . 0.0 110.314 -179.994 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' C' C ' 18' ' ' ILE . . . . . 0.605 HD12 ' HB2' ' C' ' 21' ' ' LEU . 2.3 pt 36.51 37.43 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.509 2.485 0 O-C-N 121.714 -0.616 . . . . 0.0 111.29 179.991 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 19' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER 51.25 52.97 13.77 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.215 -0.928 . . . . 0.0 109.024 -179.239 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 20' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 53.49 26.31 5.45 Favored 'General case' 0 N--CA 1.489 1.503 0 N-CA-C 108.354 -0.98 . . . . 0.0 108.354 -177.81 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 21' ' ' LEU . . . . . 0.605 ' HB2' HD12 ' C' ' 18' ' ' ILE . 0.5 OUTLIER 48.06 59.12 4.45 Favored 'General case' 0 N--CA 1.49 1.571 0 CA-C-O 121.943 0.878 . . . . 0.0 109.703 -178.937 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' C' C ' 22' ' ' VAL . . . . . . . . . . . . . 75.4 t . . . . . 0 N--CA 1.489 1.495 0 CA-C-O 117.995 -1.003 . . . . 0.0 110.095 -179.721 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 41.5 m80 . . . . . 0 N--CA 1.493 1.688 0 CA-C-O 121.253 0.549 . . . . 0.0 110.191 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 52.37 44.55 29.75 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.262 -0.898 . . . . 0.0 110.265 -179.918 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -173.07 72.28 0.1 OUTLIER Glycine 0 N--CA 1.49 2.282 0 N-CA-C 109.738 -1.345 . . . . 0.0 109.738 -179.944 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 2.0 t-160 -103.89 120.76 41.68 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.152 -1.205 . . . . 0.0 110.103 179.778 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 0.407 ' CG1' ' O ' ' A' ' 5' ' ' ILE . 0.9 OUTLIER -118.31 44.89 0.48 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.553 0 O-C-N 121.221 -0.924 . . . . 0.0 110.439 -179.775 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -126.87 -156.97 0.78 Allowed 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.204 -0.935 . . . . 0.0 110.298 -179.951 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 7' ' ' ILE . . . . . 0.634 ' N ' HD12 ' A' ' 7' ' ' ILE . 4.8 mp -88.28 122.25 69.83 Favored Pre-proline 0 N--CA 1.491 1.61 0 O-C-N 121.242 -0.911 . . . . 0.0 110.025 179.92 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 48.3 Cg_endo -73.92 117.81 5.17 Favored 'Trans proline' 0 C--N 1.313 -1.302 0 O-C-N 123.408 1.215 . . . . 0.0 110.383 -179.892 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 47.0 Cg_endo -73.79 -3.65 14.1 Favored 'Trans proline' 0 C--N 1.312 -1.349 0 O-C-N 123.474 1.25 . . . . 0.0 111.382 179.985 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -63.83 -24.24 68.11 Favored Glycine 0 N--CA 1.49 2.269 0 N-CA-C 109.34 -1.504 . . . . 0.0 109.34 179.679 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.51 ' O ' HD23 ' A' ' 15' ' ' LEU . 7.1 tt -66.23 -26.6 67.45 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.219 -1.165 . . . . 0.0 110.095 179.924 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 63.4 m -74.24 -28.98 61.49 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.293 -0.879 . . . . 0.0 110.055 179.868 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -71.51 -41.32 69.38 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.358 -0.839 . . . . 0.0 110.008 179.864 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 28.1 tp -72.72 -41.76 64.86 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.31 -0.869 . . . . 0.0 110.071 179.902 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.533 HD12 HD21 ' B' ' 15' ' ' LEU . 2.8 mm? -58.03 -50.02 74.85 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.2 -0.937 . . . . 0.0 110.116 179.902 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 16' ' ' GLN . . . . . 0.496 ' O ' HG23 ' A' ' 20' ' ' VAL . 3.3 mt-30 -55.04 -43.3 73.64 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.207 -0.933 . . . . 0.0 109.698 179.731 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -53.24 -36.69 53.24 Favored Glycine 0 N--CA 1.493 2.486 0 N-CA-C 109.185 -1.566 . . . . 0.0 109.185 179.486 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' TYR . . . . . 0.627 ' O ' HG23 ' A' ' 22' ' ' VAL . 28.2 t80 -69.91 -54.63 12.54 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.441 -1.034 . . . . 0.0 109.363 179.307 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.765 ' O ' HD12 ' A' ' 23' ' ' LEU . 47.8 m -52.47 -27.65 17.06 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.373 -0.829 . . . . 0.0 109.982 179.373 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.496 HG23 ' O ' ' A' ' 16' ' ' GLN . 43.9 t -71.54 -74.9 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.61 0 O-C-N 121.419 -0.801 . . . . 0.0 109.83 179.812 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.433 ' O ' ' CG ' ' A' ' 25' ' ' GLN . 21.8 pt-20 -48.54 -42.93 34.83 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.378 -0.826 . . . . 0.0 110.77 -179.665 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.673 HG11 HD11 ' A' ' 30' ' ' LEU . 97.1 t -55.2 -39.0 49.24 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.649 0 O-C-N 121.145 -0.972 . . . . 0.0 110.38 -179.815 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.765 HD12 ' O ' ' A' ' 19' ' ' THR . 30.7 mt -88.65 -22.71 23.3 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.211 -0.931 . . . . 0.0 110.295 -179.88 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -81.24 -37.63 28.25 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.189 -0.945 . . . . 0.0 110.264 179.994 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 25' ' ' GLN . . . . . 0.508 ' NE2' ' CE1' ' A' ' 33' ' ' PHE . 0.0 OUTLIER -105.72 -20.19 13.53 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.18 -0.95 . . . . 0.0 110.34 179.84 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 26' ' ' GLN . . . . . 0.419 ' N ' ' HG3' ' A' ' 25' ' ' GLN . 0.9 OUTLIER 47.82 83.23 0.22 Allowed Pre-proline 0 N--CA 1.494 1.735 0 O-C-N 121.197 -0.939 . . . . 0.0 110.655 -179.983 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 46.1 Cg_endo -72.91 160.83 45.13 Favored 'Trans proline' 0 C--N 1.311 -1.416 0 O-C-N 123.749 1.394 . . . . 0.0 110.446 179.957 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 43.0 Cg_endo -69.52 -25.39 29.77 Favored 'Trans proline' 0 C--N 1.312 -1.367 0 O-C-N 123.653 1.344 . . . . 0.0 110.256 179.936 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 33.3 m-20 -148.9 114.03 5.49 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.418 -0.801 . . . . 0.0 109.935 179.851 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.673 HD11 HG11 ' A' ' 22' ' ' VAL . 0.1 OUTLIER -57.38 -52.2 66.31 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.33 -0.856 . . . . 0.0 110.11 -179.866 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.413 ' O ' HG23 ' A' ' 35' ' ' VAL . 60.8 t -49.01 -62.14 0.49 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.699 0 O-C-N 121.291 -0.881 . . . . 0.0 110.15 179.742 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -55.91 -36.49 67.74 Favored 'General case' 0 C--N 1.3 -1.565 0 O-C-N 121.548 -0.72 . . . . 0.0 109.658 179.491 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 33' ' ' PHE . . . . . 0.508 ' CE1' ' NE2' ' A' ' 25' ' ' GLN . 55.5 t80 -66.1 -50.53 63.73 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.269 -0.895 . . . . 0.0 109.537 179.393 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.532 ' HB2' ' OH ' ' A' ' 18' ' ' TYR . . . -56.27 -38.51 71.29 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.397 -0.814 . . . . 0.0 109.798 179.535 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.543 HG13 ' OG1' ' B' ' 39' ' ' THR . 91.2 t -73.03 -34.57 46.05 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.339 0 O-C-N 121.373 -0.829 . . . . 0.0 109.993 179.782 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -80.43 -31.69 37.48 Favored 'General case' 0 C--N 1.303 -1.447 0 O-C-N 121.308 -0.87 . . . . 0.0 109.675 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 78.3 t80 -75.01 -65.3 0.89 Allowed 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.129 -0.982 . . . . 0.0 110.386 -179.859 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 12.9 m-85 -52.9 -49.56 65.69 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.228 -0.92 . . . . 0.0 110.626 -179.523 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' THR . . . . . 0.546 ' OG1' HG13 ' B' ' 35' ' ' VAL . 35.9 m -52.88 -37.71 60.81 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 120.989 -1.07 . . . . 0.0 110.037 179.944 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -72.35 -27.25 62.28 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.171 -0.955 . . . . 0.0 110.056 179.646 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 1.1 tt -65.35 -34.0 77.3 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.277 -0.89 . . . . 0.0 110.04 179.892 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.16 -24.15 62.8 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.299 -0.875 . . . . 0.0 109.894 179.72 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -76.7 -56.78 4.3 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.317 -0.864 . . . . 0.0 110.118 179.939 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -58.83 -69.45 0.19 Allowed 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.326 -0.859 . . . . 0.0 110.172 179.813 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -51.48 142.79 13.17 Favored 'General case' 0 C--N 1.303 -1.424 0 O-C-N 121.513 -0.742 . . . . 0.0 110.483 -179.354 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.661 0 CA-C-O 118.015 -0.993 . . . . 0.0 110.259 -179.995 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 1' ' ' HIS . . . . . 0.436 ' O ' ' N ' ' B' ' 3' ' ' GLY . 0.1 OUTLIER . . . . . 0 N--CA 1.491 1.621 0 CA-C-O 121.103 0.477 . . . . 0.0 110.318 . . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 2' ' ' MET . . . . . . . . . . . . . 15.0 mtt 56.71 -85.8 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.557 -0.714 . . . . 0.0 110.605 -179.925 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 3' ' ' GLY . . . . . 0.436 ' N ' ' O ' ' B' ' 1' ' ' HIS . . . 169.76 -160.93 34.18 Favored Glycine 0 N--CA 1.49 2.273 0 N-CA-C 109.505 -1.438 . . . . 0.0 109.505 -179.995 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 4' ' ' HIS . . . . . . . . . . . . . 35.8 p-80 -165.69 149.09 7.88 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.29 -1.123 . . . . 0.0 110.392 -179.991 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 5' ' ' ILE . . . . . 0.531 HG23 ' O ' ' B' ' 5' ' ' ILE . 6.0 tp -118.54 48.91 0.36 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.545 0 O-C-N 121.373 -0.83 . . . . 0.0 110.121 179.902 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 6' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -116.76 -154.96 0.57 Allowed 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.266 -0.896 . . . . 0.0 110.075 -179.997 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 7' ' ' ILE . . . . . . . . . . . . . 47.0 mm -94.4 138.32 22.45 Favored Pre-proline 0 N--CA 1.493 1.676 0 O-C-N 121.192 -0.943 . . . . 0.0 110.276 -179.803 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 49.0 Cg_endo -72.79 129.87 15.0 Favored 'Trans proline' 0 C--N 1.313 -1.34 0 O-C-N 123.541 1.285 . . . . 0.0 110.317 179.921 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 9' ' ' PRO . . . . . . . . . . . . . 49.5 Cg_endo -74.43 153.97 45.11 Favored 'Trans proline' 0 C--N 1.311 -1.397 0 O-C-N 123.497 1.261 . . . . 0.0 110.477 -179.968 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 111.58 -25.05 14.04 Favored Glycine 0 N--CA 1.49 2.292 0 N-CA-C 109.553 -1.419 . . . . 0.0 109.553 179.889 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -69.05 -22.91 64.0 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.224 -1.162 . . . . 0.0 110.214 -179.986 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 91.6 m -78.96 -35.11 43.65 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.159 -0.963 . . . . 0.0 110.281 -179.956 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 28.1 mt-10 -65.88 -44.25 85.88 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.191 -0.943 . . . . 0.0 110.389 -179.928 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -67.89 -32.87 73.65 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.239 -0.913 . . . . 0.0 110.545 -179.803 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 15' ' ' LEU . . . . . 0.533 HD21 HD12 ' A' ' 15' ' ' LEU . 2.5 mp -77.76 -42.32 34.51 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.192 -0.943 . . . . 0.0 110.559 -179.733 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 16' ' ' GLN . . . . . 0.735 ' O ' HG23 ' B' ' 20' ' ' VAL . 0.9 OUTLIER -53.16 -44.03 67.5 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.035 -1.041 . . . . 0.0 110.011 179.93 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 17' ' ' GLY . . . . . . . . . . . . . . . -62.26 -51.42 56.72 Favored Glycine 0 N--CA 1.489 2.2 0 N-CA-C 109.346 -1.502 . . . . 0.0 109.346 179.902 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 18' ' ' TYR . . . . . 0.564 ' O ' HG23 ' B' ' 22' ' ' VAL . 16.3 t80 -56.12 -33.78 65.46 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.341 -1.093 . . . . 0.0 110.279 179.895 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 62.6 m -71.55 -31.76 67.36 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.26 -0.9 . . . . 0.0 110.354 -179.887 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 20' ' ' VAL . . . . . 0.735 HG23 ' O ' ' B' ' 16' ' ' GLN . 48.6 t -75.14 -17.47 16.07 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.645 0 O-C-N 121.271 -0.893 . . . . 0.0 110.487 -179.885 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 21' ' ' GLU . . . . . 0.449 ' HG3' ' HA ' ' B' ' 18' ' ' TYR . 0.8 OUTLIER -89.15 -50.31 6.23 Favored 'General case' 0 N--CA 1.497 1.92 0 O-C-N 121.137 -0.977 . . . . 0.0 109.281 179.906 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 22' ' ' VAL . . . . . 0.564 HG23 ' O ' ' B' ' 18' ' ' TYR . 23.8 t -60.79 -24.59 32.81 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.515 0 O-C-N 121.776 -0.577 . . . . 0.0 110.323 -179.637 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 23' ' ' LEU . . . . . 0.476 HD23 ' HA ' ' B' ' 23' ' ' LEU . 6.8 mt -90.15 -31.65 16.99 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.214 -0.929 . . . . 0.0 110.492 -179.835 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -87.4 -51.71 5.79 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.189 -0.944 . . . . 0.0 110.591 -179.643 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 25' ' ' GLN . . . . . 0.425 ' O ' ' HG3' ' B' ' 26' ' ' GLN . 14.0 tp60 -85.15 -19.77 31.26 Favored 'General case' 0 N--CA 1.486 1.335 0 O-C-N 121.146 -0.971 . . . . 0.0 110.477 -179.557 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 26' ' ' GLN . . . . . 0.425 ' HG3' ' O ' ' B' ' 25' ' ' GLN . 9.0 pt20 36.26 74.82 0.55 Allowed Pre-proline 0 N--CA 1.507 2.376 0 O-C-N 121.81 -0.556 . . . . 0.0 111.893 -179.92 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 27' ' ' PRO . . . . . . . . . . . . . 44.4 Cg_endo -70.04 166.94 26.26 Favored 'Trans proline' 0 C--N 1.311 -1.429 0 O-C-N 123.532 1.28 . . . . 0.0 110.565 179.887 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 45.4 Cg_endo -71.79 -52.96 0.18 Allowed 'Trans proline' 0 C--N 1.313 -1.317 0 O-C-N 123.611 1.322 . . . . 0.0 110.551 -179.969 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -114.66 122.26 45.92 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.225 -0.922 . . . . 0.0 110.195 -179.899 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 3.8 tp -74.59 -39.44 62.2 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.194 -0.941 . . . . 0.0 110.264 179.957 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 86.2 t -49.73 -66.81 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.711 0 O-C-N 121.169 -0.957 . . . . 0.0 110.097 179.726 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 1.5 t0 -56.28 -38.44 71.19 Favored 'General case' 0 C--N 1.301 -1.536 0 O-C-N 121.626 -0.671 . . . . 0.0 110.101 179.744 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 33' ' ' PHE . . . . . . . . . . . . . 69.5 t80 -62.95 -44.38 96.22 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.215 -0.928 . . . . 0.0 109.845 179.747 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 34' ' ' ALA . . . . . 0.477 ' HB2' ' OH ' ' B' ' 18' ' ' TYR . . . -56.44 -31.93 64.42 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.206 -0.934 . . . . 0.0 109.78 179.65 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 35' ' ' VAL . . . . . 0.546 HG13 ' OG1' ' A' ' 39' ' ' THR . 89.9 t -73.91 -53.57 17.27 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.37 0 O-C-N 121.303 -0.873 . . . . 0.0 110.097 179.8 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -59.55 -24.75 63.97 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.342 -0.849 . . . . 0.0 110.491 -179.779 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 37' ' ' TYR . . . . . 0.432 ' CD2' ' CD1' ' B' ' 18' ' ' TYR . 14.2 t80 -78.66 -69.03 0.59 Allowed 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.191 -0.943 . . . . 0.0 110.54 -179.751 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 38' ' ' PHE . . . . . 0.411 ' HB2' HG22 ' A' ' 35' ' ' VAL . 26.0 m-85 -53.53 -39.24 64.53 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.2 -0.937 . . . . 0.0 110.165 -179.832 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 39' ' ' THR . . . . . 0.543 ' OG1' HG13 ' A' ' 35' ' ' VAL . 55.2 m -57.71 -49.91 74.97 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.145 -0.972 . . . . 0.0 109.901 179.835 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 40' ' ' ARG . . . . . 0.521 ' O ' ' HB2' ' B' ' 44' ' ' ALA . 0.0 OUTLIER -68.0 -24.1 65.08 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.222 -0.924 . . . . 0.0 109.936 179.873 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -69.52 -31.48 69.74 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.352 -0.843 . . . . 0.0 110.128 179.807 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -74.26 -40.73 62.16 Favored 'General case' 0 C--N 1.305 -1.352 0 O-C-N 121.329 -0.857 . . . . 0.0 109.688 179.916 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 43' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 -101.48 14.71 31.13 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.329 -0.857 . . . . 0.0 110.36 179.838 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 44' ' ' ALA . . . . . 0.521 ' HB2' ' O ' ' B' ' 40' ' ' ARG . . . -62.89 -63.36 1.23 Allowed 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.164 -0.96 . . . . 0.0 110.496 -179.982 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 45' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -48.14 -69.11 0.13 Allowed 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.487 -0.758 . . . . 0.0 110.732 -179.164 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 18.9 ttt180 . . . . . 0 N--CA 1.491 1.625 0 CA-C-O 117.964 -1.017 . . . . 0.0 110.204 179.909 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' C' C ' 1' ' ' LEU . . . . . . . . . . . . . 1.3 pp . . . . . 0 N--CA 1.494 1.756 0 CA-C-O 121.375 0.607 . . . . 0.0 110.209 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' C' C ' 2' ' ' LEU . . . . . 0.427 HD21 HD13 ' A' ' 23' ' ' LEU . 0.5 OUTLIER -175.61 -39.01 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.243 -0.911 . . . . 0.0 110.159 -179.946 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' C' C ' 3' ' ' ILE . . . . . . . . . . . . . 1.5 tt -70.09 -18.07 21.44 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.66 0 O-C-N 121.319 -0.863 . . . . 0.0 110.462 -179.878 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 4' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -78.95 -44.13 23.12 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.112 -0.993 . . . . 0.0 110.32 -179.861 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 5' ' ' THR . . . . . 0.509 HG23 ' N ' ' C' ' 6' ' ' ALA . 13.5 t -83.17 -41.83 18.01 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.269 -0.894 . . . . 0.0 110.211 -179.754 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 6' ' ' ALA . . . . . 0.509 ' N ' HG23 ' C' ' 5' ' ' THR . . . -54.58 -45.63 73.61 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.441 -0.787 . . . . 0.0 110.295 -179.998 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 7' ' ' SER . . . . . . . . . . . . . 61.4 p -75.69 -28.42 58.64 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.211 -0.931 . . . . 0.0 110.337 -179.944 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 8' ' ' SER . . . . . . . . . . . . . 12.6 t -79.5 -33.31 42.24 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.309 -0.869 . . . . 0.0 110.363 -179.953 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 9' ' ' LEU . . . . . . . . . . . . . 7.1 tt -66.52 -53.0 39.78 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.191 -0.943 . . . . 0.0 110.361 -179.83 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 10' ' ' VAL . . . . . . . . . . . . . 25.8 m -58.62 -26.15 30.48 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.693 0 O-C-N 121.282 -0.887 . . . . 0.0 110.291 -179.795 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 11' ' ' LYS . . . . . 0.41 ' O ' ' NE2' ' C' ' 15' ' ' GLN . 1.2 ttmm -68.94 -52.39 29.72 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.328 -0.857 . . . . 0.0 110.311 -179.806 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 12' ' ' ASN . . . . . . . . . . . . . 13.8 t30 -64.17 -17.62 63.69 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.195 -0.941 . . . . 0.0 110.513 -179.979 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 13' ' ' ALA . . . . . . . . . . . . . . . -87.14 -54.51 4.28 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.131 -0.98 . . . . 0.0 110.504 -179.836 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 14' ' ' ILE . . . . . 0.551 ' O ' HD12 ' C' ' 18' ' ' ILE . 35.4 mm -53.72 -26.96 14.64 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.653 0 O-C-N 121.227 -0.921 . . . . 0.0 110.311 -179.751 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 15' ' ' GLN . . . . . 0.41 ' NE2' ' O ' ' C' ' 11' ' ' LYS . 0.9 OUTLIER -86.98 -33.77 19.5 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.191 -0.943 . . . . 0.0 110.223 -179.991 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' C' C ' 16' ' ' LEU . . . . . . . . . . . . . 4.1 tp -53.64 -52.71 59.03 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.25 -0.906 . . . . 0.0 110.21 -179.868 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 17' ' ' SER . . . . . . . . . . . . . 8.9 p -59.93 -51.02 71.46 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.276 -0.89 . . . . 0.0 110.112 179.967 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 18' ' ' ILE . . . . . 0.551 HD12 ' O ' ' C' ' 14' ' ' ILE . 79.9 mt -61.12 -34.73 61.5 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.62 0 O-C-N 121.273 -0.892 . . . . 0.0 110.177 -179.97 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 19' ' ' GLU . . . . . . . . . . . . . 46.0 tt0 -68.44 -46.74 69.03 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.255 -0.903 . . . . 0.0 110.242 -179.952 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 20' ' ' GLN . . . . . . . . . . . . . 23.3 tt0 -67.3 -20.71 65.66 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.224 -0.922 . . . . 0.0 110.266 -179.985 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 21' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -62.99 -36.32 83.12 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.256 -0.903 . . . . 0.0 110.224 179.991 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 22' ' ' VAL . . . . . . . . . . . . . 61.3 t . . . . . 0 N--CA 1.491 1.586 0 CA-C-O 118.042 -0.98 . . . . 0.0 110.315 179.984 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 3.9 m80 . . . . . 0 N--CA 1.491 1.623 0 CA-C-O 121.202 0.525 . . . . 0.0 110.233 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -171.75 -174.93 1.44 Allowed 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.183 -0.948 . . . . 0.0 110.421 179.988 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 105.58 98.38 2.55 Favored Glycine 0 N--CA 1.49 2.272 0 N-CA-C 109.501 -1.439 . . . . 0.0 109.501 179.983 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -121.78 -32.9 3.68 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.192 -1.181 . . . . 0.0 110.338 -179.933 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 46.6 mm -120.84 141.91 39.19 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.651 0 O-C-N 121.246 -0.909 . . . . 0.0 110.32 -179.972 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 17.8 pt20 -101.39 -153.48 0.46 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.319 -0.863 . . . . 0.0 109.967 179.835 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 38.8 mm -52.1 117.84 10.95 Favored Pre-proline 0 N--CA 1.492 1.645 0 O-C-N 121.103 -0.998 . . . . 0.0 110.051 179.999 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 44.9 Cg_endo -70.18 118.45 5.69 Favored 'Trans proline' 0 C--N 1.313 -1.303 0 O-C-N 123.492 1.259 . . . . 0.0 110.668 -179.788 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 46.6 Cg_endo -72.7 -164.59 0.19 Allowed 'Trans proline' 0 C--N 1.314 -1.273 0 O-C-N 123.451 1.237 . . . . 0.0 110.442 179.916 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 94.05 -36.01 3.94 Favored Glycine 0 N--CA 1.491 2.325 0 N-CA-C 109.63 -1.388 . . . . 0.0 109.63 179.867 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.466 HD21 HG11 ' B' ' 22' ' ' VAL . 0.1 OUTLIER -66.66 -32.48 73.83 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.218 -1.166 . . . . 0.0 110.242 179.997 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 12' ' ' THR . . . . . 0.408 HG23 HG11 ' C' ' 10' ' ' VAL . 65.9 m -57.42 -63.18 1.32 Allowed 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.268 -0.895 . . . . 0.0 110.355 -179.806 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -51.0 -41.15 59.58 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.295 -0.878 . . . . 0.0 110.533 -179.86 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -64.32 -42.79 96.15 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.317 -0.865 . . . . 0.0 110.28 -179.891 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.78 HD22 HD11 ' B' ' 15' ' ' LEU . 59.8 mt -70.24 -47.4 61.53 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.195 -0.941 . . . . 0.0 110.14 -179.934 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 16' ' ' GLN . . . . . 0.404 ' O ' HG23 ' A' ' 20' ' ' VAL . 0.0 OUTLIER -54.49 -39.91 68.0 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.158 -0.964 . . . . 0.0 109.947 179.882 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 17' ' ' GLY . . . . . 0.405 ' O ' ' HG3' ' A' ' 21' ' ' GLU . . . -57.04 -49.81 68.93 Favored Glycine 0 N--CA 1.49 2.266 0 N-CA-C 109.202 -1.559 . . . . 0.0 109.202 179.671 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 18' ' ' TYR . . . . . 0.603 ' O ' HG23 ' A' ' 22' ' ' VAL . 23.7 t80 -58.65 -21.39 53.88 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.358 -1.083 . . . . 0.0 110.109 179.729 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 1.3 m -82.77 -28.57 30.26 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.285 -0.884 . . . . 0.0 110.077 -179.992 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.404 HG23 ' O ' ' A' ' 16' ' ' GLN . 61.6 t -79.92 -18.1 12.6 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.701 0 O-C-N 121.356 -0.84 . . . . 0.0 110.294 179.997 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.405 ' HG3' ' O ' ' A' ' 17' ' ' GLY . 1.0 OUTLIER -90.79 -46.99 7.9 Favored 'General case' 0 N--CA 1.499 1.986 0 O-C-N 121.131 -0.981 . . . . 0.0 109.09 179.939 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.603 HG23 ' O ' ' A' ' 18' ' ' TYR . 86.1 t -59.71 -38.52 76.25 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.512 0 O-C-N 121.669 -0.644 . . . . 0.0 110.029 -179.976 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -75.87 -36.28 59.61 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.347 -0.846 . . . . 0.0 109.959 179.701 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.98 -26.12 53.54 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.288 -0.883 . . . . 0.0 110.233 179.928 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 73.4 mm-40 -97.96 -38.58 9.34 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.257 -0.902 . . . . 0.0 110.409 -179.856 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 1.7 mt-30 53.35 56.54 13.93 Favored Pre-proline 0 N--CA 1.492 1.634 0 O-C-N 121.247 -0.908 . . . . 0.0 110.028 -179.834 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 45.0 Cg_endo -71.09 156.9 58.96 Favored 'Trans proline' 0 C--N 1.312 -1.387 0 O-C-N 123.757 1.399 . . . . 0.0 110.606 -179.798 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 44.6 Cg_endo -70.93 -21.31 28.22 Favored 'Trans proline' 0 C--N 1.312 -1.371 0 O-C-N 123.768 1.404 . . . . 0.0 110.469 179.9 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 4.4 p-10 -139.36 123.61 18.03 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.28 -0.888 . . . . 0.0 110.204 179.987 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 5.3 tp -88.82 -31.04 18.52 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.2 -0.938 . . . . 0.0 110.125 179.851 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.435 HG23 ' H ' ' A' ' 31' ' ' VAL . 42.9 t -50.71 -58.4 1.83 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.769 0 O-C-N 121.27 -0.894 . . . . 0.0 110.124 179.865 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 8.0 t0 -64.23 -42.88 96.36 Favored 'General case' 0 C--N 1.302 -1.487 0 O-C-N 121.509 -0.745 . . . . 0.0 110.12 179.87 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 89.4 t80 -61.57 -40.32 94.31 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.212 -0.93 . . . . 0.0 109.904 179.722 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.467 ' HB2' ' OH ' ' A' ' 18' ' ' TYR . . . -56.72 -37.28 70.74 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.279 -0.888 . . . . 0.0 110.204 179.905 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.467 HG13 ' OG1' ' B' ' 39' ' ' THR . 90.1 t -74.18 -37.79 46.93 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.346 0 O-C-N 121.277 -0.889 . . . . 0.0 110.403 -179.798 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -68.76 -37.95 79.74 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.187 -0.945 . . . . 0.0 110.507 -179.819 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 33.0 t80 -63.99 -56.76 12.74 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.222 -0.924 . . . . 0.0 110.592 -179.691 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 20.0 m-85 -68.15 -48.75 64.52 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.252 -0.905 . . . . 0.0 110.908 -179.391 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' THR . . . . . 0.508 ' OG1' HG13 ' B' ' 35' ' ' VAL . 55.5 m -52.17 -46.73 65.61 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.048 -1.033 . . . . 0.0 110.209 -179.786 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 7.1 ttt-85 -64.13 -29.0 70.15 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.199 -0.938 . . . . 0.0 110.018 179.83 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -64.82 -28.27 69.45 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.338 -0.851 . . . . 0.0 110.279 179.982 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.07 -22.02 62.17 Favored 'General case' 0 C--N 1.306 -1.307 0 O-C-N 121.212 -0.93 . . . . 0.0 109.853 179.871 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -106.8 -12.52 15.49 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.228 -0.92 . . . . 0.0 110.549 179.9 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -52.63 -55.01 25.49 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.08 -1.012 . . . . 0.0 110.705 -179.782 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 3.6 tpm_? -47.03 -43.99 20.15 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.585 -0.697 . . . . 0.0 110.836 -178.833 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 28.7 mtt85 . . . . . 0 N--CA 1.49 1.56 0 CA-C-O 117.983 -1.008 . . . . 0.0 110.223 179.848 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 1' ' ' HIS . . . . . . . . . . . . . 1.5 t-160 . . . . . 0 N--CA 1.491 1.59 0 CA-C-O 121.287 0.565 . . . . 0.0 110.192 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 2' ' ' MET . . . . . . . . . . . . . 11.9 mmt -128.92 -57.4 1.17 Allowed 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.348 -0.845 . . . . 0.0 110.045 179.891 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 3' ' ' GLY . . . . . . . . . . . . . . . 127.9 122.11 2.47 Favored Glycine 0 N--CA 1.491 2.357 0 N-CA-C 109.602 -1.399 . . . . 0.0 109.602 179.863 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 4' ' ' HIS . . . . . . . . . . . . . 6.3 t60 -100.31 -25.53 14.21 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.246 -1.15 . . . . 0.0 110.132 179.93 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 5' ' ' ILE . . . . . 0.414 ' H ' HG22 ' B' ' 5' ' ' ILE . 1.2 tt -104.27 147.1 10.8 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.602 0 O-C-N 121.236 -0.915 . . . . 0.0 110.214 179.918 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 6' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -153.68 48.76 0.66 Allowed 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.247 -0.908 . . . . 0.0 110.22 179.958 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 7' ' ' ILE . . . . . 0.502 HG13 HG21 ' C' ' 5' ' ' THR . 47.2 mm -122.04 121.59 27.93 Favored Pre-proline 0 N--CA 1.491 1.612 0 O-C-N 121.215 -0.928 . . . . 0.0 110.147 179.97 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 48.8 Cg_endo -73.33 116.46 4.71 Favored 'Trans proline' 0 C--N 1.313 -1.295 0 O-C-N 123.469 1.247 . . . . 0.0 110.614 -179.808 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 9' ' ' PRO . . . . . . . . . . . . . 48.3 Cg_endo -75.14 -172.91 1.4 Allowed 'Trans proline' 0 C--N 1.312 -1.355 0 O-C-N 123.551 1.29 . . . . 0.0 110.33 179.797 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 94.37 -18.88 56.07 Favored Glycine 0 N--CA 1.491 2.335 0 N-CA-C 109.822 -1.311 . . . . 0.0 109.822 -179.963 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 11' ' ' LEU . . . . . 0.618 HD23 ' O ' ' B' ' 11' ' ' LEU . 3.3 tt -88.53 -19.32 26.53 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.183 -1.186 . . . . 0.0 110.367 -180.0 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 64.8 m -63.55 -50.55 69.05 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.193 -0.942 . . . . 0.0 110.398 -179.88 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -51.53 -34.52 36.67 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.302 -0.874 . . . . 0.0 110.34 -179.892 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -69.14 -55.69 9.92 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.294 -0.879 . . . . 0.0 110.145 179.983 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 15' ' ' LEU . . . . . 0.78 HD11 HD22 ' A' ' 15' ' ' LEU . 1.0 OUTLIER -55.35 -41.2 72.19 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.214 -0.929 . . . . 0.0 109.919 179.872 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 1.7 tt0 -59.29 -39.23 82.34 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.233 -0.917 . . . . 0.0 109.734 179.679 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 17' ' ' GLY . . . . . . . . . . . . . . . -62.39 -39.67 98.07 Favored Glycine 0 N--CA 1.489 2.225 0 N-CA-C 109.152 -1.579 . . . . 0.0 109.152 179.621 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 18' ' ' TYR . . . . . 0.607 ' OH ' ' HB2' ' B' ' 34' ' ' ALA . 16.8 t80 -71.56 -43.91 65.5 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.261 -1.14 . . . . 0.0 109.935 179.676 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 10.3 m -53.55 -35.42 60.72 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.346 -0.846 . . . . 0.0 109.919 179.683 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 42.2 t -69.76 -73.62 0.1 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.614 0 O-C-N 121.364 -0.835 . . . . 0.0 109.904 179.769 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 7.8 pt-20 -46.75 -42.96 17.66 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.449 -0.782 . . . . 0.0 110.912 -179.752 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 22' ' ' VAL . . . . . 0.51 HG23 ' O ' ' B' ' 18' ' ' TYR . 55.1 t -57.47 -36.25 52.71 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.622 0 O-C-N 121.108 -0.995 . . . . 0.0 109.506 179.445 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 8.2 tp -89.47 -22.32 22.54 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.347 -0.846 . . . . 0.0 109.964 179.612 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -86.85 -61.89 1.63 Allowed 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.268 -0.895 . . . . 0.0 110.139 179.782 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 29.5 mm-40 -58.84 -33.09 70.03 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.313 -0.867 . . . . 0.0 110.271 179.968 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER 49.7 59.92 16.05 Favored Pre-proline 0 N--CA 1.492 1.656 0 O-C-N 121.326 -0.859 . . . . 0.0 110.411 -179.903 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 27' ' ' PRO . . . . . . . . . . . . . 45.3 Cg_endo -71.52 158.52 53.67 Favored 'Trans proline' 0 C--N 1.311 -1.446 0 O-C-N 123.81 1.427 . . . . 0.0 110.523 -179.859 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 44.0 Cg_endo -70.16 -37.9 7.6 Favored 'Trans proline' 0 C--N 1.311 -1.435 0 O-C-N 123.704 1.371 . . . . 0.0 110.113 179.769 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -127.47 119.35 25.9 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.286 -0.884 . . . . 0.0 109.924 179.677 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 5.0 tp -73.49 -29.85 62.77 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.249 -0.907 . . . . 0.0 110.299 -179.731 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 42.0 t -52.19 -64.79 0.34 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.664 0 O-C-N 121.177 -0.952 . . . . 0.0 110.052 179.749 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 11.8 t0 -56.7 -42.6 79.41 Favored 'General case' 0 C--N 1.302 -1.458 0 O-C-N 121.444 -0.785 . . . . 0.0 110.171 179.806 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 33' ' ' PHE . . . . . . . . . . . . . 22.9 t80 -60.06 -53.58 56.1 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.163 -0.96 . . . . 0.0 109.783 179.497 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 34' ' ' ALA . . . . . 0.607 ' HB2' ' OH ' ' B' ' 18' ' ' TYR . . . -51.01 -33.31 24.39 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.369 -0.832 . . . . 0.0 110.296 179.679 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 35' ' ' VAL . . . . . 0.508 HG13 ' OG1' ' A' ' 39' ' ' THR . 88.9 t -79.44 -41.54 22.51 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.406 0 O-C-N 121.166 -0.959 . . . . 0.0 110.222 179.946 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -66.51 -39.04 88.47 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.307 -0.871 . . . . 0.0 110.548 -179.783 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 37' ' ' TYR . . . . . . . . . . . . . 61.1 t80 -67.14 -66.72 0.52 Allowed 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.136 -0.978 . . . . 0.0 110.423 -179.691 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 10.6 m-85 -51.26 -48.84 62.08 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.142 -0.974 . . . . 0.0 110.519 -179.586 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 39' ' ' THR . . . . . 0.467 ' OG1' HG13 ' A' ' 35' ' ' VAL . 45.6 m -53.75 -32.44 52.27 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.096 -1.003 . . . . 0.0 109.905 179.961 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -76.14 -30.5 58.18 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.174 -0.954 . . . . 0.0 109.775 179.589 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -61.9 -28.64 69.65 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.318 -0.864 . . . . 0.0 109.823 179.563 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.43 -22.11 65.53 Favored 'General case' 0 C--N 1.304 -1.391 0 O-C-N 121.363 -0.836 . . . . 0.0 109.91 179.793 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 43' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -71.2 -28.37 64.17 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.27 -0.894 . . . . 0.0 110.198 -179.884 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -66.4 -78.64 0.05 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.302 -0.874 . . . . 0.0 110.371 -179.95 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 45' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 51.22 -179.66 0.02 OUTLIER 'General case' 0 C--N 1.304 -1.408 0 O-C-N 121.663 -0.648 . . . . 0.0 110.519 -179.526 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.49 1.572 0 CA-C-O 118.002 -0.999 . . . . 0.0 110.304 -179.977 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 1' ' ' LEU . . . . . . . . . . . . . 3.9 mp . . . . . 0 N--CA 1.492 1.642 0 CA-C-O 121.266 0.555 . . . . 0.0 110.153 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' C' C ' 2' ' ' LEU . . . . . . . . . . . . . 1.1 pp -76.87 -22.88 52.83 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.259 -0.901 . . . . 0.0 110.155 179.967 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 3' ' ' ILE . . . . . . . . . . . . . 5.3 mt -58.28 -58.05 8.17 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.64 0 O-C-N 121.295 -0.878 . . . . 0.0 110.176 179.912 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 4' ' ' GLU . . . . . . . . . . . . . 6.8 tm-20 -53.36 -41.18 65.56 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.204 -0.935 . . . . 0.0 109.968 179.976 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 5' ' ' THR . . . . . 0.502 HG21 HG13 ' B' ' 7' ' ' ILE . 1.3 m -63.32 -34.08 76.91 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.289 -0.882 . . . . 0.0 109.892 179.886 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 6' ' ' ALA . . . . . . . . . . . . . . . -75.77 -32.62 60.02 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.281 -0.887 . . . . 0.0 110.101 179.934 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 7' ' ' SER . . . . . . . . . . . . . 27.8 t -68.6 -34.53 75.93 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.192 -0.943 . . . . 0.0 110.187 179.899 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 8' ' ' SER . . . . . . . . . . . . . 46.7 t -67.94 -32.96 73.77 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.341 -0.85 . . . . 0.0 110.285 179.89 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 9' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -68.35 -36.02 78.62 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.176 -0.952 . . . . 0.0 110.17 179.919 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 10' ' ' VAL . . . . . 0.408 HG11 HG23 ' A' ' 12' ' ' THR . 95.0 t -57.53 -44.25 84.59 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 O-C-N 121.293 -0.879 . . . . 0.0 110.125 -179.978 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.18 -55.38 34.54 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.377 -0.827 . . . . 0.0 110.192 179.951 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 12' ' ' ASN . . . . . . . . . . . . . 1.2 m-80 -60.34 -26.73 66.81 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.289 -0.882 . . . . 0.0 110.384 -179.877 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 13' ' ' ALA . . . . . . . . . . . . . . . -72.51 -46.58 53.99 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.189 -0.944 . . . . 0.0 110.251 -179.861 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 14' ' ' ILE . . . . . 0.4 HD12 HG23 ' C' ' 14' ' ' ILE . 49.8 mm -71.32 -22.42 22.32 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.64 0 O-C-N 121.256 -0.902 . . . . 0.0 110.309 -179.878 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 15' ' ' GLN . . . . . 0.401 ' O ' ' N ' ' C' ' 17' ' ' SER . 12.3 mt-30 -82.81 -46.13 13.45 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.227 -0.921 . . . . 0.0 110.349 179.986 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 16' ' ' LEU . . . . . 0.439 ' HA ' HD23 ' C' ' 16' ' ' LEU . 71.2 mt -69.85 65.17 0.22 Allowed 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.301 -0.874 . . . . 0.0 110.13 179.948 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 17' ' ' SER . . . . . 0.401 ' N ' ' O ' ' C' ' 15' ' ' GLN . 13.5 p -177.16 -70.1 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.281 -0.887 . . . . 0.0 109.914 -179.95 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 18' ' ' ILE . . . . . . . . . . . . . 31.4 pt -69.88 -20.73 23.58 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.593 0 O-C-N 121.314 -0.866 . . . . 0.0 110.187 179.79 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 19' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -98.39 14.94 26.3 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.219 -0.926 . . . . 0.0 110.575 -179.906 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 20' ' ' GLN . . . . . . . . . . . . . 29.8 tt0 -134.35 -56.35 0.85 Allowed 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.09 -1.006 . . . . 0.0 110.128 179.832 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 21' ' ' LEU . . . . . . . . . . . . . 3.0 tp -88.76 47.98 1.57 Allowed 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.23 -0.918 . . . . 0.0 110.134 179.889 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 22' ' ' VAL . . . . . 0.421 HG12 ' H ' ' C' ' 22' ' ' VAL . 7.1 p . . . . . 0 N--CA 1.491 1.606 0 CA-C-O 117.961 -1.019 . . . . 0.0 110.227 -179.862 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.492 1.626 0 CA-C-O 121.24 0.543 . . . . 0.0 110.277 . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -61.61 -59.38 5.3 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.234 -0.916 . . . . 0.0 110.051 179.995 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 150.4 89.21 0.07 OUTLIER Glycine 0 N--CA 1.491 2.322 0 N-CA-C 109.631 -1.388 . . . . 0.0 109.631 179.953 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -135.78 -161.63 1.18 Allowed 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.261 -1.14 . . . . 0.0 110.2 179.997 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 0.466 ' N ' HD12 ' A' ' 5' ' ' ILE . 4.6 mp -112.18 128.83 68.56 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.574 0 O-C-N 121.291 -0.881 . . . . 0.0 110.198 179.88 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 6.1 pt20 -171.41 175.16 4.23 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.314 -0.866 . . . . 0.0 109.907 -179.962 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' ILE . . . . . 0.658 ' O ' HD12 ' A' ' 7' ' ' ILE . 2.2 pp -76.7 132.16 72.47 Favored Pre-proline 0 N--CA 1.492 1.669 0 O-C-N 121.141 -0.974 . . . . 0.0 109.925 -179.912 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 49.6 Cg_endo -75.15 138.33 22.55 Favored 'Trans proline' 0 C--N 1.313 -1.336 0 O-C-N 123.5 1.263 . . . . 0.0 110.621 -179.773 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 48.4 Cg_endo -74.51 164.33 34.14 Favored 'Trans proline' 0 C--N 1.312 -1.381 0 O-C-N 123.608 1.32 . . . . 0.0 110.22 179.803 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 99.3 -33.48 6.15 Favored Glycine 0 N--CA 1.49 2.294 0 N-CA-C 109.528 -1.429 . . . . 0.0 109.528 179.989 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 11.6 tp -52.88 -46.39 67.9 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.282 -1.128 . . . . 0.0 110.066 179.869 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 98.2 m -59.19 -47.07 86.68 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.193 -0.942 . . . . 0.0 110.151 179.864 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.6 tm-20 -57.47 -29.23 64.07 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.232 -0.917 . . . . 0.0 110.057 179.846 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.672 HD21 ' CE1' ' A' ' 38' ' ' PHE . 4.0 tt -78.41 -44.56 24.51 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.267 -0.895 . . . . 0.0 110.242 179.924 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.638 HD22 HD11 ' B' ' 15' ' ' LEU . 98.4 mt -70.39 -50.53 37.78 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.288 -0.883 . . . . 0.0 110.271 -179.859 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 1.2 tt0 -53.3 -46.81 69.53 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.164 -0.96 . . . . 0.0 110.052 179.959 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -56.89 -40.35 90.08 Favored Glycine 0 N--CA 1.491 2.301 0 N-CA-C 109.137 -1.585 . . . . 0.0 109.137 179.613 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' TYR . . . . . 0.605 ' O ' HG23 ' A' ' 22' ' ' VAL . 22.8 t80 -66.64 -44.74 81.16 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.309 -1.113 . . . . 0.0 109.812 179.668 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 52.4 m -57.3 -26.85 61.54 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.366 -0.834 . . . . 0.0 109.902 179.632 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 44.2 t -73.53 -72.27 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.569 0 O-C-N 121.381 -0.824 . . . . 0.0 110.258 179.995 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.443 ' OE2' ' CD1' ' A' ' 37' ' ' TYR . 10.1 pt-20 -46.42 -43.56 16.5 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.39 -0.819 . . . . 0.0 111.144 -179.476 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.605 HG23 ' O ' ' A' ' 18' ' ' TYR . 99.6 t -58.52 -37.34 64.08 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.657 0 O-C-N 120.914 -1.116 . . . . 0.0 110.004 179.955 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.577 HD11 ' CD1' ' B' ' 7' ' ' ILE . 0.4 OUTLIER -78.57 -20.63 50.12 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.362 -0.836 . . . . 0.0 110.298 179.939 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -95.23 -58.33 2.17 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.284 -0.885 . . . . 0.0 110.462 -179.736 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 25' ' ' GLN . . . . . 0.43 ' O ' ' CG ' ' A' ' 26' ' ' GLN . 7.9 mp0 -63.11 -22.34 66.79 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.218 -0.926 . . . . 0.0 110.531 -179.73 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 26' ' ' GLN . . . . . 0.43 ' CG ' ' O ' ' A' ' 25' ' ' GLN . 3.4 pt20 36.49 59.24 3.46 Favored Pre-proline 0 N--CA 1.505 2.279 0 O-C-N 122.013 -0.429 . . . . 0.0 111.589 -179.9 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo -69.95 161.22 46.78 Favored 'Trans proline' 0 C--N 1.31 -1.459 0 O-C-N 123.796 1.419 . . . . 0.0 110.763 -179.735 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 43.4 Cg_endo -69.81 -46.34 1.24 Allowed 'Trans proline' 0 C--N 1.311 -1.398 0 O-C-N 123.84 1.442 . . . . 0.0 110.33 179.975 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -120.54 116.45 25.4 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.355 -0.84 . . . . 0.0 110.048 179.86 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 6.7 tp -70.22 -30.8 67.98 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.391 -0.818 . . . . 0.0 110.273 -179.992 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.416 HG23 ' H ' ' A' ' 31' ' ' VAL . 41.5 t -51.3 -64.8 0.31 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.663 0 O-C-N 121.239 -0.913 . . . . 0.0 109.956 179.929 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 1.4 t0 -55.3 -39.36 69.8 Favored 'General case' 0 C--N 1.302 -1.467 0 O-C-N 121.429 -0.794 . . . . 0.0 110.022 179.654 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' PHE . . . . . 0.401 ' CZ ' ' OE2' ' A' ' 21' ' ' GLU . 66.4 t80 -62.35 -44.69 95.89 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.267 -0.896 . . . . 0.0 109.876 179.63 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.463 ' HB2' ' OH ' ' A' ' 18' ' ' TYR . . . -59.34 -42.9 92.58 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.31 -0.868 . . . . 0.0 110.116 179.887 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.508 HG13 ' OG1' ' B' ' 39' ' ' THR . 71.9 t -73.09 -24.39 20.8 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.382 0 O-C-N 121.209 -0.932 . . . . 0.0 109.977 179.903 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -80.98 -36.64 30.51 Favored 'General case' 0 C--N 1.304 -1.398 0 O-C-N 121.288 -0.883 . . . . 0.0 109.793 -179.911 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' TYR . . . . . 0.443 ' CD1' ' OE2' ' A' ' 21' ' ' GLU . 61.4 t80 -74.94 -61.28 1.94 Allowed 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.15 -0.969 . . . . 0.0 110.318 -179.826 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 38' ' ' PHE . . . . . 0.672 ' CE1' HD21 ' A' ' 14' ' ' LEU . 14.9 m-85 -52.15 -51.36 58.47 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.316 -0.865 . . . . 0.0 110.415 -179.925 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 39' ' ' THR . . . . . 0.507 ' OG1' HG13 ' B' ' 35' ' ' VAL . 21.2 m -51.91 -43.25 63.32 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.189 -0.944 . . . . 0.0 110.069 179.914 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.73 -30.52 70.03 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.232 -0.918 . . . . 0.0 110.14 179.829 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -57.86 -36.5 72.44 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.235 -0.916 . . . . 0.0 109.966 179.917 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 8.4 mtm180 -50.61 -26.86 5.86 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.321 -0.862 . . . . 0.0 109.933 179.563 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' GLU . . . . . 0.604 ' O ' ' HB3' ' A' ' 44' ' ' ALA . 1.4 mm-40 -104.16 -61.22 1.47 Allowed 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.501 -0.749 . . . . 0.0 109.855 179.679 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 44' ' ' ALA . . . . . 0.604 ' HB3' ' O ' ' A' ' 43' ' ' GLU . . . 67.14 -61.63 0.34 Allowed 'General case' 0 N--CA 1.501 2.104 0 O-C-N 121.525 -0.734 . . . . 0.0 110.78 179.816 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.413 ' N ' ' O ' ' A' ' 43' ' ' GLU . 0.0 OUTLIER -52.21 176.1 0.02 OUTLIER 'General case' 0 C--N 1.3 -1.559 0 O-C-N 121.542 -0.724 . . . . 0.0 110.546 -179.058 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 31.1 ttp180 . . . . . 0 N--CA 1.492 1.658 0 CA-C-O 117.992 -1.004 . . . . 0.0 110.164 -179.967 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 1' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.492 1.673 0 CA-C-O 121.312 0.577 . . . . 0.0 110.167 . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 2' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 53.59 60.17 3.86 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.197 -0.94 . . . . 0.0 110.111 179.936 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 3' ' ' GLY . . . . . . . . . . . . . . . -106.46 -120.7 4.67 Favored Glycine 0 N--CA 1.49 2.275 0 N-CA-C 109.691 -1.363 . . . . 0.0 109.691 180.0 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 4' ' ' HIS . . . . . . . . . . . . . 1.3 t-160 -126.69 -161.5 1.07 Allowed 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.255 -1.144 . . . . 0.0 110.489 -179.769 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 5' ' ' ILE . . . . . 0.948 HD13 ' N ' ' B' ' 6' ' ' GLN . 0.0 OUTLIER -100.03 146.93 8.07 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.561 0 O-C-N 121.489 -0.757 . . . . 0.0 109.802 179.971 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 6' ' ' GLN . . . . . 0.948 ' N ' HD13 ' B' ' 5' ' ' ILE . 8.4 mt-30 -128.46 155.64 44.47 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.08 -1.013 . . . . 0.0 110.704 -179.483 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 7' ' ' ILE . . . . . 0.577 ' CD1' HD11 ' A' ' 23' ' ' LEU . 33.8 mm -48.37 128.64 13.02 Favored Pre-proline 0 N--CA 1.495 1.794 0 O-C-N 121.268 -0.895 . . . . 0.0 110.581 -179.949 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 48.8 Cg_endo -75.88 117.85 4.85 Favored 'Trans proline' 0 C--N 1.314 -1.26 0 O-C-N 123.469 1.247 . . . . 0.0 110.32 179.811 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 9' ' ' PRO . . . . . . . . . . . . . 46.1 Cg_endo -73.27 153.83 51.18 Favored 'Trans proline' 0 C--N 1.312 -1.36 0 O-C-N 123.535 1.282 . . . . 0.0 110.396 -179.854 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 117.76 -23.38 9.5 Favored Glycine 0 N--CA 1.49 2.282 0 N-CA-C 109.508 -1.437 . . . . 0.0 109.508 -179.863 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 11' ' ' LEU . . . . . 0.432 HD21 HG11 ' A' ' 22' ' ' VAL . 0.2 OUTLIER -73.5 -46.74 46.11 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.229 -1.16 . . . . 0.0 110.215 -179.961 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 95.6 m -54.78 -30.0 55.72 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.156 -0.965 . . . . 0.0 110.138 -179.955 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 4.4 tt0 -64.59 -48.77 73.71 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.314 -0.866 . . . . 0.0 110.18 179.999 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -68.82 -31.02 69.7 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.3 -0.875 . . . . 0.0 110.23 179.901 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 15' ' ' LEU . . . . . 0.638 HD11 HD22 ' A' ' 15' ' ' LEU . 2.1 mm? -65.27 -55.38 18.69 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.223 -0.923 . . . . 0.0 110.254 -179.978 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -53.11 -45.16 68.16 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.26 -0.9 . . . . 0.0 110.177 179.837 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 17' ' ' GLY . . . . . . . . . . . . . . . -56.35 -36.88 71.22 Favored Glycine 0 N--CA 1.49 2.285 0 N-CA-C 109.256 -1.538 . . . . 0.0 109.256 179.733 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 18' ' ' TYR . . . . . . . . . . . . . 38.5 t80 -73.41 -44.88 57.47 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.386 -1.067 . . . . 0.0 110.063 179.811 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 19' ' ' THR . . . . . 0.801 ' O ' HD23 ' B' ' 23' ' ' LEU . 52.2 m -57.28 -23.31 47.55 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.239 -0.913 . . . . 0.0 110.05 179.923 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 37.6 t -78.58 -70.34 0.38 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.649 0 O-C-N 121.409 -0.807 . . . . 0.0 110.143 -179.982 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 21' ' ' GLU . . . . . 0.444 ' HG3' HG23 ' B' ' 22' ' ' VAL . 10.2 pt-20 -44.58 -42.81 7.63 Favored 'General case' 0 N--CA 1.497 1.906 0 O-C-N 121.514 -0.741 . . . . 0.0 111.065 -179.507 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 22' ' ' VAL . . . . . 0.444 HG23 ' HG3' ' B' ' 21' ' ' GLU . 84.7 t -66.23 -34.59 71.21 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.551 0 O-C-N 121.051 -1.031 . . . . 0.0 109.64 179.556 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 23' ' ' LEU . . . . . 0.801 HD23 ' O ' ' B' ' 19' ' ' THR . 1.8 mm? -75.47 -28.72 59.36 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.342 -0.849 . . . . 0.0 109.923 179.802 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -90.58 -65.2 1.04 Allowed 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.377 -0.827 . . . . 0.0 110.187 -179.876 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 25' ' ' GLN . . . . . 0.446 ' CG ' ' O ' ' B' ' 25' ' ' GLN . 1.9 tt0 -85.29 56.56 4.0 Favored 'General case' 0 C--N 1.305 -1.35 0 O-C-N 121.114 -0.991 . . . . 0.0 109.845 179.911 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 10.1 mt-30 -38.29 98.8 0.17 Allowed Pre-proline 0 N--CA 1.499 1.986 0 O-C-N 121.896 -0.503 . . . . 0.0 111.56 -179.717 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 27' ' ' PRO . . . . . . . . . . . . . 47.3 Cg_endo -74.26 160.05 42.86 Favored 'Trans proline' 0 C--N 1.311 -1.421 0 O-C-N 123.909 1.478 . . . . 0.0 110.41 -179.909 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 44.4 Cg_endo -71.39 -28.16 18.41 Favored 'Trans proline' 0 C--N 1.312 -1.363 0 O-C-N 123.677 1.356 . . . . 0.0 109.967 179.691 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -146.59 112.38 5.67 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.392 -0.818 . . . . 0.0 109.926 179.695 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 30' ' ' LEU . . . . . 0.471 HD23 HD13 ' A' ' 14' ' ' LEU . 1.7 tp -57.09 -33.74 67.61 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.226 -0.921 . . . . 0.0 109.882 -179.994 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 47.5 t -53.55 -55.9 11.13 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.653 0 O-C-N 121.353 -0.842 . . . . 0.0 109.898 179.59 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -65.21 -40.35 94.03 Favored 'General case' 0 C--N 1.301 -1.506 0 O-C-N 121.58 -0.7 . . . . 0.0 110.191 -179.93 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 33' ' ' PHE . . . . . 0.443 ' CE2' HG22 ' B' ' 22' ' ' VAL . 79.3 t80 -63.83 -43.29 96.64 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.214 -0.928 . . . . 0.0 109.757 179.642 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -59.01 -38.69 79.8 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.31 -0.868 . . . . 0.0 110.109 179.846 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 35' ' ' VAL . . . . . 0.507 HG13 ' OG1' ' A' ' 39' ' ' THR . 70.7 t -79.84 -25.57 12.1 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.358 0 O-C-N 121.245 -0.909 . . . . 0.0 109.901 179.791 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -81.88 -36.83 27.76 Favored 'General case' 0 C--N 1.304 -1.391 0 O-C-N 121.297 -0.877 . . . . 0.0 110.112 -179.791 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 37' ' ' TYR . . . . . 0.429 ' CZ ' ' OE1' ' B' ' 21' ' ' GLU . 87.5 t80 -76.1 -59.52 2.73 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.043 -1.036 . . . . 0.0 110.629 -179.658 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 38' ' ' PHE . . . . . 0.457 ' HB3' ' CG2' ' A' ' 35' ' ' VAL . 4.3 m-85 -55.48 -46.38 76.87 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.232 -0.917 . . . . 0.0 110.655 -179.554 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 39' ' ' THR . . . . . 0.508 ' OG1' HG13 ' A' ' 35' ' ' VAL . 8.7 m -53.23 -48.73 67.94 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 120.939 -1.101 . . . . 0.0 109.975 179.993 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -55.74 -42.46 75.43 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.222 -0.924 . . . . 0.0 110.255 179.989 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 1.6 mt -54.56 -40.96 69.25 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.206 -0.934 . . . . 0.0 109.913 179.75 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.16 -25.46 67.77 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.233 -0.917 . . . . 0.0 109.907 179.79 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 43' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -94.78 -28.1 15.44 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.364 -0.835 . . . . 0.0 110.103 179.798 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -75.82 -66.69 0.75 Allowed 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.367 -0.833 . . . . 0.0 110.317 179.929 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 45' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -50.83 157.48 0.8 Allowed 'General case' 0 N--CA 1.487 1.401 0 O-C-N 121.529 -0.732 . . . . 0.0 110.546 -179.222 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 5.4 mmm180 . . . . . 0 N--CA 1.492 1.633 0 CA-C-O 117.934 -1.032 . . . . 0.0 110.186 -179.912 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' C' C ' 1' ' ' LEU . . . . . 0.41 ' O ' ' N ' ' C' ' 3' ' ' ILE . 5.5 mt . . . . . 0 N--CA 1.491 1.597 0 CA-C-O 121.106 0.479 . . . . 0.0 110.199 . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 2' ' ' LEU . . . . . 0.487 ' HG ' HD13 ' A' ' 23' ' ' LEU . 0.6 OUTLIER 67.28 -63.44 0.29 Allowed 'General case' 0 N--CA 1.501 2.111 0 O-C-N 121.44 -0.788 . . . . 0.0 110.419 -179.958 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' C' C ' 3' ' ' ILE . . . . . 0.41 ' N ' ' O ' ' C' ' 1' ' ' LEU . 49.3 mm -66.3 -53.93 31.57 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.636 0 O-C-N 121.078 -1.014 . . . . 0.0 110.254 -179.895 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 4' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -51.77 -38.03 53.85 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.248 -0.908 . . . . 0.0 110.327 -179.981 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 5' ' ' THR . . . . . . . . . . . . . 93.1 m -72.62 -48.42 39.75 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.387 -0.821 . . . . 0.0 110.364 -179.921 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 6' ' ' ALA . . . . . 0.433 ' O ' HG12 ' C' ' 10' ' ' VAL . . . -56.35 -25.65 49.99 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.254 -0.903 . . . . 0.0 110.477 -179.781 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 7' ' ' SER . . . . . . . . . . . . . 63.1 m -83.79 -39.12 20.41 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.124 -0.985 . . . . 0.0 110.267 -179.897 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 8' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -75.39 -37.43 60.52 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.18 -0.95 . . . . 0.0 110.107 179.923 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 9' ' ' LEU . . . . . . . . . . . . . 2.6 tp -66.34 -56.68 9.96 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.246 -0.909 . . . . 0.0 110.065 179.85 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 10' ' ' VAL . . . . . 0.561 HG23 HG13 ' C' ' 14' ' ' ILE . 10.9 p -51.64 -28.38 8.9 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.597 0 O-C-N 121.309 -0.869 . . . . 0.0 110.405 179.966 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 11' ' ' LYS . . . . . . . . . . . . . 8.9 mttm -67.98 -49.0 64.25 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.266 -0.897 . . . . 0.0 110.269 179.969 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 12' ' ' ASN . . . . . . . . . . . . . 28.4 m-20 -93.65 -0.31 56.16 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.269 -0.895 . . . . 0.0 110.761 179.985 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 13' ' ' ALA . . . . . . . . . . . . . . . -107.51 -14.87 14.74 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 120.957 -1.089 . . . . 0.0 110.485 179.989 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 14' ' ' ILE . . . . . 0.561 HG13 HG23 ' C' ' 10' ' ' VAL . 47.9 mm -119.76 -35.84 1.58 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.689 0 O-C-N 121.105 -0.997 . . . . 0.0 110.222 -179.852 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 15' ' ' GLN . . . . . 0.549 ' HA ' HG22 ' C' ' 18' ' ' ILE . 7.6 mt-30 -106.53 30.11 6.31 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.226 -0.921 . . . . 0.0 110.222 -179.979 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 16' ' ' LEU . . . . . 0.452 HD23 ' H ' ' C' ' 16' ' ' LEU . 0.6 OUTLIER -71.59 -18.54 62.22 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.293 -0.88 . . . . 0.0 110.556 -179.903 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' C' C ' 17' ' ' SER . . . . . . . . . . . . . 2.4 t -112.82 -57.11 2.33 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.122 -0.987 . . . . 0.0 110.365 -179.91 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 18' ' ' ILE . . . . . 0.549 HG22 ' HA ' ' C' ' 15' ' ' GLN . 0.6 OUTLIER -54.33 -31.64 22.79 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.597 0 O-C-N 121.259 -0.9 . . . . 0.0 110.212 179.994 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' C' C ' 19' ' ' GLU . . . . . . . . . . . . . 20.2 tt0 -114.65 55.84 0.74 Allowed 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.147 -0.971 . . . . 0.0 110.182 179.992 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 20' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -169.07 -39.21 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.217 -0.927 . . . . 0.0 110.273 179.864 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 21' ' ' LEU . . . . . . . . . . . . . 25.9 mt -93.91 29.68 2.04 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.232 -0.917 . . . . 0.0 110.169 179.989 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 22' ' ' VAL . . . . . . . . . . . . . 88.1 t . . . . . 0 N--CA 1.492 1.626 0 CA-C-O 118.078 -0.963 . . . . 0.0 110.179 -179.96 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.655 0 CA-C-O 121.279 0.561 . . . . 0.0 110.134 . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 1.4 mmm -104.58 79.53 1.57 Allowed 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.222 -0.924 . . . . 0.0 110.312 179.939 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -113.3 -141.51 8.0 Favored Glycine 0 N--CA 1.49 2.264 0 N-CA-C 109.463 -1.455 . . . . 0.0 109.463 179.887 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 32.0 p-80 -127.45 154.77 44.67 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.181 -1.187 . . . . 0.0 110.277 179.946 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 0.417 HG23 ' O ' ' A' ' 5' ' ' ILE . 1.4 tt -116.47 133.58 62.61 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.634 0 O-C-N 121.203 -0.936 . . . . 0.0 110.283 -179.87 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 6' ' ' GLN . . . . . 0.613 ' C ' HD12 ' A' ' 7' ' ' ILE . 1.5 mt-30 -143.46 173.06 11.96 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.166 -0.959 . . . . 0.0 110.461 -179.908 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 7' ' ' ILE . . . . . 0.635 ' N ' HD12 ' A' ' 7' ' ' ILE . 4.9 mp -130.18 122.36 20.1 Favored Pre-proline 0 N--CA 1.493 1.693 0 O-C-N 121.209 -0.932 . . . . 0.0 110.191 -179.978 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 48.6 Cg_endo -75.23 120.11 5.86 Favored 'Trans proline' 0 C--N 1.314 -1.281 0 O-C-N 123.472 1.248 . . . . 0.0 110.44 179.881 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 48.1 Cg_endo -77.42 0.75 9.47 Favored 'Trans proline' 0 C--N 1.314 -1.256 0 O-C-N 123.408 1.215 . . . . 0.0 111.565 -179.99 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -65.65 -19.0 66.66 Favored Glycine 0 N--CA 1.491 2.314 0 N-CA-C 109.807 -1.317 . . . . 0.0 109.807 179.994 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.46 HD11 HD13 ' B' ' 30' ' ' LEU . 1.7 mp -84.36 -24.36 29.74 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.152 -1.205 . . . . 0.0 110.492 -179.739 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 71.5 m -54.8 -57.14 12.77 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.153 -0.967 . . . . 0.0 110.589 -179.754 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -56.94 -48.71 77.65 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.276 -0.89 . . . . 0.0 110.631 -179.593 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.617 HD22 ' CD2' ' B' ' 30' ' ' LEU . 3.5 tp -50.75 -58.13 6.66 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.277 -0.889 . . . . 0.0 110.692 -179.489 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 2.4 mp -56.36 -49.41 74.49 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.199 -0.938 . . . . 0.0 110.389 -179.752 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' GLN . . . . . 0.65 ' OE1' HG21 ' C' ' 10' ' ' VAL . 0.9 OUTLIER -50.41 -49.15 55.44 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.185 -0.947 . . . . 0.0 110.324 179.981 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -55.25 -38.84 69.24 Favored Glycine 0 N--CA 1.491 2.333 0 N-CA-C 109.055 -1.618 . . . . 0.0 109.055 179.658 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' TYR . . . . . 0.763 ' O ' HG23 ' A' ' 22' ' ' VAL . 24.7 t80 -67.42 -50.65 58.53 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.407 -1.055 . . . . 0.0 109.708 179.492 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 70.9 m -57.01 -32.83 66.54 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.282 -0.886 . . . . 0.0 109.807 179.621 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.571 HG23 ' O ' ' A' ' 16' ' ' GLN . 44.8 t -63.46 -73.76 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.545 0 O-C-N 121.357 -0.839 . . . . 0.0 110.22 179.959 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.414 ' OE1' ' CE1' ' A' ' 37' ' ' TYR . 10.3 pt-20 -45.06 -43.26 9.3 Favored 'General case' 0 N--CA 1.498 1.931 0 O-C-N 121.461 -0.774 . . . . 0.0 111.035 -179.575 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.763 HG23 ' O ' ' A' ' 18' ' ' TYR . 94.6 t -51.92 -53.84 15.99 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.713 0 O-C-N 121.1 -1.0 . . . . 0.0 110.144 179.888 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.462 HD21 HG13 ' B' ' 7' ' ' ILE . 0.9 OUTLIER -56.81 -35.27 68.57 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.271 -0.893 . . . . 0.0 110.115 179.874 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 1.4 mmt180 -77.34 -62.9 1.5 Allowed 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.31 -0.869 . . . . 0.0 110.331 -179.925 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 34.9 mm-40 -57.84 -39.34 77.45 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.218 -0.926 . . . . 0.0 110.26 -179.955 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 51.79 56.93 16.34 Favored Pre-proline 0 N--CA 1.492 1.661 0 O-C-N 121.235 -0.916 . . . . 0.0 110.102 -179.794 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 43.8 Cg_endo -70.06 161.06 47.39 Favored 'Trans proline' 0 C--N 1.311 -1.403 0 O-C-N 123.735 1.387 . . . . 0.0 110.51 -179.996 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 45.4 Cg_endo -71.5 -34.04 10.0 Favored 'Trans proline' 0 C--N 1.311 -1.401 0 O-C-N 123.694 1.365 . . . . 0.0 110.23 -179.976 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -130.12 119.45 23.04 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.325 -0.859 . . . . 0.0 110.264 -179.847 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 5.3 tp -75.28 -35.57 61.29 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.342 -0.848 . . . . 0.0 109.816 179.802 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.611 HG12 ' HD2' ' B' ' 42' ' ' ARG . 44.9 t -51.55 -59.18 1.46 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.695 0 O-C-N 121.279 -0.888 . . . . 0.0 109.855 179.564 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 6.0 t0 -58.55 -40.1 82.08 Favored 'General case' 0 C--N 1.301 -1.529 0 O-C-N 121.683 -0.636 . . . . 0.0 109.932 179.753 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 42.4 t80 -62.05 -48.78 78.7 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.157 -0.965 . . . . 0.0 109.511 179.448 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.627 ' HB2' ' OH ' ' A' ' 18' ' ' TYR . . . -52.97 -38.2 61.94 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.389 -0.819 . . . . 0.0 110.121 179.716 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.546 HG13 ' OG1' ' B' ' 39' ' ' THR . 97.1 t -70.06 -35.73 65.24 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.367 0 O-C-N 121.25 -0.906 . . . . 0.0 110.174 -179.958 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -83.14 -20.17 35.28 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.294 -0.879 . . . . 0.0 110.444 -179.989 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' TYR . . . . . 0.414 ' CE1' ' OE1' ' A' ' 21' ' ' GLU . 33.7 t80 -73.31 -62.21 1.55 Allowed 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.205 -0.935 . . . . 0.0 110.565 -179.665 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 38' ' ' PHE . . . . . 0.45 ' CE1' HD21 ' A' ' 14' ' ' LEU . 29.3 m-85 -67.18 -45.21 77.63 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.204 -0.935 . . . . 0.0 110.644 -179.571 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 39' ' ' THR . . . . . 0.542 ' OG1' HG13 ' B' ' 35' ' ' VAL . 42.7 m -52.53 -39.28 61.21 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.156 -0.965 . . . . 0.0 110.252 -179.939 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 3.6 mtp85 -74.37 -34.59 63.41 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.204 -0.935 . . . . 0.0 110.008 179.773 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 10.5 tp -65.97 -19.95 66.04 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.38 -0.825 . . . . 0.0 110.396 -179.939 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -82.69 -21.91 34.73 Favored 'General case' 0 C--N 1.305 -1.367 0 O-C-N 121.139 -0.976 . . . . 0.0 109.915 179.977 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 12.2 mt-10 -104.21 -4.99 22.35 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.194 -0.941 . . . . 0.0 110.816 -179.983 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -108.7 -75.93 0.62 Allowed 'General case' 0 N--CA 1.492 1.652 0 O-C-N 120.933 -1.104 . . . . 0.0 110.318 179.93 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -56.08 158.07 4.2 Favored 'General case' 0 C--N 1.304 -1.405 0 O-C-N 121.515 -0.74 . . . . 0.0 110.237 -179.308 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.576 0 CA-C-O 118.028 -0.987 . . . . 0.0 110.265 -179.976 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 1' ' ' HIS . . . . . . . . . . . . . 51.3 m80 . . . . . 0 N--CA 1.491 1.621 0 CA-C-O 121.273 0.559 . . . . 0.0 110.147 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 2' ' ' MET . . . . . . . . . . . . . 2.9 tpt -102.66 113.97 27.82 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.354 -0.841 . . . . 0.0 110.109 -179.965 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 3' ' ' GLY . . . . . . . . . . . . . . . -169.94 53.57 0.2 Allowed Glycine 0 N--CA 1.49 2.271 0 N-CA-C 109.458 -1.457 . . . . 0.0 109.458 -179.935 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 4' ' ' HIS . . . . . 0.464 ' N ' HD12 ' B' ' 5' ' ' ILE . 0.1 OUTLIER -103.67 53.79 0.75 Allowed 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.263 -1.14 . . . . 0.0 110.39 -179.851 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 5' ' ' ILE . . . . . 0.635 ' N ' HD12 ' B' ' 5' ' ' ILE . 5.3 mp -110.42 -11.89 11.41 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.61 0 O-C-N 121.163 -0.961 . . . . 0.0 110.711 179.837 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 6' ' ' GLN . . . . . 0.714 ' C ' HD12 ' B' ' 7' ' ' ILE . 0.0 OUTLIER 179.65 33.12 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.347 -0.846 . . . . 0.0 110.492 179.363 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 7' ' ' ILE . . . . . 0.714 HD12 ' C ' ' B' ' 6' ' ' GLN . 4.3 mp -145.39 100.37 4.45 Favored Pre-proline 0 N--CA 1.493 1.689 0 O-C-N 121.216 -0.928 . . . . 0.0 110.43 -179.905 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 45.0 Cg_endo -72.43 139.34 31.48 Favored 'Trans proline' 0 C--N 1.312 -1.347 0 O-C-N 123.604 1.318 . . . . 0.0 110.628 179.885 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 9' ' ' PRO . . . . . . . . . . . . . 47.9 Cg_endo -73.72 156.82 48.68 Favored 'Trans proline' 0 C--N 1.312 -1.369 0 O-C-N 123.654 1.344 . . . . 0.0 110.248 179.675 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 135.25 -31.27 2.71 Favored Glycine 0 N--CA 1.49 2.28 0 N-CA-C 109.606 -1.398 . . . . 0.0 109.606 179.884 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 1.8 mp -78.32 -22.96 47.32 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.276 -1.132 . . . . 0.0 110.151 179.941 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 89.3 m -54.4 -42.15 70.08 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.378 -0.826 . . . . 0.0 110.302 179.985 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -79.4 -36.09 39.68 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.282 -0.886 . . . . 0.0 110.274 179.976 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 2.8 tp -65.2 -49.95 67.78 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.235 -0.916 . . . . 0.0 110.151 -179.994 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 6.0 mp -62.78 -50.29 71.62 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.319 -0.863 . . . . 0.0 110.391 -179.971 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 16' ' ' GLN . . . . . 0.713 ' O ' HG23 ' B' ' 20' ' ' VAL . 1.1 mt-30 -52.04 -40.5 61.18 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.153 -0.967 . . . . 0.0 110.139 179.972 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 17' ' ' GLY . . . . . . . . . . . . . . . -57.6 -51.67 56.51 Favored Glycine 0 N--CA 1.491 2.301 0 N-CA-C 109.169 -1.572 . . . . 0.0 109.169 179.649 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 18' ' ' TYR . . . . . 0.904 ' OH ' ' HB2' ' B' ' 34' ' ' ALA . 12.0 t80 -54.04 -38.99 65.8 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.369 -1.077 . . . . 0.0 110.19 179.891 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 51.9 m -71.03 -32.94 69.84 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.391 -0.818 . . . . 0.0 110.307 -179.862 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 20' ' ' VAL . . . . . 0.713 HG23 ' O ' ' B' ' 16' ' ' GLN . 90.3 t -70.1 -17.38 20.91 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.625 0 O-C-N 121.216 -0.927 . . . . 0.0 110.473 -179.892 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 21' ' ' GLU . . . . . 0.472 ' OE1' ' CD1' ' B' ' 37' ' ' TYR . 0.7 OUTLIER -92.23 -57.79 2.59 Favored 'General case' 0 N--CA 1.497 1.905 0 O-C-N 121.09 -1.006 . . . . 0.0 109.439 -179.927 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 22' ' ' VAL . . . . . . . . . . . . . 96.5 t -49.85 -26.34 2.76 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.528 0 O-C-N 121.565 -0.71 . . . . 0.0 110.476 -179.952 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 1.2 mt -84.78 -47.34 10.49 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.214 -0.929 . . . . 0.0 110.076 179.722 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.47 -66.6 0.64 Allowed 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.205 -0.934 . . . . 0.0 110.178 179.82 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 25' ' ' GLN . . . . . 0.429 ' O ' ' CG ' ' B' ' 25' ' ' GLN . 0.2 OUTLIER -91.68 59.69 3.8 Favored 'General case' 0 C--N 1.306 -1.292 0 O-C-N 121.039 -1.038 . . . . 0.0 109.917 179.903 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 21.2 mt-30 -38.42 98.63 0.17 Allowed Pre-proline 0 N--CA 1.5 2.056 0 O-C-N 122.042 -0.411 . . . . 0.0 111.676 -179.646 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 27' ' ' PRO . . . . . 0.515 ' HG3' ' CD2' ' B' ' 33' ' ' PHE . 49.4 Cg_endo -77.42 163.66 29.57 Favored 'Trans proline' 0 C--N 1.311 -1.422 0 O-C-N 123.821 1.432 . . . . 0.0 110.55 -179.986 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 45.1 Cg_endo -71.84 -52.65 0.19 Allowed 'Trans proline' 0 C--N 1.313 -1.34 0 O-C-N 123.679 1.357 . . . . 0.0 110.745 -179.946 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 58.0 m-20 -117.53 116.83 27.89 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.12 -0.988 . . . . 0.0 110.31 -179.826 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 30' ' ' LEU . . . . . 0.617 ' CD2' HD22 ' A' ' 14' ' ' LEU . 0.5 OUTLIER -60.5 -45.49 93.59 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.28 -0.888 . . . . 0.0 110.169 179.991 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 31' ' ' VAL . . . . . 0.504 ' O ' HG23 ' B' ' 35' ' ' VAL . 43.5 t -50.6 -63.05 0.44 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.761 0 O-C-N 121.233 -0.917 . . . . 0.0 109.964 179.737 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 4.8 t0 -57.92 -33.37 68.72 Favored 'General case' 0 C--N 1.303 -1.43 0 O-C-N 121.477 -0.764 . . . . 0.0 109.855 179.711 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 33' ' ' PHE . . . . . 0.515 ' CD2' ' HG3' ' B' ' 27' ' ' PRO . 32.7 t80 -67.24 -51.32 54.56 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.316 -0.865 . . . . 0.0 109.477 179.38 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 34' ' ' ALA . . . . . 0.904 ' HB2' ' OH ' ' B' ' 18' ' ' TYR . . . -54.05 -32.14 53.67 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.399 -0.813 . . . . 0.0 109.961 179.698 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 35' ' ' VAL . . . . . 0.542 HG13 ' OG1' ' A' ' 39' ' ' THR . 87.5 t -71.8 -38.19 64.69 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.355 0 O-C-N 121.277 -0.889 . . . . 0.0 110.117 -179.981 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -73.45 -34.36 65.36 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.182 -0.949 . . . . 0.0 110.23 179.922 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 37' ' ' TYR . . . . . 0.472 ' CD1' ' OE1' ' B' ' 21' ' ' GLU . 19.1 t80 -70.57 -66.62 0.58 Allowed 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.24 -0.913 . . . . 0.0 110.328 -179.945 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 24.8 m-85 -51.36 -53.49 35.78 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.24 -0.912 . . . . 0.0 110.428 -179.877 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 39' ' ' THR . . . . . 0.546 ' OG1' HG13 ' A' ' 35' ' ' VAL . 51.6 m -51.27 -30.88 19.25 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.152 -0.968 . . . . 0.0 110.006 179.79 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -82.83 -28.19 30.33 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.306 -0.871 . . . . 0.0 109.799 179.642 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -54.09 -43.87 70.71 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.4 -0.813 . . . . 0.0 110.094 179.817 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 42' ' ' ARG . . . . . 0.611 ' HD2' HG12 ' A' ' 31' ' ' VAL . 0.0 OUTLIER -51.9 -30.3 23.62 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.27 -0.894 . . . . 0.0 110.645 -179.733 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 43' ' ' GLU . . . . . . . . . . . . . 18.4 mm-40 -99.21 -14.53 19.26 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.126 -0.984 . . . . 0.0 110.803 -179.738 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -59.27 -77.49 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.084 -1.01 . . . . 0.0 110.524 -179.864 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 45' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.32 -31.3 32.55 Favored 'General case' 0 C--N 1.303 -1.426 0 O-C-N 121.523 -0.735 . . . . 0.0 110.547 -179.185 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 4.0 tmt_? . . . . . 0 N--CA 1.491 1.6 0 CA-C-O 117.968 -1.015 . . . . 0.0 110.313 -179.887 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' C' C ' 1' ' ' LEU . . . . . 0.445 ' O ' HG22 ' C' ' 3' ' ' ILE . 1.2 mp . . . . . 0 N--CA 1.491 1.605 0 CA-C-O 121.084 0.469 . . . . 0.0 110.285 . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 2' ' ' LEU . . . . . 0.434 HD21 HD22 ' A' ' 23' ' ' LEU . 0.5 OUTLIER 64.05 -73.47 0.05 Allowed 'General case' 0 N--CA 1.499 2.013 0 O-C-N 121.465 -0.772 . . . . 0.0 110.528 -179.939 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' C' C ' 3' ' ' ILE . . . . . 0.445 HG22 ' O ' ' C' ' 1' ' ' LEU . 15.1 tt -55.03 -22.97 12.05 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.68 0 O-C-N 121.235 -0.916 . . . . 0.0 110.684 -179.78 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 4' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -86.34 -0.23 55.42 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.121 -0.987 . . . . 0.0 110.841 -179.769 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 5' ' ' THR . . . . . . . . . . . . . 86.2 m -125.01 -34.84 2.73 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.043 -1.036 . . . . 0.0 110.369 -179.913 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 6' ' ' ALA . . . . . . . . . . . . . . . -72.28 -38.06 68.88 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.154 -0.966 . . . . 0.0 110.383 -179.811 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 7' ' ' SER . . . . . . . . . . . . . 16.2 m -62.42 -45.84 91.28 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.216 -0.927 . . . . 0.0 110.479 -179.794 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 8' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -72.63 -25.2 61.21 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.2 -0.938 . . . . 0.0 110.37 -179.742 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 9' ' ' LEU . . . . . . . . . . . . . 1.7 tp -61.88 -51.21 69.13 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.296 -0.878 . . . . 0.0 110.194 179.978 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 10' ' ' VAL . . . . . 0.65 HG21 ' OE1' ' A' ' 16' ' ' GLN . 88.5 t -54.31 -47.97 68.3 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.645 0 O-C-N 121.232 -0.918 . . . . 0.0 110.162 179.881 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 11' ' ' LYS . . . . . 0.446 ' HA ' HG22 ' C' ' 14' ' ' ILE . 0.0 OUTLIER -52.98 -46.14 68.13 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.309 -0.869 . . . . 0.0 110.328 179.996 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' C' C ' 12' ' ' ASN . . . . . . . . . . . . . 48.6 t-20 -73.5 -18.01 61.15 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.221 -0.924 . . . . 0.0 110.424 -179.86 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 13' ' ' ALA . . . . . . . . . . . . . . . -105.03 5.0 32.21 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.118 -0.989 . . . . 0.0 110.8 -179.981 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 14' ' ' ILE . . . . . 0.446 HG22 ' HA ' ' C' ' 11' ' ' LYS . 9.7 tp -120.32 -16.54 6.82 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.605 0 O-C-N 120.937 -1.102 . . . . 0.0 110.73 -179.688 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 15' ' ' GLN . . . . . 0.404 ' O ' ' CB ' ' C' ' 19' ' ' GLU . 3.5 mt-30 -92.87 -39.8 10.98 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.007 -1.058 . . . . 0.0 110.189 -179.894 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 16' ' ' LEU . . . . . 0.459 ' O ' ' N ' ' C' ' 18' ' ' ILE . 4.3 mp -56.69 -169.9 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.283 -0.886 . . . . 0.0 109.909 179.761 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 17' ' ' SER . . . . . 0.429 ' HB3' ' O ' ' C' ' 16' ' ' LEU . 36.4 t 57.67 -82.34 0.02 OUTLIER 'General case' 0 N--CA 1.497 1.906 0 O-C-N 121.595 -0.69 . . . . 0.0 110.633 -179.912 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 18' ' ' ILE . . . . . 0.459 ' N ' ' O ' ' C' ' 16' ' ' LEU . 29.5 pt -60.98 -33.82 57.33 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.628 0 O-C-N 120.904 -1.123 . . . . 0.0 109.914 179.978 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 19' ' ' GLU . . . . . 0.424 ' N ' HG13 ' C' ' 18' ' ' ILE . 3.3 tt0 -105.33 19.41 20.63 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.237 -0.915 . . . . 0.0 110.08 179.727 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 20' ' ' GLN . . . . . . . . . . . . . 15.3 tt0 -121.3 -39.27 2.69 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.211 -0.931 . . . . 0.0 109.988 179.982 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 21' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -93.85 -29.98 15.04 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.244 -0.91 . . . . 0.0 110.126 179.92 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 22' ' ' VAL . . . . . . . . . . . . . 65.1 t . . . . . 0 N--CA 1.491 1.618 0 CA-C-O 117.954 -1.022 . . . . 0.0 110.137 179.973 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 26.1 m80 . . . . . 0 N--CA 1.492 1.645 0 CA-C-O 121.159 0.504 . . . . 0.0 110.148 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 4.7 ptp -103.87 43.81 1.06 Allowed 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.229 -0.919 . . . . 0.0 110.21 179.963 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -156.78 103.48 0.24 Allowed Glycine 0 N--CA 1.49 2.278 0 N-CA-C 109.286 -1.525 . . . . 0.0 109.286 179.999 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' HIS . . . . . 0.637 ' C ' HD12 ' A' ' 5' ' ' ILE . 2.9 t60 -114.87 170.19 8.52 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.117 -1.225 . . . . 0.0 110.596 -179.668 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 0.691 ' N ' HD12 ' A' ' 5' ' ' ILE . 5.2 mp -134.39 172.05 16.83 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.66 0 O-C-N 121.431 -0.793 . . . . 0.0 109.748 179.994 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 6' ' ' GLN . . . . . 0.517 ' N ' HG22 ' A' ' 5' ' ' ILE . 3.1 tt0 -99.06 31.54 2.99 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.028 -1.045 . . . . 0.0 110.226 -179.707 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 7' ' ' ILE . . . . . 0.481 HD12 HG22 ' A' ' 5' ' ' ILE . 3.3 mp -135.65 103.52 10.16 Favored Pre-proline 0 N--CA 1.49 1.57 0 O-C-N 121.357 -0.839 . . . . 0.0 109.75 179.584 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 45.4 Cg_endo -71.29 133.4 22.71 Favored 'Trans proline' 0 C--N 1.312 -1.351 0 O-C-N 123.71 1.374 . . . . 0.0 110.548 -179.798 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 47.9 Cg_endo -74.15 174.17 12.89 Favored 'Trans proline' 0 C--N 1.313 -1.314 0 O-C-N 123.582 1.306 . . . . 0.0 110.511 -179.969 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 94.74 -22.13 39.5 Favored Glycine 0 N--CA 1.491 2.321 0 N-CA-C 109.729 -1.348 . . . . 0.0 109.729 179.955 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -70.37 -29.68 66.41 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.2 -1.176 . . . . 0.0 110.352 -179.898 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 21.9 m -62.14 -60.65 3.28 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.229 -0.919 . . . . 0.0 110.317 -179.885 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.425 ' HG3' ' N ' ' A' ' 14' ' ' LEU . 4.5 pt-20 -52.24 -25.22 8.75 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.278 -0.889 . . . . 0.0 110.391 -179.857 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.66 HD13 HD23 ' B' ' 30' ' ' LEU . 9.0 mt -79.48 -50.1 11.27 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.235 -0.916 . . . . 0.0 110.508 -179.889 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.532 ' CD1' HD22 ' B' ' 15' ' ' LEU . 3.9 mm? -70.75 -50.0 40.72 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.212 -0.93 . . . . 0.0 110.269 -179.853 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 16' ' ' GLN . . . . . 0.728 ' HG2' ' HB1' ' C' ' 6' ' ' ALA . 1.2 tt0 -57.42 -42.49 82.44 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.274 -0.891 . . . . 0.0 109.949 179.929 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -59.04 -41.49 96.49 Favored Glycine 0 N--CA 1.492 2.371 0 N-CA-C 109.592 -1.403 . . . . 0.0 109.592 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' TYR . . . . . 0.59 ' O ' HG23 ' A' ' 22' ' ' VAL . 60.4 t80 -68.99 -43.74 74.26 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.159 -1.201 . . . . 0.0 109.959 179.868 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 86.0 m -58.69 -28.27 65.6 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.361 -0.837 . . . . 0.0 110.136 179.883 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 25.4 t -75.4 -70.89 0.28 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.653 0 O-C-N 121.265 -0.897 . . . . 0.0 110.031 179.961 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -47.08 -45.59 21.97 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.341 -0.849 . . . . 0.0 111.032 -179.433 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.59 HG23 ' O ' ' A' ' 18' ' ' TYR . 81.8 t -54.8 -57.63 6.17 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.586 0 O-C-N 120.912 -1.118 . . . . 0.0 110.13 179.96 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.577 HD22 ' CG2' ' B' ' 7' ' ' ILE . 8.4 mt -68.07 -15.15 63.47 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.369 -0.832 . . . . 0.0 110.686 -179.799 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 5.5 tpt180 -80.37 -58.85 2.94 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.088 -1.008 . . . . 0.0 110.47 -179.832 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 5.9 pt20 -81.65 -22.18 37.71 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.241 -0.912 . . . . 0.0 110.443 -179.738 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER 53.22 75.65 0.61 Allowed Pre-proline 0 N--CA 1.491 1.582 0 O-C-N 121.165 -0.959 . . . . 0.0 110.162 -179.837 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 45.0 Cg_endo -71.95 156.86 55.78 Favored 'Trans proline' 0 C--N 1.312 -1.369 0 O-C-N 123.563 1.296 . . . . 0.0 110.415 -179.899 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 43.2 Cg_endo -69.74 -24.36 29.87 Favored 'Trans proline' 0 C--N 1.311 -1.43 0 O-C-N 123.712 1.375 . . . . 0.0 110.043 179.693 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -143.44 117.71 9.59 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.353 -0.842 . . . . 0.0 109.902 179.585 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.41 ' CD1' ' OH ' ' A' ' 18' ' ' TYR . 17.4 tp -72.67 -39.11 67.34 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.269 -0.894 . . . . 0.0 110.307 -179.851 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.583 HG12 ' HG2' ' B' ' 42' ' ' ARG . 45.0 t -49.74 -61.71 0.57 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.767 0 O-C-N 121.242 -0.911 . . . . 0.0 110.22 179.933 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 32' ' ' ASP . . . . . 0.408 ' OD2' ' NH2' ' B' ' 42' ' ' ARG . 7.1 t0 -58.07 -34.73 70.45 Favored 'General case' 0 C--N 1.302 -1.459 0 O-C-N 121.454 -0.779 . . . . 0.0 110.206 -179.906 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 33' ' ' PHE . . . . . 0.519 ' CE2' HG22 ' A' ' 22' ' ' VAL . 68.6 t80 -66.64 -44.19 82.64 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.173 -0.954 . . . . 0.0 109.557 179.533 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -56.62 -40.53 75.53 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.429 -0.794 . . . . 0.0 110.257 179.685 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.541 HG13 ' OG1' ' B' ' 39' ' ' THR . 90.5 t -75.7 -26.67 18.17 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.423 0 O-C-N 121.232 -0.917 . . . . 0.0 110.164 -179.999 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 36' ' ' GLU . . . . . 0.428 ' OE1' ' CA ' ' A' ' 36' ' ' GLU . 1.5 tp10 -81.73 -41.94 20.54 Favored 'General case' 0 C--N 1.303 -1.452 0 O-C-N 121.336 -0.853 . . . . 0.0 109.759 -179.88 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 88.4 t80 -69.39 -59.35 3.05 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.211 -0.931 . . . . 0.0 110.356 -179.836 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' PHE . . . . . 0.403 ' HB3' ' CG2' ' B' ' 35' ' ' VAL . 6.1 m-85 -54.1 -52.42 61.07 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.231 -0.918 . . . . 0.0 110.451 -179.789 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 39' ' ' THR . . . . . 0.51 ' OG1' HG13 ' B' ' 35' ' ' VAL . 24.3 m -52.82 -27.51 18.55 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.135 -0.978 . . . . 0.0 109.988 179.973 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.97 -26.53 60.53 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.21 -0.931 . . . . 0.0 109.986 179.758 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -77.67 -34.75 52.88 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.232 -0.917 . . . . 0.0 110.064 179.82 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -55.7 -28.99 58.61 Favored 'General case' 0 C--N 1.306 -1.297 0 O-C-N 121.226 -0.921 . . . . 0.0 109.271 179.484 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 43' ' ' GLU . . . . . 0.612 ' O ' ' HB3' ' A' ' 44' ' ' ALA . 0.6 OUTLIER -99.32 -59.56 1.7 Allowed 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.522 -0.736 . . . . 0.0 109.638 179.417 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 44' ' ' ALA . . . . . 0.612 ' HB3' ' O ' ' A' ' 43' ' ' GLU . . . 66.11 -70.32 0.1 Allowed 'General case' 0 N--CA 1.497 1.88 0 CA-C-O 121.734 0.778 . . . . 0.0 110.275 179.822 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.436 ' N ' ' O ' ' A' ' 43' ' ' GLU . 0.0 OUTLIER 41.14 90.62 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.736 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.364 -179.709 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 2.3 mtt180 . . . . . 0 N--CA 1.491 1.611 0 CA-C-O 117.971 -1.014 . . . . 0.0 110.215 -179.964 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 1' ' ' HIS . . . . . . . . . . . . . 93.4 m-70 . . . . . 0 N--CA 1.49 1.561 0 CA-C-O 121.2 0.524 . . . . 0.0 110.226 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 2' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -91.83 -177.73 4.83 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.302 -0.874 . . . . 0.0 110.168 179.996 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 3' ' ' GLY . . . . . . . . . . . . . . . -148.26 -95.82 0.16 Allowed Glycine 0 N--CA 1.49 2.281 0 N-CA-C 109.575 -1.41 . . . . 0.0 109.575 -179.973 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 4' ' ' HIS . . . . . . . . . . . . . 7.1 p80 -114.27 173.94 6.2 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.148 -1.207 . . . . 0.0 110.319 -179.983 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 5' ' ' ILE . . . . . . . . . . . . . 44.1 mm -121.31 129.81 75.25 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.667 0 O-C-N 121.35 -0.844 . . . . 0.0 109.859 179.83 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 6' ' ' GLN . . . . . . . . . . . . . 8.6 mt-30 -146.9 131.88 18.17 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.112 -0.993 . . . . 0.0 110.516 -179.796 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 7' ' ' ILE . . . . . 0.577 ' CG2' HD22 ' A' ' 23' ' ' LEU . 1.1 mp -73.44 -60.92 1.54 Allowed Pre-proline 0 N--CA 1.491 1.617 0 O-C-N 121.397 -0.815 . . . . 0.0 110.603 -179.952 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 8' ' ' PRO . . . . . 0.501 ' HD3' ' HB ' ' B' ' 7' ' ' ILE . 44.1 Cg_endo -70.28 111.93 3.04 Favored 'Trans proline' 0 C--N 1.305 -1.756 0 O-C-N 123.573 1.302 . . . . 0.0 110.662 179.747 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 9' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_endo -86.27 123.38 2.26 Favored 'Trans proline' 0 C--N 1.313 -1.322 0 O-C-N 123.597 1.314 . . . . 0.0 111.246 -179.619 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 73.74 2.27 60.49 Favored Glycine 0 N--CA 1.492 2.411 0 C-N-CA 120.262 -0.97 . . . . 0.0 110.887 179.055 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 11' ' ' LEU . . . . . 0.47 ' CB ' ' HB2' ' B' ' 8' ' ' PRO . 0.1 OUTLIER -90.38 -28.86 18.4 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 120.728 -1.454 . . . . 0.0 110.44 -179.935 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 82.0 m -58.13 -39.87 79.83 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.139 -0.976 . . . . 0.0 110.202 179.891 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -60.64 -40.07 90.6 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.351 -0.843 . . . . 0.0 110.106 179.969 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 14' ' ' LEU . . . . . 0.441 ' HA ' HD13 ' B' ' 14' ' ' LEU . 0.5 OUTLIER -60.19 -42.15 94.44 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.254 -0.903 . . . . 0.0 110.252 -179.975 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 15' ' ' LEU . . . . . 0.532 HD22 ' CD1' ' A' ' 15' ' ' LEU . 65.1 mt -74.64 -44.21 51.6 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.241 -0.912 . . . . 0.0 109.963 179.956 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 16' ' ' GLN . . . . . 0.563 ' O ' HG23 ' B' ' 20' ' ' VAL . 0.9 OUTLIER -54.09 -37.7 64.54 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.308 -0.87 . . . . 0.0 109.956 179.837 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 17' ' ' GLY . . . . . . . . . . . . . . . -67.99 -49.64 46.34 Favored Glycine 0 N--CA 1.49 2.264 0 N-CA-C 109.397 -1.481 . . . . 0.0 109.397 179.862 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 18' ' ' TYR . . . . . 0.44 ' HA ' ' HG3' ' B' ' 21' ' ' GLU . 18.4 t80 -60.02 -34.89 73.98 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.345 -1.091 . . . . 0.0 110.181 179.895 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 95.4 m -63.87 -33.64 76.14 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.18 -0.95 . . . . 0.0 110.525 -179.912 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 20' ' ' VAL . . . . . 0.563 HG23 ' O ' ' B' ' 16' ' ' GLN . 59.4 t -75.46 -22.68 16.53 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.751 0 O-C-N 121.147 -0.971 . . . . 0.0 110.29 -179.811 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 21' ' ' GLU . . . . . 0.44 ' HG3' ' HA ' ' B' ' 18' ' ' TYR . 0.6 OUTLIER -88.92 -52.89 4.86 Favored 'General case' 0 N--CA 1.497 1.915 0 O-C-N 121.153 -0.967 . . . . 0.0 108.702 179.685 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 22' ' ' VAL . . . . . 0.436 HG13 HD13 ' B' ' 30' ' ' LEU . 57.0 t -50.38 -31.8 8.98 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.5 0 O-C-N 121.665 -0.647 . . . . 0.0 110.07 179.498 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -86.34 -39.26 16.64 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.275 -0.891 . . . . 0.0 110.057 179.758 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 1.8 tpt180 -75.86 -52.23 10.8 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.278 -0.889 . . . . 0.0 110.271 -179.95 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 1.9 mm100 -64.04 -40.58 96.61 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.247 -0.908 . . . . 0.0 110.28 -179.961 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 26' ' ' GLN . . . . . 0.401 ' N ' ' CD ' ' B' ' 27' ' ' PRO . 0.2 OUTLIER 51.83 55.71 15.55 Favored Pre-proline 0 N--CA 1.491 1.624 0 O-C-N 121.278 -0.888 . . . . 0.0 110.026 -179.856 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 27' ' ' PRO . . . . . 0.401 ' CD ' ' N ' ' B' ' 26' ' ' GLN . 43.3 Cg_endo -69.6 158.97 55.28 Favored 'Trans proline' 0 C--N 1.313 -1.336 0 O-C-N 123.789 1.415 . . . . 0.0 110.687 -179.629 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_endo -70.0 -22.35 31.11 Favored 'Trans proline' 0 C--N 1.311 -1.406 0 O-C-N 123.724 1.381 . . . . 0.0 110.182 179.811 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 10.4 m-20 -140.2 115.56 9.95 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.369 -0.832 . . . . 0.0 110.123 179.709 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 30' ' ' LEU . . . . . 0.66 HD23 HD13 ' A' ' 14' ' ' LEU . 7.0 tp -72.2 -32.95 67.25 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.297 -0.877 . . . . 0.0 110.008 179.886 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 31' ' ' VAL . . . . . 0.406 ' H ' HG23 ' B' ' 31' ' ' VAL . 33.2 t -57.05 -65.3 0.42 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.715 0 O-C-N 121.316 -0.865 . . . . 0.0 109.879 179.656 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -56.25 -31.74 63.85 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.477 -0.764 . . . . 0.0 109.984 179.868 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 33' ' ' PHE . . . . . . . . . . . . . 47.8 t80 -68.88 -45.48 70.88 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.305 -0.872 . . . . 0.0 109.691 179.462 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -58.49 -37.1 74.84 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.495 -0.753 . . . . 0.0 110.124 179.772 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 35' ' ' VAL . . . . . 0.51 HG13 ' OG1' ' A' ' 39' ' ' THR . 98.3 t -73.2 -46.7 49.7 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.399 0 O-C-N 121.161 -0.962 . . . . 0.0 110.311 179.975 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -60.14 -44.37 94.99 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.165 -0.959 . . . . 0.0 110.416 -179.85 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 37' ' ' TYR . . . . . . . . . . . . . 28.1 t80 -64.45 -67.94 0.39 Allowed 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.209 -0.932 . . . . 0.0 110.606 -179.72 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 13.1 m-85 -51.12 -48.78 61.69 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.279 -0.888 . . . . 0.0 110.776 -179.552 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 39' ' ' THR . . . . . 0.541 ' OG1' HG13 ' A' ' 35' ' ' VAL . 35.7 m -52.35 -32.86 40.34 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 120.959 -1.088 . . . . 0.0 110.002 -179.816 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -68.59 -41.65 79.33 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.266 -0.896 . . . . 0.0 109.848 179.651 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -55.39 -28.31 53.2 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.261 -0.9 . . . . 0.0 109.818 179.658 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 42' ' ' ARG . . . . . 0.583 ' HG2' HG12 ' A' ' 31' ' ' VAL . 7.2 mmm180 -78.63 -19.85 51.71 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.276 -0.89 . . . . 0.0 110.297 179.843 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 43' ' ' GLU . . . . . . . . . . . . . 7.3 mm-40 -115.31 12.57 16.44 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.136 -0.978 . . . . 0.0 110.649 -179.95 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -82.12 -71.28 0.49 Allowed 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.092 -1.005 . . . . 0.0 110.372 179.928 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 45' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -49.15 134.7 17.46 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.52 -0.738 . . . . 0.0 110.892 -179.192 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 57.3 ttt180 . . . . . 0 N--CA 1.493 1.68 0 CA-C-O 118.053 -0.975 . . . . 0.0 110.429 179.751 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' C' C ' 1' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.614 0 CA-C-O 121.269 0.557 . . . . 0.0 110.226 . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 2' ' ' LEU . . . . . 0.464 HD21 HG21 ' B' ' 7' ' ' ILE . 0.3 OUTLIER -100.47 -21.81 15.23 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.171 -0.955 . . . . 0.0 110.276 -179.849 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' C' C ' 3' ' ' ILE . . . . . . . . . . . . . 97.0 mt -63.67 -38.53 82.53 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.629 0 O-C-N 121.19 -0.944 . . . . 0.0 110.3 -179.946 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 4' ' ' GLU . . . . . . . . . . . . . 6.5 mt-10 -66.38 -36.9 84.03 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.229 -0.919 . . . . 0.0 110.397 -179.873 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 5' ' ' THR . . . . . . . . . . . . . 99.0 m -76.46 -56.05 4.98 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.207 -0.933 . . . . 0.0 110.24 -179.956 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 6' ' ' ALA . . . . . 0.728 ' HB1' ' HG2' ' A' ' 16' ' ' GLN . . . -54.42 -35.25 62.71 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.284 -0.885 . . . . 0.0 110.187 -179.983 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 7' ' ' SER . . . . . . . . . . . . . 84.0 p -69.78 -30.25 67.76 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.28 -0.887 . . . . 0.0 110.18 -179.992 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 8' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -96.68 -21.08 17.82 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.29 -0.882 . . . . 0.0 110.215 179.97 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 9' ' ' LEU . . . . . . . . . . . . . 9.3 tt -69.56 -47.47 63.53 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.32 -0.862 . . . . 0.0 110.179 -179.938 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 10' ' ' VAL . . . . . 0.52 HG23 ' N ' ' C' ' 11' ' ' LYS . 33.6 m -57.63 -40.61 76.18 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.66 0 O-C-N 121.184 -0.948 . . . . 0.0 110.038 179.996 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 11' ' ' LYS . . . . . 0.52 ' N ' HG23 ' C' ' 10' ' ' VAL . 18.4 mttt -59.46 -38.61 81.23 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.299 -0.875 . . . . 0.0 110.038 179.817 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 12' ' ' ASN . . . . . . . . . . . . . 8.0 m-20 -69.5 -23.13 63.58 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.31 -0.869 . . . . 0.0 110.053 179.861 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 13' ' ' ALA . . . . . . . . . . . . . . . -82.01 -22.95 36.23 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.257 -0.902 . . . . 0.0 110.374 -179.944 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 14' ' ' ILE . . . . . . . . . . . . . 66.8 mt -88.51 -53.49 9.53 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.593 0 O-C-N 121.217 -0.927 . . . . 0.0 110.476 -179.831 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 15' ' ' GLN . . . . . . . . . . . . . 2.9 pp0? -57.11 -24.93 57.57 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.09 -1.007 . . . . 0.0 110.205 -179.933 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 16' ' ' LEU . . . . . . . . . . . . . 22.1 tp -73.39 -15.62 61.36 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.346 -0.846 . . . . 0.0 110.473 -179.949 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 17' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -73.9 -57.98 3.61 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.077 -1.014 . . . . 0.0 110.273 -179.934 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 18' ' ' ILE . . . . . . . . . . . . . 44.3 pt -66.85 -21.19 28.08 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.596 0 O-C-N 121.253 -0.904 . . . . 0.0 110.283 -179.987 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 19' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -82.72 -20.99 34.96 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.217 -0.927 . . . . 0.0 110.16 179.948 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 20' ' ' GLN . . . . . . . . . . . . . 16.1 tt0 -86.04 -32.11 21.62 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.276 -0.89 . . . . 0.0 110.321 180.0 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 21' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -90.51 -36.13 14.68 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.204 -0.935 . . . . 0.0 110.309 179.994 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 22' ' ' VAL . . . . . . . . . . . . . 98.2 t . . . . . 0 N--CA 1.49 1.569 0 CA-C-O 118.026 -0.988 . . . . 0.0 110.257 -179.82 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 10.1 m-70 . . . . . 0 N--CA 1.492 1.65 0 CA-C-O 121.135 0.493 . . . . 0.0 110.208 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -125.83 -41.69 1.95 Allowed 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.343 -0.848 . . . . 0.0 110.167 179.936 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -92.76 108.48 3.66 Favored Glycine 0 N--CA 1.49 2.296 0 N-CA-C 109.532 -1.427 . . . . 0.0 109.532 179.98 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -112.28 27.33 9.74 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.271 -1.134 . . . . 0.0 110.201 -180.0 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -117.39 45.67 0.43 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.561 0 O-C-N 121.147 -0.971 . . . . 0.0 110.335 -179.865 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 1.4 mm100 -148.41 135.01 19.76 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.178 -0.951 . . . . 0.0 110.195 179.921 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' ILE . . . . . 0.696 ' O ' HD12 ' A' ' 7' ' ' ILE . 2.4 pp -75.71 138.91 70.05 Favored Pre-proline 0 N--CA 1.491 1.612 0 O-C-N 121.253 -0.905 . . . . 0.0 110.215 -179.998 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 49.2 Cg_endo -74.06 140.06 27.77 Favored 'Trans proline' 0 C--N 1.313 -1.31 0 O-C-N 123.552 1.29 . . . . 0.0 110.539 -179.968 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 48.9 Cg_endo -75.48 165.77 29.95 Favored 'Trans proline' 0 C--N 1.312 -1.353 0 O-C-N 123.578 1.304 . . . . 0.0 110.439 179.863 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 104.13 -32.99 6.93 Favored Glycine 0 N--CA 1.491 2.338 0 N-CA-C 109.748 -1.341 . . . . 0.0 109.748 179.787 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 6.8 tp -53.58 -55.58 24.48 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.131 -1.217 . . . . 0.0 110.211 -179.932 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' THR . . . . . 0.748 HG23 HG21 ' C' ' 10' ' ' VAL . 57.0 m -53.53 -56.33 17.92 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.259 -0.901 . . . . 0.0 110.411 -179.851 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -53.75 -41.09 66.75 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.302 -0.874 . . . . 0.0 110.498 -179.698 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -75.19 -27.67 59.73 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.179 -0.951 . . . . 0.0 110.419 -179.761 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 5.3 mp -86.44 -55.38 3.92 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.1 -1.0 . . . . 0.0 110.307 -179.967 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' GLN . . . . . 0.721 ' O ' HG23 ' A' ' 20' ' ' VAL . 1.6 mt-30 -51.48 -37.73 50.43 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.14 -0.975 . . . . 0.0 109.877 179.694 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 17' ' ' GLY . . . . . 0.421 ' O ' ' CG ' ' A' ' 21' ' ' GLU . . . -69.18 -55.5 10.35 Favored Glycine 0 N--CA 1.489 2.232 0 N-CA-C 108.988 -1.645 . . . . 0.0 108.988 179.45 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 18' ' ' TYR . . . . . 0.497 ' O ' HG23 ' A' ' 22' ' ' VAL . 21.5 t80 -50.48 -32.12 17.18 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.349 -1.089 . . . . 0.0 110.088 179.673 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.477 HG21 ' HA ' ' C' ' 6' ' ' ALA . 94.4 m -76.25 -32.45 58.87 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.465 -0.772 . . . . 0.0 110.053 179.936 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.721 HG23 ' O ' ' A' ' 16' ' ' GLN . 95.1 t -78.5 -18.78 13.4 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.62 0 O-C-N 121.296 -0.877 . . . . 0.0 110.673 -179.858 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.44 ' HG3' ' HA ' ' A' ' 18' ' ' TYR . 1.3 mt-10 -84.87 -57.99 2.88 Favored 'General case' 0 N--CA 1.498 1.933 0 O-C-N 121.008 -1.057 . . . . 0.0 109.036 179.91 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.497 HG23 ' O ' ' A' ' 18' ' ' TYR . 39.8 t -51.65 -34.25 15.92 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.477 0 O-C-N 121.643 -0.661 . . . . 0.0 109.94 179.821 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.466 ' HB3' HD21 ' C' ' 2' ' ' LEU . 2.4 mp -76.53 -37.94 55.9 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.389 -0.82 . . . . 0.0 109.774 179.51 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 24' ' ' ARG . . . . . 0.405 ' HG3' ' O ' ' A' ' 20' ' ' VAL . 0.4 OUTLIER -66.36 -24.67 66.54 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.37 -0.831 . . . . 0.0 110.002 179.874 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 25' ' ' GLN . . . . . 0.405 ' O ' ' C ' ' A' ' 26' ' ' GLN . 0.8 OUTLIER -143.81 59.45 1.37 Allowed 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.265 -0.897 . . . . 0.0 110.212 -179.991 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 26' ' ' GLN . . . . . 0.405 ' C ' ' O ' ' A' ' 25' ' ' GLN . 6.2 pt20 -34.72 95.56 0.09 OUTLIER Pre-proline 0 N--CA 1.505 2.28 0 CA-C-O 120.959 0.409 . . . . 0.0 111.741 -179.75 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 27' ' ' PRO . . . . . 0.401 ' HD3' ' O ' ' A' ' 25' ' ' GLN . 46.7 Cg_endo -73.72 161.01 42.77 Favored 'Trans proline' 0 C--N 1.312 -1.348 0 O-C-N 123.876 1.461 . . . . 0.0 110.515 -179.614 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 43.5 Cg_endo -70.18 -29.54 21.73 Favored 'Trans proline' 0 C--N 1.31 -1.451 0 O-C-N 123.689 1.363 . . . . 0.0 110.224 179.79 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -142.83 118.46 10.42 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.207 -0.933 . . . . 0.0 110.086 179.712 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.574 ' CD2' HD13 ' B' ' 14' ' ' LEU . 4.9 tp -76.79 -24.58 52.86 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.264 -0.897 . . . . 0.0 109.937 179.934 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.421 HG23 ' H ' ' A' ' 31' ' ' VAL . 43.7 t -52.83 -62.96 0.53 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.61 0 O-C-N 121.313 -0.867 . . . . 0.0 110.05 179.791 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -60.82 -43.03 98.78 Favored 'General case' 0 C--N 1.302 -1.457 0 O-C-N 121.504 -0.748 . . . . 0.0 110.02 179.826 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 33' ' ' PHE . . . . . 0.421 ' CE2' HG22 ' A' ' 22' ' ' VAL . 90.7 t80 -59.79 -43.71 94.27 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.128 -0.983 . . . . 0.0 109.678 179.502 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 34' ' ' ALA . . . . . 0.579 ' HB1' ' CD2' ' B' ' 38' ' ' PHE . . . -54.68 -43.99 72.96 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.311 -0.868 . . . . 0.0 109.735 179.626 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.55 HG13 ' OG1' ' B' ' 39' ' ' THR . 54.5 t -71.77 -49.28 46.58 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.335 0 O-C-N 121.309 -0.87 . . . . 0.0 109.94 179.741 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -62.04 -27.65 69.03 Favored 'General case' 0 N--CA 1.487 1.38 0 O-C-N 121.276 -0.89 . . . . 0.0 109.812 179.829 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 73.7 t80 -72.67 -72.04 0.26 Allowed 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.215 -0.928 . . . . 0.0 110.414 -179.734 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' PHE . . . . . 0.431 ' CD2' ' HB1' ' B' ' 34' ' ' ALA . 27.3 m-85 -54.63 -47.79 73.04 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.209 -0.932 . . . . 0.0 110.446 -179.796 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 39' ' ' THR . . . . . 0.509 ' OG1' HG13 ' B' ' 35' ' ' VAL . 99.1 m -52.39 -34.19 46.94 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.102 -0.999 . . . . 0.0 109.94 179.84 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 1.9 tpt85 -75.92 -23.05 55.46 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.312 -0.867 . . . . 0.0 109.902 179.645 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.446 ' HA ' HD22 ' A' ' 41' ' ' LEU . 0.2 OUTLIER -65.54 -40.7 93.21 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.253 -0.904 . . . . 0.0 110.189 179.967 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.78 -22.29 34.81 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.321 -0.862 . . . . 0.0 110.431 -179.847 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 -83.25 -31.87 26.74 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.252 -0.905 . . . . 0.0 110.457 -179.725 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -83.0 -77.66 0.24 Allowed 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.213 -0.929 . . . . 0.0 110.764 -179.782 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -61.57 102.17 0.23 Allowed 'General case' 0 C--N 1.304 -1.372 0 O-C-N 121.429 -0.794 . . . . 0.0 110.289 -179.056 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 2.5 mtp85 . . . . . 0 N--CA 1.492 1.664 0 CA-C-O 118.098 -0.953 . . . . 0.0 110.247 -179.921 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 1' ' ' HIS . . . . . . . . . . . . . 39.9 m80 . . . . . 0 N--CA 1.491 1.599 0 CA-C-O 121.313 0.578 . . . . 0.0 110.101 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 2' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -54.94 -56.27 21.53 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.253 -0.904 . . . . 0.0 110.255 -179.967 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 3' ' ' GLY . . . . . . . . . . . . . . . 176.36 161.48 25.46 Favored Glycine 0 N--CA 1.49 2.265 0 N-CA-C 109.705 -1.358 . . . . 0.0 109.705 -179.969 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 4' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -122.68 96.04 4.87 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.314 -1.109 . . . . 0.0 110.189 179.905 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 5' ' ' ILE . . . . . 0.647 HG23 ' O ' ' B' ' 5' ' ' ILE . 1.9 tt -128.44 61.43 0.3 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.592 0 O-C-N 121.245 -0.91 . . . . 0.0 110.359 -179.888 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 6' ' ' GLN . . . . . . . . . . . . . 31.4 mt-30 -124.51 83.86 2.21 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.284 -0.885 . . . . 0.0 110.246 -179.996 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 7' ' ' ILE . . . . . . . . . . . . . 50.4 mm -107.57 97.74 21.13 Favored Pre-proline 0 N--CA 1.492 1.67 0 O-C-N 121.247 -0.908 . . . . 0.0 110.139 179.868 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 46.5 Cg_endo -72.57 116.8 4.85 Favored 'Trans proline' 0 C--N 1.312 -1.365 0 O-C-N 123.715 1.376 . . . . 0.0 110.626 -179.96 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 9' ' ' PRO . . . . . . . . . . . . . 45.9 Cg_endo -72.93 -176.61 2.45 Favored 'Trans proline' 0 C--N 1.313 -1.339 0 O-C-N 123.592 1.311 . . . . 0.0 110.386 179.986 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 118.51 -26.97 7.46 Favored Glycine 0 N--CA 1.491 2.337 0 N-CA-C 109.573 -1.411 . . . . 0.0 109.573 179.969 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 11' ' ' LEU . . . . . 0.43 ' HG ' HD23 ' B' ' 15' ' ' LEU . 4.5 tt -73.64 -24.07 59.96 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.279 -1.13 . . . . 0.0 110.314 -179.921 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 23.4 m -57.94 -58.75 7.03 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.227 -0.921 . . . . 0.0 110.119 -179.989 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 4.5 mt-10 -53.9 -44.7 70.74 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.415 -0.803 . . . . 0.0 110.195 -179.975 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 14' ' ' LEU . . . . . 0.574 HD13 ' CD2' ' A' ' 30' ' ' LEU . 6.5 mt -55.71 -57.94 9.92 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.209 -0.932 . . . . 0.0 110.124 179.967 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 15' ' ' LEU . . . . . 0.51 ' HA ' HD13 ' B' ' 15' ' ' LEU . 3.6 mm? -60.86 -37.94 83.86 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.315 -0.866 . . . . 0.0 110.122 179.92 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 16' ' ' GLN . . . . . 0.472 ' O ' HG23 ' B' ' 20' ' ' VAL . 2.3 tt0 -51.94 -52.01 53.09 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.241 -0.912 . . . . 0.0 110.314 179.899 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 17' ' ' GLY . . . . . 0.409 ' O ' ' HG3' ' B' ' 21' ' ' GLU . . . -56.14 -51.53 55.21 Favored Glycine 0 N--CA 1.49 2.249 0 N-CA-C 109.142 -1.583 . . . . 0.0 109.142 179.665 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 18' ' ' TYR . . . . . 0.673 ' OH ' ' HB2' ' B' ' 34' ' ' ALA . 14.8 t80 -53.98 -40.16 66.67 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.332 -1.099 . . . . 0.0 110.083 179.684 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 54.1 m -62.75 -41.4 99.19 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.435 -0.79 . . . . 0.0 110.386 -179.844 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 20' ' ' VAL . . . . . 0.568 HG22 ' CD2' ' C' ' 16' ' ' LEU . 48.9 t -65.42 -18.81 24.54 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.66 0 O-C-N 121.148 -0.97 . . . . 0.0 110.378 -179.938 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 21' ' ' GLU . . . . . 0.468 ' HG3' ' HA ' ' B' ' 18' ' ' TYR . 1.4 mt-10 -93.32 -49.84 5.75 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.126 -0.984 . . . . 0.0 109.051 179.793 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 22' ' ' VAL . . . . . 0.604 ' CG1' HD11 ' B' ' 30' ' ' LEU . 85.7 t -58.92 -28.4 38.15 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.461 0 O-C-N 121.719 -0.613 . . . . 0.0 110.02 179.962 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 8.5 tp -85.18 -43.47 13.79 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.26 -0.9 . . . . 0.0 109.891 179.583 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -78.34 -64.16 1.23 Allowed 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.36 -0.838 . . . . 0.0 110.1 179.874 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 25' ' ' GLN . . . . . 0.404 ' HB3' ' HD3' ' B' ' 27' ' ' PRO . 0.0 OUTLIER -55.06 -37.88 67.3 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.323 -0.86 . . . . 0.0 110.127 179.824 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 2.0 tt0 52.16 60.54 13.31 Favored Pre-proline 0 N--CA 1.491 1.61 0 O-C-N 121.246 -0.908 . . . . 0.0 110.306 -179.947 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 27' ' ' PRO . . . . . 0.404 ' HD3' ' HB3' ' B' ' 25' ' ' GLN . 45.2 Cg_endo -71.35 151.5 60.01 Favored 'Trans proline' 0 C--N 1.313 -1.341 0 O-C-N 123.586 1.308 . . . . 0.0 110.505 -179.973 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 45.2 Cg_endo -70.62 -33.25 13.62 Favored 'Trans proline' 0 C--N 1.311 -1.421 0 O-C-N 123.637 1.335 . . . . 0.0 110.392 179.873 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 29' ' ' ASP . . . . . 0.403 ' O ' ' HB2' ' B' ' 33' ' ' PHE . 2.1 m-20 -118.35 117.13 28.24 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.304 -0.873 . . . . 0.0 110.207 -179.998 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 30' ' ' LEU . . . . . 0.604 HD11 ' CG1' ' B' ' 22' ' ' VAL . 0.1 OUTLIER -82.3 -46.49 13.58 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.296 -0.877 . . . . 0.0 110.013 179.9 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 31' ' ' VAL . . . . . 0.58 ' O ' HG23 ' B' ' 35' ' ' VAL . 40.7 t -53.62 -51.83 39.39 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.695 0 O-C-N 121.384 -0.823 . . . . 0.0 109.608 179.569 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 7.9 t0 -67.95 -35.78 78.98 Favored 'General case' 0 C--N 1.303 -1.45 0 O-C-N 121.648 -0.657 . . . . 0.0 109.782 179.812 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 33' ' ' PHE . . . . . 0.403 ' HB2' ' O ' ' B' ' 29' ' ' ASP . 44.0 t80 -67.03 -44.69 79.58 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.23 -0.919 . . . . 0.0 109.396 179.359 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 34' ' ' ALA . . . . . 0.673 ' HB2' ' OH ' ' B' ' 18' ' ' TYR . . . -57.49 -36.89 72.07 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.363 -0.835 . . . . 0.0 109.777 179.604 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 35' ' ' VAL . . . . . 0.58 HG23 ' O ' ' B' ' 31' ' ' VAL . 99.4 t -69.5 -43.91 80.28 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.301 0 O-C-N 121.298 -0.876 . . . . 0.0 110.018 179.79 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -67.28 -30.47 70.35 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.244 -0.91 . . . . 0.0 110.046 179.755 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 37' ' ' TYR . . . . . 0.468 ' CE1' ' OE1' ' B' ' 21' ' ' GLU . 82.9 t80 -73.67 -63.39 1.21 Allowed 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.349 -0.844 . . . . 0.0 110.185 179.977 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 38' ' ' PHE . . . . . 0.579 ' CD2' ' HB1' ' A' ' 34' ' ' ALA . 9.3 m-85 -57.04 -48.7 77.9 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.259 -0.901 . . . . 0.0 110.413 -179.976 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 39' ' ' THR . . . . . 0.55 ' OG1' HG13 ' A' ' 35' ' ' VAL . 57.4 m -53.93 -36.63 62.98 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.139 -0.976 . . . . 0.0 110.013 179.848 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.36 -25.85 61.68 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.292 -0.88 . . . . 0.0 109.923 179.706 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 4.7 mt -72.79 -28.87 62.85 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.254 -0.904 . . . . 0.0 110.025 179.879 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -76.5 -23.46 53.73 Favored 'General case' 0 C--N 1.306 -1.284 0 O-C-N 121.302 -0.874 . . . . 0.0 109.717 179.882 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 43' ' ' GLU . . . . . . . . . . . . . 26.3 mt-10 -82.71 -30.88 28.81 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.297 -0.877 . . . . 0.0 110.188 179.907 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -82.96 -74.78 0.34 Allowed 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.343 -0.848 . . . . 0.0 110.373 179.971 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 45' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -50.77 164.05 0.16 Allowed 'General case' 0 N--CA 1.488 1.444 0 O-C-N 121.588 -0.695 . . . . 0.0 110.466 -179.262 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 16.1 ttt180 . . . . . 0 N--CA 1.492 1.645 0 CA-C-O 118.048 -0.977 . . . . 0.0 110.173 179.987 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' C' C ' 1' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.492 1.659 0 CA-C-O 121.147 0.498 . . . . 0.0 110.23 . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 2' ' ' LEU . . . . . 0.466 HD21 ' HB3' ' A' ' 23' ' ' LEU . 5.5 mp 53.99 21.02 2.67 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.389 -0.819 . . . . 0.0 110.585 179.964 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 3' ' ' ILE . . . . . . . . . . . . . 19.3 tt -88.27 -18.87 7.92 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.636 0 O-C-N 121.165 -0.96 . . . . 0.0 110.295 179.894 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 4' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -98.35 -9.22 25.68 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.179 -0.951 . . . . 0.0 110.785 -179.892 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 5' ' ' THR . . . . . 0.528 HG22 ' CD1' ' C' ' 9' ' ' LEU . 65.9 m -113.29 -54.12 2.64 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 120.983 -1.073 . . . . 0.0 110.511 -179.807 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 6' ' ' ALA . . . . . 0.477 ' HA ' HG21 ' A' ' 19' ' ' THR . . . -61.76 -56.95 14.14 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.124 -0.985 . . . . 0.0 110.316 -179.785 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 7' ' ' SER . . . . . 0.4 ' O ' ' HB2' ' C' ' 11' ' ' LYS . 47.4 m -65.4 -25.2 67.44 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.224 -0.923 . . . . 0.0 110.339 -179.857 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 8' ' ' SER . . . . . . . . . . . . . 1.1 t -82.87 -39.49 21.54 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.206 -0.934 . . . . 0.0 110.403 -179.916 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 9' ' ' LEU . . . . . 0.528 ' CD1' HG22 ' C' ' 5' ' ' THR . 29.7 mt -61.06 -55.39 33.17 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.207 -0.933 . . . . 0.0 110.399 -179.891 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 10' ' ' VAL . . . . . 0.748 HG21 HG23 ' A' ' 12' ' ' THR . 12.3 p -58.17 -38.97 71.19 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.601 0 O-C-N 121.163 -0.961 . . . . 0.0 110.213 -179.941 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 11' ' ' LYS . . . . . 0.515 ' N ' HG13 ' C' ' 10' ' ' VAL . 5.2 tttm -54.76 -57.79 10.13 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.239 -0.913 . . . . 0.0 110.211 -179.927 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 12' ' ' ASN . . . . . . . . . . . . . 2.8 m-20 -67.29 -23.67 65.68 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.161 -0.962 . . . . 0.0 110.064 179.917 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 13' ' ' ALA . . . . . . . . . . . . . . . -68.18 -43.05 79.01 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.283 -0.886 . . . . 0.0 110.109 179.965 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 14' ' ' ILE . . . . . . . . . . . . . 45.5 mm -69.99 -26.79 30.7 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.601 0 O-C-N 121.215 -0.928 . . . . 0.0 109.911 179.795 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 15' ' ' GLN . . . . . . . . . . . . . 32.8 mt-30 -57.69 -24.19 55.54 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.254 -0.904 . . . . 0.0 109.976 179.729 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 16' ' ' LEU . . . . . 0.568 ' CD2' HG22 ' B' ' 20' ' ' VAL . 0.0 OUTLIER -56.55 -21.26 25.2 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.187 -0.946 . . . . 0.0 109.553 179.293 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' C' C ' 17' ' ' SER . . . . . 0.454 ' O ' ' CG1' ' C' ' 18' ' ' ILE . 2.8 m -82.2 54.09 2.44 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.291 -0.88 . . . . 0.0 109.907 179.477 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 18' ' ' ILE . . . . . 0.456 ' O ' ' N ' ' C' ' 20' ' ' GLN . 18.4 pt 41.36 27.28 0.1 OUTLIER 'Isoleucine or valine' 0 N--CA 1.498 1.941 0 O-C-N 121.911 -0.493 . . . . 0.0 111.731 -179.801 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 19' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 61.81 -71.08 0.04 OUTLIER 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.408 -0.808 . . . . 0.0 111.571 178.942 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 20' ' ' GLN . . . . . 0.456 ' N ' ' O ' ' C' ' 18' ' ' ILE . 3.4 mt-30 -49.56 -27.35 4.35 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.315 -0.866 . . . . 0.0 110.921 -179.115 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 21' ' ' LEU . . . . . 0.455 ' HB2' ' CG1' ' C' ' 18' ' ' ILE . 0.3 OUTLIER -89.65 53.84 2.7 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.048 -1.032 . . . . 0.0 110.138 179.997 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' C' C ' 22' ' ' VAL . . . . . 0.61 ' O ' HG22 ' C' ' 22' ' ' VAL . 7.6 p . . . . . 0 N--CA 1.492 1.636 0 CA-C-O 117.96 -1.019 . . . . 0.0 110.179 179.942 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.238 0 N-CA-C 109.498 -1.441 . . . . 0.0 109.498 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.676 HD22 HD11 ' A' ' 15' ' ' LEU . 0.8 OUTLIER -76.0 -21.98 56.32 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.232 -1.158 . . . . 0.0 110.099 179.937 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 92.6 m -74.07 -37.35 64.26 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.236 -0.915 . . . . 0.0 110.213 -179.97 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -82.04 -47.46 12.6 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.367 -0.833 . . . . 0.0 110.208 179.986 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -53.45 -41.72 66.41 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.177 -0.952 . . . . 0.0 110.115 179.86 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.891 HD22 HD11 ' B' ' 15' ' ' LEU . 71.0 mt -71.48 -37.53 71.29 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.191 -0.943 . . . . 0.0 109.989 179.789 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . 0.723 ' O ' HG23 ' A' ' 20' ' ' VAL . 0.0 OUTLIER -64.38 -34.13 77.46 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.275 -0.891 . . . . 0.0 110.137 179.893 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -67.43 -45.23 80.38 Favored Glycine 0 N--CA 1.491 2.315 0 N-CA-C 109.218 -1.553 . . . . 0.0 109.218 179.721 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . 0.629 ' OH ' ' HB2' ' A' ' 34' ' ' ALA . 20.4 t80 -63.6 -47.22 82.33 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.346 -1.091 . . . . 0.0 109.697 179.581 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 59.4 m -57.42 -27.1 62.1 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.329 -0.857 . . . . 0.0 110.139 179.715 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.723 HG23 ' O ' ' A' ' 16' ' ' GLN . 46.1 t -74.74 -73.91 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.59 0 O-C-N 121.396 -0.815 . . . . 0.0 110.316 -179.959 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.469 ' OE1' ' CE1' ' A' ' 37' ' ' TYR . 10.3 pt-20 -44.7 -44.32 9.05 Favored 'General case' 0 N--CA 1.497 1.898 0 O-C-N 121.482 -0.761 . . . . 0.0 111.319 -179.443 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.588 HG23 ' O ' ' A' ' 18' ' ' TYR . 89.6 t -55.21 -50.84 61.08 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.638 0 O-C-N 120.96 -1.087 . . . . 0.0 110.188 179.969 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.53 HD13 HD11 ' C' ' 2' ' ' LEU . 88.8 mt -77.34 -3.64 41.05 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.319 -0.863 . . . . 0.0 110.892 -179.734 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -106.72 -52.78 2.72 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 120.923 -1.111 . . . . 0.0 110.388 -179.919 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 3.3 tp-100 -78.89 -24.98 43.83 Favored 'General case' 0 C--N 1.306 -1.322 0 O-C-N 121.278 -0.889 . . . . 0.0 109.831 -179.999 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 2.7 mt-30 52.77 70.85 1.64 Allowed Pre-proline 0 N--CA 1.491 1.59 0 O-C-N 121.192 -0.942 . . . . 0.0 110.091 179.996 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 45.4 Cg_endo -70.3 159.7 52.08 Favored 'Trans proline' 0 C--N 1.31 -1.485 0 O-C-N 123.67 1.353 . . . . 0.0 110.5 -179.95 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 44.4 Cg_endo -71.22 -30.4 15.95 Favored 'Trans proline' 0 C--N 1.311 -1.402 0 O-C-N 123.761 1.4 . . . . 0.0 110.278 179.96 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -140.26 116.01 10.23 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.267 -0.896 . . . . 0.0 110.17 179.864 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 16.7 tp -67.45 -38.73 84.92 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.221 -0.924 . . . . 0.0 109.955 179.972 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 42.6 t -55.06 -66.55 0.26 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.632 0 O-C-N 121.379 -0.825 . . . . 0.0 109.837 179.796 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -56.78 -34.63 67.81 Favored 'General case' 0 N--CA 1.487 1.406 0 O-C-N 121.48 -0.763 . . . . 0.0 109.819 179.735 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 46.1 t80 -64.18 -47.71 78.76 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.269 -0.895 . . . . 0.0 109.609 179.337 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . 0.629 ' HB2' ' OH ' ' A' ' 18' ' ' TYR . . . -52.53 -32.07 38.7 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.369 -0.832 . . . . 0.0 110.132 179.762 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.471 HG13 ' OG1' ' B' ' 39' ' ' THR . 58.5 t -74.86 -39.04 45.0 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.388 0 O-C-N 121.379 -0.826 . . . . 0.0 110.356 -179.963 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 39.5 mm-40 -72.23 -32.0 66.33 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.148 -0.97 . . . . 0.0 110.479 -179.763 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . 0.469 ' CE1' ' OE1' ' A' ' 21' ' ' GLU . 34.1 t80 -73.37 -68.88 0.46 Allowed 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.256 -0.902 . . . . 0.0 110.594 -179.686 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . 0.471 ' CD2' ' O ' ' A' ' 34' ' ' ALA . 24.1 m-85 -50.28 -49.51 53.16 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.207 -0.933 . . . . 0.0 110.665 -179.565 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . 0.464 ' OG1' HG13 ' B' ' 35' ' ' VAL . 45.5 m -52.35 -40.51 62.05 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.151 -0.968 . . . . 0.0 109.941 179.912 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 12.0 mtt85 -74.93 -27.0 60.03 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.253 -0.904 . . . . 0.0 109.717 179.562 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -58.23 -32.38 68.27 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.317 -0.865 . . . . 0.0 109.745 179.655 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.417 ' NH2' ' OD1' ' B' ' 32' ' ' ASP . 5.0 ttp180 -53.09 -43.42 66.77 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.385 -0.822 . . . . 0.0 110.158 179.945 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 5.5 mt-10 -75.32 -30.88 60.46 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.327 -0.858 . . . . 0.0 110.468 -179.748 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.635 0 O-C-N 121.185 -0.947 . . . . 0.0 110.663 -179.787 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 47.8 Cg_endo . . . . . 0 N--CA 1.485 1.003 0 N-CA-C 110.671 -0.55 . . . . 0.0 110.671 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' B' B ' 9' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_endo -76.82 165.21 28.95 Favored 'Trans proline' 0 C--N 1.313 -1.34 0 O-C-N 123.594 1.312 . . . . 0.0 110.378 179.848 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 108.65 -26.09 17.21 Favored Glycine 0 N--CA 1.491 2.33 0 N-CA-C 109.93 -1.268 . . . . 0.0 109.93 179.64 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 11' ' ' LEU . . . . . 0.626 HD23 HD23 ' B' ' 15' ' ' LEU . 0.4 OUTLIER -80.2 -26.8 39.04 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.16 -1.2 . . . . 0.0 110.267 -179.89 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 88.8 m -68.53 -36.99 79.61 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.194 -0.941 . . . . 0.0 110.344 179.993 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -74.27 -40.48 62.3 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.28 -0.888 . . . . 0.0 110.111 179.923 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 14' ' ' LEU . . . . . 0.44 HD23 ' HA ' ' B' ' 14' ' ' LEU . 3.2 mt -62.68 -37.6 87.1 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.183 -0.948 . . . . 0.0 110.055 179.786 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . 0.891 HD11 HD22 ' A' ' 15' ' ' LEU . 1.3 mm? -72.84 -49.07 32.45 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.324 -0.86 . . . . 0.0 110.054 179.859 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 16' ' ' GLN . . . . . 0.793 ' O ' HG23 ' B' ' 20' ' ' VAL . 2.5 mt-30 -55.52 -37.54 68.04 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.282 -0.886 . . . . 0.0 110.013 179.789 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 17' ' ' GLY . . . . . . . . . . . . . . . -62.59 -40.29 98.95 Favored Glycine 0 N--CA 1.489 2.224 0 N-CA-C 109.0 -1.64 . . . . 0.0 109.0 179.769 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 18' ' ' TYR . . . . . 0.621 ' OH ' ' HB2' ' B' ' 34' ' ' ALA . 34.1 t80 -71.17 -53.71 13.53 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.304 -1.116 . . . . 0.0 109.722 179.572 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 90.6 m -51.1 -27.07 7.48 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.239 -0.913 . . . . 0.0 110.185 179.721 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 20' ' ' VAL . . . . . 0.793 HG23 ' O ' ' B' ' 16' ' ' GLN . 55.7 t -73.88 -75.44 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.651 0 O-C-N 121.316 -0.865 . . . . 0.0 109.829 179.669 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 21' ' ' GLU . . . . . 0.443 ' HG3' ' N ' ' B' ' 22' ' ' VAL . 11.0 pt-20 -47.09 -41.5 17.28 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.459 -0.775 . . . . 0.0 110.793 -179.849 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 22' ' ' VAL . . . . . 0.72 ' CG1' HD11 ' B' ' 30' ' ' LEU . 78.7 t -55.94 -44.9 79.59 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.575 0 O-C-N 121.176 -0.953 . . . . 0.0 110.116 179.912 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -73.22 -26.18 61.03 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.196 -0.94 . . . . 0.0 110.4 -179.86 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.55 -55.47 4.11 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.113 -0.992 . . . . 0.0 110.425 -179.868 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 25' ' ' GLN . . . . . 0.437 ' O ' ' CG ' ' B' ' 26' ' ' GLN . 5.6 mp0 -65.67 -20.35 66.26 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.147 -0.97 . . . . 0.0 110.657 -179.708 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 26' ' ' GLN . . . . . 0.437 ' CG ' ' O ' ' B' ' 25' ' ' GLN . 12.7 pt20 36.45 55.22 2.91 Favored Pre-proline 0 N--CA 1.507 2.38 0 O-C-N 122.058 -0.401 . . . . 0.0 111.534 -179.791 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 27' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_endo -68.09 152.02 76.82 Favored 'Trans proline' 0 C--N 1.31 -1.488 0 O-C-N 123.678 1.357 . . . . 0.0 110.526 -179.798 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 44.3 Cg_endo -71.06 -14.41 31.96 Favored 'Trans proline' 0 C--N 1.312 -1.392 0 O-C-N 123.755 1.397 . . . . 0.0 110.503 -179.958 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 12.5 m-20 -137.46 111.2 8.16 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.066 -1.021 . . . . 0.0 110.282 179.915 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 30' ' ' LEU . . . . . 0.72 HD11 ' CG1' ' B' ' 22' ' ' VAL . 0.2 OUTLIER -76.73 -34.19 58.11 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.345 -0.847 . . . . 0.0 109.492 179.641 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 21.6 t -61.93 -50.8 78.65 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.603 0 CA-C-O 121.658 0.742 . . . . 0.0 109.468 179.484 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 32' ' ' ASP . . . . . 0.417 ' OD1' ' NH2' ' A' ' 42' ' ' ARG . 10.5 t70 -67.61 -30.25 69.78 Favored 'General case' 0 C--N 1.303 -1.456 0 O-C-N 121.643 -0.661 . . . . 0.0 109.97 179.775 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 33' ' ' PHE . . . . . . . . . . . . . 83.5 t80 -72.68 -39.48 67.03 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.273 -0.892 . . . . 0.0 109.501 179.284 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 34' ' ' ALA . . . . . 0.621 ' HB2' ' OH ' ' B' ' 18' ' ' TYR . . . -65.83 -38.35 88.67 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.376 -0.827 . . . . 0.0 109.938 179.633 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 35' ' ' VAL . . . . . 0.464 HG13 ' OG1' ' A' ' 39' ' ' THR . 96.8 t -73.8 -32.58 35.01 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.325 0 O-C-N 121.309 -0.87 . . . . 0.0 110.195 179.886 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -80.13 -30.18 38.98 Favored 'General case' 0 N--CA 1.487 1.42 0 O-C-N 121.262 -0.899 . . . . 0.0 109.592 179.892 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 37' ' ' TYR . . . . . . . . . . . . . 16.5 t80 -76.96 -64.14 1.2 Allowed 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.18 -0.95 . . . . 0.0 110.205 -179.957 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 12.7 m-85 -51.95 -50.27 61.54 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.255 -0.903 . . . . 0.0 110.444 -179.845 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 39' ' ' THR . . . . . 0.471 ' OG1' HG13 ' A' ' 35' ' ' VAL . 43.1 m -53.19 -40.98 64.82 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.2 -0.938 . . . . 0.0 110.031 179.853 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 16.6 ttt85 -72.13 -25.27 61.66 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.266 -0.896 . . . . 0.0 110.076 179.766 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -57.68 -55.27 37.02 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.262 -0.899 . . . . 0.0 110.089 179.856 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.93 -36.22 26.95 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.16 -0.963 . . . . 0.0 110.633 -179.958 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 43' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 . . . . . 0 N--CA 1.491 1.612 0 O-C-N 121.211 -0.931 . . . . 0.0 110.371 -179.844 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' C' C ' 2' ' ' LEU . . . . . 0.53 HD11 HD13 ' A' ' 23' ' ' LEU . 4.0 tp . . . . . 0 N--CA 1.491 1.584 0 CA-C-O 121.245 0.545 . . . . 0.0 110.222 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 3' ' ' ILE . . . . . . . . . . . . . 1.8 pp -63.09 -23.16 32.55 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.591 0 O-C-N 121.339 -0.851 . . . . 0.0 110.239 -179.977 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 4' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 -78.6 -32.35 47.54 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.235 -0.916 . . . . 0.0 110.329 -179.918 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 5' ' ' THR . . . . . . . . . . . . . 93.1 m -74.82 -34.57 62.38 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.221 -0.924 . . . . 0.0 110.262 -179.958 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 6' ' ' ALA . . . . . 0.436 ' HA ' ' HB2' ' C' ' 9' ' ' LEU . . . -77.7 -37.92 48.48 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.243 -0.911 . . . . 0.0 110.306 -179.895 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' C' C ' 7' ' ' SER . . . . . . . . . . . . . 31.9 m -52.44 -69.85 0.1 Allowed 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.157 -0.964 . . . . 0.0 110.204 -179.885 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 8' ' ' SER . . . . . . . . . . . . . 1.9 m -58.68 -24.54 61.52 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.262 -0.899 . . . . 0.0 110.265 179.908 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 9' ' ' LEU . . . . . 0.436 ' HB2' ' HA ' ' C' ' 6' ' ' ALA . 0.4 OUTLIER -52.24 -43.14 64.15 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.248 -0.907 . . . . 0.0 110.301 -179.923 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' C' C ' 10' ' ' VAL . . . . . . . . . . . . . 71.1 t -71.95 -30.11 35.73 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.595 0 O-C-N 121.166 -0.959 . . . . 0.0 110.309 -179.887 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 11' ' ' LYS . . . . . . . . . . . . . 34.4 mmtm -66.05 -48.6 70.51 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.19 -0.944 . . . . 0.0 110.361 -179.901 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' C' C ' 12' ' ' ASN . . . . . . . . . . . . . 28.7 m-80 . . . . . 0 N--CA 1.492 1.646 0 O-C-N 121.288 -0.882 . . . . 0.0 110.262 -179.918 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.396 0 N-CA-C 109.608 -1.397 . . . . 0.0 109.608 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -69.06 -23.14 64.0 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.236 -1.156 . . . . 0.0 110.35 -179.881 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 31.9 m -76.91 -51.15 11.72 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.221 -0.925 . . . . 0.0 110.259 -179.96 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -57.77 -31.71 66.79 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.262 -0.899 . . . . 0.0 110.272 -179.923 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.1 mp -72.29 -40.35 67.64 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.357 -0.84 . . . . 0.0 110.282 -179.882 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 5.8 mp -77.79 -52.76 8.4 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.284 -0.885 . . . . 0.0 110.246 -179.94 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . 0.435 ' O ' HG23 ' A' ' 20' ' ' VAL . 1.0 OUTLIER -51.79 -44.27 63.38 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.185 -0.947 . . . . 0.0 110.257 179.956 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -58.38 -47.76 87.82 Favored Glycine 0 N--CA 1.49 2.297 0 N-CA-C 109.149 -1.58 . . . . 0.0 109.149 179.729 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . 0.645 ' O ' HG23 ' A' ' 22' ' ' VAL . 46.8 t80 -61.15 -47.19 87.37 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.271 -1.135 . . . . 0.0 109.629 179.466 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 7.9 m -56.58 -36.11 68.97 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.361 -0.837 . . . . 0.0 110.147 179.743 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.435 HG23 ' O ' ' A' ' 16' ' ' GLN . 41.6 t -67.15 -71.95 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.674 0 O-C-N 121.293 -0.879 . . . . 0.0 110.216 -179.981 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 5.4 pt-20 -46.58 -49.11 19.33 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.357 -0.839 . . . . 0.0 111.425 -179.392 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.746 HG11 HD11 ' B' ' 11' ' ' LEU . 93.5 t -50.8 -44.28 26.16 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.717 0 O-C-N 120.774 -1.204 . . . . 0.0 110.529 -179.777 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.42 ' HB3' HD11 ' C' ' 2' ' ' LEU . 0.2 OUTLIER -73.26 -25.1 60.56 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.218 -0.926 . . . . 0.0 110.252 -179.987 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -76.49 -69.39 0.51 Allowed 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.255 -0.903 . . . . 0.0 110.417 -179.929 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . 0.407 ' HG3' ' HD3' ' A' ' 27' ' ' PRO . 2.7 pt20 -71.94 -33.67 68.42 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.126 -0.984 . . . . 0.0 110.285 -179.845 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 52.13 81.38 0.26 Allowed Pre-proline 0 N--CA 1.492 1.662 0 O-C-N 121.275 -0.891 . . . . 0.0 110.18 179.965 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . 0.407 ' HD3' ' HG3' ' A' ' 25' ' ' GLN . 44.8 Cg_endo -71.82 162.3 42.4 Favored 'Trans proline' 0 C--N 1.311 -1.442 0 O-C-N 123.727 1.383 . . . . 0.0 110.528 -179.82 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo -70.14 -26.4 25.81 Favored 'Trans proline' 0 C--N 1.311 -1.44 0 O-C-N 123.803 1.423 . . . . 0.0 110.142 179.828 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 9.6 m-20 -139.15 112.22 8.0 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.361 -0.837 . . . . 0.0 109.726 179.588 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 3.5 tp -74.7 -33.49 62.44 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.32 -0.862 . . . . 0.0 110.29 -179.7 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.417 ' H ' HG23 ' A' ' 31' ' ' VAL . 43.2 t -50.78 -54.66 9.12 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.714 0 O-C-N 121.275 -0.89 . . . . 0.0 110.112 179.812 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -66.19 -44.18 84.7 Favored 'General case' 0 C--N 1.301 -1.533 0 O-C-N 121.565 -0.709 . . . . 0.0 110.148 179.911 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 36.7 t80 -58.18 -50.3 74.0 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.082 -1.011 . . . . 0.0 109.756 179.532 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . 0.416 ' HB2' ' OH ' ' A' ' 18' ' ' TYR . . . -49.22 -39.48 30.04 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.42 -0.8 . . . . 0.0 110.515 179.891 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.556 HG13 ' OG1' ' B' ' 39' ' ' THR . 90.3 t -73.88 -38.85 51.01 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.366 0 O-C-N 121.221 -0.924 . . . . 0.0 110.423 -179.883 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -74.17 -20.56 60.17 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.201 -0.937 . . . . 0.0 110.548 -179.661 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 26.6 t80 -75.65 -59.61 2.67 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.191 -0.943 . . . . 0.0 110.466 -179.899 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . 0.407 ' CD2' ' HB1' ' B' ' 34' ' ' ALA . 23.6 m-85 -67.44 -48.69 66.5 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.225 -0.922 . . . . 0.0 110.51 -179.824 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . 0.484 ' OG1' HG13 ' B' ' 35' ' ' VAL . 94.8 m -50.42 -41.56 52.62 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.174 -0.954 . . . . 0.0 110.29 -179.943 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 1.5 ttt180 -70.25 -25.2 63.26 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.177 -0.952 . . . . 0.0 110.13 179.697 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -62.54 -34.23 76.5 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.258 -0.901 . . . . 0.0 109.954 179.888 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.421 ' HD3' HG12 ' B' ' 31' ' ' VAL . 0.0 OUTLIER -54.64 -37.49 65.73 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.352 -0.843 . . . . 0.0 110.275 179.92 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -84.01 -25.53 29.87 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.217 -0.927 . . . . 0.0 110.4 -179.887 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.645 0 O-C-N 121.169 -0.957 . . . . 0.0 110.345 -179.983 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 47.7 Cg_endo . . . . . 0 N--CA 1.483 0.892 0 N-CA-C 110.349 -0.673 . . . . 0.0 110.349 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' B' B ' 9' ' ' PRO . . . . . . . . . . . . . 45.3 Cg_endo -72.53 177.8 7.01 Favored 'Trans proline' 0 C--N 1.313 -1.34 0 O-C-N 123.522 1.275 . . . . 0.0 110.49 179.967 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 99.28 -40.28 2.49 Favored Glycine 0 N--CA 1.491 2.3 0 N-CA-C 109.473 -1.451 . . . . 0.0 109.473 -179.943 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 11' ' ' LEU . . . . . 0.746 HD11 HG11 ' A' ' 22' ' ' VAL . 0.2 OUTLIER -63.22 -23.94 67.65 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.306 -1.114 . . . . 0.0 110.26 179.994 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 95.5 m -62.94 -61.38 2.43 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.223 -0.923 . . . . 0.0 110.214 179.929 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 -52.3 -32.81 39.38 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.342 -0.849 . . . . 0.0 110.248 -179.979 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 14.1 mt -66.59 -56.94 8.41 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.285 -0.884 . . . . 0.0 110.429 -179.852 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . 0.657 HD11 ' CD2' ' B' ' 11' ' ' LEU . 14.3 mt -66.03 -48.95 69.41 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.218 -0.926 . . . . 0.0 110.27 -179.943 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -52.02 -47.49 64.98 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.139 -0.976 . . . . 0.0 110.028 179.826 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 17' ' ' GLY . . . . . 0.404 ' O ' ' HB ' ' B' ' 20' ' ' VAL . . . -55.14 -42.54 82.04 Favored Glycine 0 N--CA 1.49 2.3 0 N-CA-C 109.066 -1.614 . . . . 0.0 109.066 179.508 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 18' ' ' TYR . . . . . 0.453 ' O ' HG23 ' B' ' 22' ' ' VAL . 19.0 t80 -64.87 -45.27 86.73 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.323 -1.104 . . . . 0.0 109.561 179.365 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 6.6 m -58.28 -24.08 58.36 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.424 -0.798 . . . . 0.0 110.022 179.675 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 20' ' ' VAL . . . . . 0.404 ' HB ' ' O ' ' B' ' 17' ' ' GLY . 51.2 t -78.07 -74.07 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.608 0 O-C-N 121.351 -0.843 . . . . 0.0 110.413 -179.828 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -45.28 -44.62 11.52 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.464 -0.772 . . . . 0.0 111.194 -179.305 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 22' ' ' VAL . . . . . 0.502 HG22 ' CE2' ' B' ' 33' ' ' PHE . 86.0 t -59.24 -47.17 91.25 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.6 0 O-C-N 120.947 -1.096 . . . . 0.0 109.737 179.808 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 3.0 tp -72.65 -19.45 61.44 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.293 -0.879 . . . . 0.0 110.038 179.594 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -81.5 -59.07 2.75 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.297 -0.877 . . . . 0.0 110.33 -179.913 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 25' ' ' GLN . . . . . 0.438 ' HG3' ' N ' ' B' ' 26' ' ' GLN . 0.0 OUTLIER -89.82 -23.01 21.82 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.206 -0.934 . . . . 0.0 110.586 -179.653 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 26' ' ' GLN . . . . . 0.438 ' N ' ' HG3' ' B' ' 25' ' ' GLN . 7.6 mt-30 47.96 81.78 0.25 Allowed Pre-proline 0 N--CA 1.494 1.76 0 O-C-N 121.159 -0.963 . . . . 0.0 110.674 179.752 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 27' ' ' PRO . . . . . . . . . . . . . 44.9 Cg_endo -73.09 166.55 29.71 Favored 'Trans proline' 0 C--N 1.31 -1.483 0 O-C-N 123.615 1.324 . . . . 0.0 110.598 -179.815 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 44.3 Cg_endo -70.52 -49.17 0.47 Allowed 'Trans proline' 0 C--N 1.311 -1.41 0 O-C-N 123.749 1.394 . . . . 0.0 110.176 179.785 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 10.0 m-20 -119.37 116.87 27.08 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.237 -0.914 . . . . 0.0 110.081 179.718 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 30' ' ' LEU . . . . . 0.448 ' HG ' ' HH ' ' B' ' 18' ' ' TYR . 0.6 OUTLIER -71.46 -29.26 64.65 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.27 -0.894 . . . . 0.0 110.444 -179.708 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 31' ' ' VAL . . . . . 0.421 HG12 ' HD3' ' A' ' 42' ' ' ARG . 43.4 t -49.9 -65.39 0.24 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.784 0 O-C-N 121.189 -0.945 . . . . 0.0 110.054 179.83 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 4.3 t0 -56.54 -46.54 80.59 Favored 'General case' 0 C--N 1.302 -1.492 0 O-C-N 121.466 -0.771 . . . . 0.0 109.961 179.679 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 33' ' ' PHE . . . . . 0.502 ' CE2' HG22 ' B' ' 22' ' ' VAL . 67.7 t80 -54.83 -47.35 74.21 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.174 -0.954 . . . . 0.0 109.832 179.68 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 34' ' ' ALA . . . . . 0.417 ' HB2' ' OH ' ' B' ' 18' ' ' TYR . . . -56.1 -40.19 73.31 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.324 -0.86 . . . . 0.0 109.935 179.74 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 35' ' ' VAL . . . . . 0.484 HG13 ' OG1' ' A' ' 39' ' ' THR . 76.9 t -77.32 -45.65 29.31 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.323 0 O-C-N 121.306 -0.871 . . . . 0.0 109.82 179.77 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -61.23 -36.26 79.48 Favored 'General case' 0 N--CA 1.487 1.403 0 O-C-N 121.3 -0.875 . . . . 0.0 109.329 179.495 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 37' ' ' TYR . . . . . . . . . . . . . 61.6 t80 -68.9 -59.34 3.13 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.295 -0.878 . . . . 0.0 110.141 179.872 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 12.1 m-85 -64.19 -49.57 71.52 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.257 -0.902 . . . . 0.0 110.576 -179.65 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 39' ' ' THR . . . . . 0.556 ' OG1' HG13 ' A' ' 35' ' ' VAL . 94.2 m -51.53 -27.7 11.54 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.1 -1.0 . . . . 0.0 110.056 179.953 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -75.49 -35.65 60.76 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.295 -0.878 . . . . 0.0 109.77 179.528 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.02 -27.83 68.61 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.389 -0.82 . . . . 0.0 110.301 179.926 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.26 -28.28 63.02 Favored 'General case' 0 N--CA 1.486 1.343 0 O-C-N 121.263 -0.898 . . . . 0.0 110.04 -179.922 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 43' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 . . . . . 0 N--CA 1.492 1.639 0 O-C-N 121.125 -0.984 . . . . 0.0 110.565 179.937 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' C' C ' 2' ' ' LEU . . . . . 0.42 HD11 ' HB3' ' A' ' 23' ' ' LEU . 0.1 OUTLIER . . . . . 0 N--CA 1.498 1.972 0 CA-C-O 121.164 0.506 . . . . 0.0 110.553 . . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 3' ' ' ILE . . . . . . . . . . . . . 2.9 mp -55.48 -23.37 13.97 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.61 0 O-C-N 121.083 -1.011 . . . . 0.0 110.321 -179.888 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 4' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -103.62 20.49 17.87 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.278 -0.889 . . . . 0.0 110.306 -179.883 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 5' ' ' THR . . . . . . . . . . . . . 78.7 m -138.34 -47.93 0.53 Allowed 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.189 -0.944 . . . . 0.0 110.078 179.825 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 6' ' ' ALA . . . . . 0.581 ' O ' HG22 ' C' ' 10' ' ' VAL . . . -61.39 -36.18 79.55 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.235 -0.916 . . . . 0.0 110.065 179.877 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 7' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -60.79 -45.43 94.4 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.28 -0.888 . . . . 0.0 110.117 179.884 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 8' ' ' SER . . . . . . . . . . . . . 6.3 t -70.92 -29.62 65.72 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.276 -0.89 . . . . 0.0 110.095 179.8 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 9' ' ' LEU . . . . . . . . . . . . . 3.2 tp -68.68 -62.8 1.23 Allowed 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.277 -0.89 . . . . 0.0 110.158 179.945 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 10' ' ' VAL . . . . . 0.581 HG22 ' O ' ' C' ' 6' ' ' ALA . 35.2 m -53.85 -27.78 16.07 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.628 0 O-C-N 121.314 -0.866 . . . . 0.0 110.173 -179.94 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' C' C ' 11' ' ' LYS . . . . . . . . . . . . . 1.8 tppt? -70.37 -38.72 74.8 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.291 -0.881 . . . . 0.0 110.255 -179.951 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' C' C ' 12' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 . . . . . 0 N--CA 1.492 1.652 0 O-C-N 121.241 -0.912 . . . . 0.0 110.139 179.937 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.414 0 N-CA-C 109.615 -1.394 . . . . 0.0 109.615 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 22.3 tp -64.36 -23.15 67.19 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.239 -1.154 . . . . 0.0 110.338 -179.904 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 7.5 m -63.25 -62.81 1.45 Allowed 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.218 -0.926 . . . . 0.0 110.231 -179.987 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 31.6 tt0 -54.77 -30.49 56.79 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.352 -0.843 . . . . 0.0 110.223 -179.99 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -72.65 -49.82 29.22 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.205 -0.935 . . . . 0.0 110.222 179.93 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -70.7 -56.58 6.08 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.141 -0.974 . . . . 0.0 110.113 179.944 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . 0.583 ' HG3' HG11 ' C' ' 10' ' ' VAL . 0.0 OUTLIER -54.38 -41.67 69.49 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.147 -0.971 . . . . 0.0 109.646 179.607 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -55.57 -41.03 80.53 Favored Glycine 0 N--CA 1.489 2.205 0 N-CA-C 109.248 -1.541 . . . . 0.0 109.248 179.554 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . 0.559 ' O ' HG23 ' A' ' 22' ' ' VAL . 63.7 t80 -67.08 -43.15 83.35 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.296 -1.12 . . . . 0.0 109.736 179.624 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 1.6 m -54.41 -29.19 48.16 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.198 -0.939 . . . . 0.0 109.88 179.557 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 45.0 t -76.86 -71.68 0.26 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.593 0 O-C-N 121.407 -0.808 . . . . 0.0 110.238 -179.955 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.409 ' HG3' ' N ' ' A' ' 22' ' ' VAL . 10.0 pt-20 -45.31 -43.09 10.43 Favored 'General case' 0 N--CA 1.497 1.903 0 O-C-N 121.447 -0.783 . . . . 0.0 111.094 -179.489 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.559 HG23 ' O ' ' A' ' 18' ' ' TYR . 71.2 t -55.94 -54.07 31.06 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.581 0 O-C-N 121.001 -1.062 . . . . 0.0 109.596 179.706 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.676 ' HB3' HD11 ' C' ' 2' ' ' LEU . 4.0 mt -66.73 -23.79 66.15 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.311 -0.868 . . . . 0.0 109.976 179.713 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . 0.482 ' NH1' HD13 ' C' ' 2' ' ' LEU . 0.0 OUTLIER -81.34 -71.15 0.49 Allowed 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.258 -0.901 . . . . 0.0 109.944 179.899 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -55.18 -35.26 64.63 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.381 -0.824 . . . . 0.0 110.199 179.907 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER 51.25 64.61 7.77 Favored Pre-proline 0 N--CA 1.491 1.612 0 O-C-N 121.173 -0.954 . . . . 0.0 110.272 -179.944 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 46.2 Cg_endo -70.69 159.44 52.7 Favored 'Trans proline' 0 C--N 1.31 -1.452 0 O-C-N 123.76 1.4 . . . . 0.0 110.475 -179.953 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 43.7 Cg_endo -70.63 -23.03 27.29 Favored 'Trans proline' 0 C--N 1.31 -1.461 0 O-C-N 123.713 1.375 . . . . 0.0 110.149 179.876 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . 0.425 ' OD2' ' CB ' ' A' ' 32' ' ' ASP . 32.8 p-10 -142.4 115.26 8.7 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.384 -0.823 . . . . 0.0 109.917 179.697 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.415 ' CD1' ' OH ' ' A' ' 18' ' ' TYR . 10.8 tp -70.61 -34.93 72.66 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.273 -0.892 . . . . 0.0 110.318 -179.691 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 42.4 t -49.83 -59.9 0.92 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.832 0 O-C-N 121.261 -0.899 . . . . 0.0 109.925 179.714 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . 0.425 ' CB ' ' OD2' ' A' ' 29' ' ' ASP . 6.4 t0 -60.1 -46.1 90.72 Favored 'General case' 0 C--N 1.301 -1.503 0 O-C-N 121.619 -0.675 . . . . 0.0 109.972 179.801 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 53.3 t80 -56.56 -48.79 76.57 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.169 -0.957 . . . . 0.0 109.568 179.524 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -55.06 -43.45 73.85 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.329 -0.857 . . . . 0.0 109.659 179.579 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.43 HG13 ' OG1' ' B' ' 39' ' ' THR . 69.2 t -72.34 -23.42 21.34 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.36 0 O-C-N 121.486 -0.759 . . . . 0.0 109.878 179.712 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -81.7 -44.07 17.61 Favored 'General case' 0 C--N 1.303 -1.418 0 O-C-N 121.23 -0.919 . . . . 0.0 109.782 -179.749 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 51.5 t80 -62.71 -61.47 2.39 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.182 -0.949 . . . . 0.0 110.752 -179.63 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 29.7 m-85 -57.51 -52.95 63.32 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.241 -0.912 . . . . 0.0 111.123 -179.321 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . 0.662 ' OG1' HG13 ' B' ' 35' ' ' VAL . 22.8 m -49.73 -41.79 44.55 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 121.065 -1.022 . . . . 0.0 110.195 -179.656 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 34.4 ttt-85 -71.59 -20.87 61.94 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.187 -0.946 . . . . 0.0 109.843 179.473 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -63.49 -43.21 97.91 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.302 -0.874 . . . . 0.0 110.242 179.998 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.498 ' HD2' HG12 ' B' ' 31' ' ' VAL . 0.0 OUTLIER -49.44 -25.71 2.77 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.198 -0.939 . . . . 0.0 110.22 179.771 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . 0.589 ' O ' ' HB3' ' A' ' 44' ' ' ALA . 1.0 OUTLIER -106.29 -58.26 1.94 Allowed 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.433 -0.792 . . . . 0.0 109.777 179.611 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . 0.589 ' HB3' ' O ' ' A' ' 43' ' ' GLU . . . . . . . . 0 N--CA 1.501 2.098 0 O-C-N 121.624 -0.672 . . . . 0.0 110.73 179.835 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_endo . . . . . 0 N--CA 1.484 0.918 0 N-CA-C 110.518 -0.608 . . . . 0.0 110.518 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' B' B ' 9' ' ' PRO . . . . . . . . . . . . . 49.3 Cg_endo -78.61 2.17 8.39 Favored 'Trans proline' 0 C--N 1.313 -1.294 0 O-C-N 123.661 1.348 . . . . 0.0 111.418 -179.943 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . -72.03 -20.2 78.82 Favored Glycine 0 N--CA 1.491 2.3 0 N-CA-C 109.664 -1.374 . . . . 0.0 109.664 179.982 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 11' ' ' LEU . . . . . 0.503 HD11 HG11 ' A' ' 22' ' ' VAL . 0.4 OUTLIER -81.12 -16.92 51.66 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.272 -1.134 . . . . 0.0 110.519 -179.891 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 12' ' ' THR . . . . . 0.525 ' OG1' HD11 ' C' ' 9' ' ' LEU . 78.4 m -73.12 -36.21 66.68 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.074 -1.016 . . . . 0.0 110.374 -179.881 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -75.06 -25.23 58.49 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.277 -0.889 . . . . 0.0 110.156 179.999 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -74.02 -47.56 36.14 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.277 -0.89 . . . . 0.0 110.166 179.922 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 84.5 mt -64.08 -49.78 70.94 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.224 -0.922 . . . . 0.0 110.021 179.882 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 16' ' ' GLN . . . . . 0.477 ' O ' HG23 ' B' ' 20' ' ' VAL . 0.0 OUTLIER -56.04 -42.35 76.43 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.264 -0.898 . . . . 0.0 109.871 179.764 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 17' ' ' GLY . . . . . 0.406 ' O ' ' CG ' ' B' ' 21' ' ' GLU . . . -57.92 -46.47 92.42 Favored Glycine 0 N--CA 1.49 2.257 0 N-CA-C 109.271 -1.532 . . . . 0.0 109.271 179.774 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 18' ' ' TYR . . . . . 0.492 ' OH ' ' HB2' ' B' ' 34' ' ' ALA . 39.4 t80 -63.38 -30.64 71.74 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.313 -1.11 . . . . 0.0 109.957 179.726 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 62.4 m -74.85 -27.69 60.37 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.343 -0.848 . . . . 0.0 110.237 179.993 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 20' ' ' VAL . . . . . 0.477 HG23 ' O ' ' B' ' 16' ' ' GLN . 87.1 t -78.1 -19.56 13.63 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.616 0 O-C-N 121.166 -0.958 . . . . 0.0 110.28 179.941 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 21' ' ' GLU . . . . . 0.456 ' HG3' ' HA ' ' B' ' 18' ' ' TYR . 0.6 OUTLIER -86.38 -45.79 10.86 Favored 'General case' 0 N--CA 1.499 1.991 0 O-C-N 121.138 -0.976 . . . . 0.0 108.895 179.605 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 22' ' ' VAL . . . . . 0.422 HG23 ' O ' ' B' ' 18' ' ' TYR . 78.2 t -63.31 -25.67 39.0 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.541 0 CA-C-O 121.308 0.575 . . . . 0.0 110.056 179.978 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 23' ' ' LEU . . . . . 0.44 HD23 ' HA ' ' B' ' 23' ' ' LEU . 4.4 mt -84.22 -31.6 24.95 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.26 -0.9 . . . . 0.0 110.09 179.777 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -87.6 -40.27 14.36 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.26 -0.9 . . . . 0.0 110.442 -179.847 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 1.8 tt0 -88.44 -40.85 13.17 Favored 'General case' 0 C--N 1.306 -1.303 0 O-C-N 121.28 -0.887 . . . . 0.0 110.298 -179.711 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 52.8 67.36 3.94 Favored Pre-proline 0 N--CA 1.492 1.628 0 O-C-N 121.318 -0.864 . . . . 0.0 110.211 179.945 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 27' ' ' PRO . . . . . . . . . . . . . 45.1 Cg_endo -70.94 167.45 25.95 Favored 'Trans proline' 0 C--N 1.312 -1.383 0 O-C-N 123.571 1.301 . . . . 0.0 110.558 -179.955 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 44.3 Cg_endo -71.26 -41.89 2.28 Favored 'Trans proline' 0 C--N 1.312 -1.359 0 O-C-N 123.734 1.386 . . . . 0.0 110.38 179.826 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 10.9 m-20 -123.22 120.88 34.45 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.222 -0.924 . . . . 0.0 110.164 179.935 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 2.7 tp -78.65 -31.55 46.86 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.289 -0.882 . . . . 0.0 109.898 179.747 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 31' ' ' VAL . . . . . 0.498 HG12 ' HD2' ' A' ' 42' ' ' ARG . 46.8 t -52.63 -67.38 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.678 0 O-C-N 121.278 -0.889 . . . . 0.0 109.967 179.787 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 1.6 t0 -55.5 -41.53 73.18 Favored 'General case' 0 C--N 1.303 -1.456 0 O-C-N 121.39 -0.819 . . . . 0.0 109.764 179.709 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 33' ' ' PHE . . . . . . . . . . . . . 59.4 t80 -58.2 -47.72 82.57 Favored 'General case' 0 N--CA 1.488 1.446 0 O-C-N 121.169 -0.957 . . . . 0.0 109.369 179.32 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 34' ' ' ALA . . . . . 0.492 ' HB2' ' OH ' ' B' ' 18' ' ' TYR . . . -58.54 -36.92 74.63 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.346 -0.846 . . . . 0.0 109.512 179.313 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 35' ' ' VAL . . . . . 0.662 HG13 ' OG1' ' A' ' 39' ' ' THR . 89.1 t -75.2 -51.43 21.38 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.32 0 O-C-N 121.471 -0.768 . . . . 0.0 109.994 179.704 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 36' ' ' GLU . . . . . 0.409 ' O ' ' HB2' ' B' ' 40' ' ' ARG . 3.0 mm-40 -58.96 -35.79 73.74 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.268 -0.895 . . . . 0.0 110.116 179.995 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 37' ' ' TYR . . . . . 0.447 ' CE1' ' OE2' ' B' ' 21' ' ' GLU . 43.2 t80 -62.29 -73.64 0.1 Allowed 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.295 -0.878 . . . . 0.0 110.107 179.957 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 20.9 m-85 -51.88 -45.36 64.09 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.242 -0.911 . . . . 0.0 110.521 -179.888 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 39' ' ' THR . . . . . 0.43 ' OG1' HG13 ' A' ' 35' ' ' VAL . 45.2 m -53.16 -28.53 26.67 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.174 -0.954 . . . . 0.0 110.032 179.835 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 40' ' ' ARG . . . . . 0.409 ' HB2' ' O ' ' B' ' 36' ' ' GLU . 0.0 OUTLIER -82.57 -30.61 29.52 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.292 -0.88 . . . . 0.0 109.953 179.686 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.69 -36.14 75.88 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.311 -0.868 . . . . 0.0 110.123 179.922 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 42' ' ' ARG . . . . . 0.415 ' NH1' ' OD2' ' A' ' 32' ' ' ASP . 0.0 OUTLIER -52.11 -38.0 55.94 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.221 -0.924 . . . . 0.0 110.194 179.934 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 43' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 . . . . . 0 N--CA 1.49 1.561 0 O-C-N 121.272 -0.893 . . . . 0.0 110.276 179.896 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' C' C ' 2' ' ' LEU . . . . . 0.676 HD11 ' HB3' ' A' ' 23' ' ' LEU . 0.1 OUTLIER . . . . . 0 N--CA 1.491 1.605 0 CA-C-O 121.26 0.553 . . . . 0.0 110.392 . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 3' ' ' ILE . . . . . . . . . . . . . 10.5 mt -63.44 -28.86 45.86 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.651 0 O-C-N 121.294 -0.879 . . . . 0.0 110.316 -179.918 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 4' ' ' GLU . . . . . . . . . . . . . 26.2 mt-10 -94.92 -20.23 19.58 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.175 -0.953 . . . . 0.0 110.352 -179.921 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 5' ' ' THR . . . . . . . . . . . . . 9.2 m -98.56 -19.67 17.47 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.29 -0.881 . . . . 0.0 110.448 -179.83 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 6' ' ' ALA . . . . . 0.449 ' O ' HG23 ' C' ' 10' ' ' VAL . . . -77.27 -58.95 2.99 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.088 -1.007 . . . . 0.0 110.445 -179.826 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 7' ' ' SER . . . . . . . . . . . . . 2.9 t -62.19 -36.24 81.29 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.179 -0.951 . . . . 0.0 110.537 -179.718 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 8' ' ' SER . . . . . . . . . . . . . 4.2 t -65.17 -42.35 93.75 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.134 -0.978 . . . . 0.0 110.341 -179.863 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' C' C ' 9' ' ' LEU . . . . . 0.525 HD11 ' OG1' ' B' ' 12' ' ' THR . 3.3 tt -70.03 -48.56 57.46 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.205 -0.934 . . . . 0.0 110.236 179.991 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 10' ' ' VAL . . . . . 0.583 HG11 ' HG3' ' A' ' 16' ' ' GLN . 87.7 t -58.77 -56.34 17.31 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.669 0 O-C-N 121.221 -0.925 . . . . 0.0 110.317 -179.923 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 11' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -52.2 -40.02 60.98 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.28 -0.887 . . . . 0.0 110.474 -179.795 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' C' C ' 12' ' ' ASN . . . . . . . . . . . . . 28.7 t30 . . . . . 0 N--CA 1.492 1.63 0 O-C-N 121.174 -0.954 . . . . 0.0 110.381 -179.895 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.333 0 N-CA-C 109.65 -1.38 . . . . 0.0 109.65 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 49.0 tp -58.52 -27.2 64.3 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.294 -1.121 . . . . 0.0 110.538 -179.889 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . 0.709 HG23 HG23 ' C' ' 10' ' ' VAL . 86.6 m -68.37 -30.78 69.8 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.218 -0.926 . . . . 0.0 110.74 -179.658 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -76.8 -39.74 50.42 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.119 -0.988 . . . . 0.0 110.507 -179.66 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.719 HD21 ' CE1' ' A' ' 38' ' ' PHE . 7.7 tt -71.46 -36.76 71.31 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.13 -0.981 . . . . 0.0 110.511 -179.741 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.434 HD12 ' HA ' ' A' ' 15' ' ' LEU . 2.0 tp -65.55 -57.43 8.22 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.182 -0.949 . . . . 0.0 110.587 -179.708 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . 0.501 ' O ' HG23 ' A' ' 20' ' ' VAL . 0.9 OUTLIER -50.58 -34.88 27.48 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.129 -0.982 . . . . 0.0 110.242 -179.901 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -62.89 -50.13 66.42 Favored Glycine 0 N--CA 1.49 2.236 0 N-CA-C 109.245 -1.542 . . . . 0.0 109.245 179.651 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . 0.451 ' HA ' ' HG3' ' A' ' 21' ' ' GLU . 30.6 t80 -56.12 -41.46 75.33 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.244 -1.15 . . . . 0.0 110.119 179.807 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 57.6 m -61.52 -37.67 84.57 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.321 -0.862 . . . . 0.0 110.59 -179.803 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.501 HG23 ' O ' ' A' ' 16' ' ' GLN . 98.5 t -69.12 -22.09 25.82 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.72 0 O-C-N 121.264 -0.897 . . . . 0.0 110.437 -179.705 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.451 ' HG3' ' HA ' ' A' ' 18' ' ' TYR . 1.2 mt-10 -88.18 -48.48 7.67 Favored 'General case' 0 N--CA 1.499 2.016 0 O-C-N 121.209 -0.932 . . . . 0.0 108.818 179.666 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.447 HG23 ' O ' ' A' ' 18' ' ' TYR . 64.7 t -48.98 -31.63 4.2 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.473 0 O-C-N 121.75 -0.594 . . . . 0.0 110.339 179.936 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 1.036 HD22 HD13 ' C' ' 2' ' ' LEU . 0.1 OUTLIER -85.76 -40.15 16.38 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.268 -0.895 . . . . 0.0 110.158 -179.956 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -74.81 -52.66 10.83 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.169 -0.957 . . . . 0.0 110.289 179.933 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . 0.434 ' O ' ' CG ' ' A' ' 26' ' ' GLN . 3.8 mp0 -73.89 -19.4 60.72 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.225 -0.922 . . . . 0.0 110.603 -179.914 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . 0.434 ' CG ' ' O ' ' A' ' 25' ' ' GLN . 21.5 pt20 36.64 61.38 3.31 Favored Pre-proline 0 N--CA 1.506 2.343 0 O-C-N 121.937 -0.477 . . . . 0.0 111.912 -179.936 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . 0.504 ' HG3' ' CD2' ' A' ' 33' ' ' PHE . 44.1 Cg_endo -71.08 154.69 62.32 Favored 'Trans proline' 0 C--N 1.311 -1.4 0 O-C-N 123.564 1.297 . . . . 0.0 110.537 -179.957 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 46.2 Cg_endo -72.77 -42.69 1.05 Allowed 'Trans proline' 0 C--N 1.312 -1.387 0 O-C-N 123.734 1.386 . . . . 0.0 110.37 179.876 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 14.2 m-20 -113.85 122.89 48.4 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.31 -0.868 . . . . 0.0 110.14 179.887 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.7 HD21 HD12 ' B' ' 11' ' ' LEU . 0.2 OUTLIER -75.48 -47.11 28.57 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.169 -0.957 . . . . 0.0 110.195 179.971 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 39.9 t -50.28 -60.98 0.69 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.786 0 O-C-N 121.177 -0.952 . . . . 0.0 109.797 179.702 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 5.1 t0 -58.86 -39.51 81.56 Favored 'General case' 0 C--N 1.302 -1.49 0 O-C-N 121.653 -0.655 . . . . 0.0 109.808 179.526 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . 0.504 ' CD2' ' HG3' ' A' ' 27' ' ' PRO . 36.9 t80 -62.54 -46.58 87.74 Favored 'General case' 0 N--CA 1.488 1.436 0 O-C-N 121.163 -0.961 . . . . 0.0 109.526 179.44 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -56.13 -40.94 74.56 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.388 -0.82 . . . . 0.0 110.123 179.79 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.407 HG13 ' OG1' ' B' ' 39' ' ' THR . 97.9 t -64.74 -43.95 96.51 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.337 0 O-C-N 121.151 -0.968 . . . . 0.0 110.146 -179.979 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -63.04 -35.0 78.77 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.28 -0.887 . . . . 0.0 110.103 179.859 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . 0.419 ' CE1' ' OE2' ' A' ' 21' ' ' GLU . 20.4 t80 -69.08 -60.42 2.37 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.233 -0.917 . . . . 0.0 110.367 -179.841 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . 0.719 ' CE1' HD21 ' A' ' 14' ' ' LEU . 28.5 m-85 -61.68 -49.2 77.43 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.282 -0.886 . . . . 0.0 110.322 -179.791 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . 0.493 ' OG1' HG13 ' B' ' 35' ' ' VAL . 55.7 m -51.79 -41.39 61.65 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.195 -0.941 . . . . 0.0 110.22 179.965 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 2.9 mtp180 -72.61 -30.22 64.17 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.235 -0.916 . . . . 0.0 109.963 179.766 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.443 ' O ' HD23 ' A' ' 41' ' ' LEU . 1.4 tt -56.73 -40.89 76.51 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.353 -0.842 . . . . 0.0 110.085 179.914 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -51.54 -29.02 15.4 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.227 -0.92 . . . . 0.0 110.438 179.999 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 -106.86 -2.93 20.86 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.232 -0.917 . . . . 0.0 110.88 -179.931 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 1.684 0 O-C-N 120.947 -1.095 . . . . 0.0 110.28 179.928 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 46.0 Cg_endo . . . . . 0 N--CA 1.484 0.925 0 N-CA-C 110.417 -0.647 . . . . 0.0 110.417 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' B' B ' 9' ' ' PRO . . . . . . . . . . . . . 48.2 Cg_endo -72.81 -174.88 1.65 Allowed 'Trans proline' 0 C--N 1.312 -1.345 0 O-C-N 123.559 1.294 . . . . 0.0 110.273 179.931 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 102.59 -38.28 3.28 Favored Glycine 0 N--CA 1.491 2.328 0 N-CA-C 109.296 -1.522 . . . . 0.0 109.296 -179.985 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 11' ' ' LEU . . . . . 0.7 HD12 HD21 ' A' ' 30' ' ' LEU . 0.7 OUTLIER -59.03 -36.49 75.08 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.327 -1.102 . . . . 0.0 110.09 179.962 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 22.1 m -51.93 -63.04 1.27 Allowed 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.234 -0.916 . . . . 0.0 110.302 179.895 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -57.6 -23.34 50.37 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.324 -0.86 . . . . 0.0 110.19 179.943 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 14' ' ' LEU . . . . . 0.561 HD23 ' HE1' ' B' ' 38' ' ' PHE . 0.0 OUTLIER -78.97 -33.74 44.86 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.234 -0.916 . . . . 0.0 110.087 179.965 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . 0.611 HD13 ' HG ' ' B' ' 11' ' ' LEU . 4.9 mp -80.27 -47.13 15.05 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.237 -0.914 . . . . 0.0 110.122 179.963 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 16' ' ' GLN . . . . . 0.761 ' O ' HG23 ' B' ' 20' ' ' VAL . 0.0 OUTLIER -53.73 -45.87 70.66 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.268 -0.895 . . . . 0.0 109.818 179.648 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 17' ' ' GLY . . . . . 0.412 ' O ' ' CG ' ' B' ' 21' ' ' GLU . . . -60.93 -50.96 61.78 Favored Glycine 0 N--CA 1.49 2.247 0 N-CA-C 109.293 -1.523 . . . . 0.0 109.293 179.632 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 18' ' ' TYR . . . . . 0.699 ' O ' HG23 ' B' ' 22' ' ' VAL . 25.8 t80 -53.72 -31.95 50.19 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.322 -1.104 . . . . 0.0 110.103 179.809 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 88.8 m -75.83 -29.31 58.58 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.37 -0.831 . . . . 0.0 110.13 179.949 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 20' ' ' VAL . . . . . 0.761 HG23 ' O ' ' B' ' 16' ' ' GLN . 39.9 t -78.5 -19.58 13.3 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.664 0 O-C-N 121.327 -0.858 . . . . 0.0 110.252 -179.982 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 21' ' ' GLU . . . . . 0.448 ' OE1' ' CE1' ' B' ' 37' ' ' TYR . 1.3 mt-10 -87.07 -42.62 12.93 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.243 -0.911 . . . . 0.0 108.868 179.851 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 22' ' ' VAL . . . . . 0.699 HG23 ' O ' ' B' ' 18' ' ' TYR . 51.9 t -64.52 -29.37 47.16 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.508 0 O-C-N 121.743 -0.598 . . . . 0.0 110.13 -179.918 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 1.4 mt -75.78 -48.13 22.96 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.315 -0.866 . . . . 0.0 110.064 179.798 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 7.1 mpt_? -69.3 -70.68 0.26 Allowed 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.249 -0.907 . . . . 0.0 110.113 179.898 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -51.83 -41.02 61.47 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.237 -0.914 . . . . 0.0 110.408 179.94 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER 52.15 66.21 5.34 Favored Pre-proline 0 N--CA 1.491 1.601 0 O-C-N 121.408 -0.808 . . . . 0.0 110.381 179.945 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 27' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_endo -71.35 159.99 50.05 Favored 'Trans proline' 0 C--N 1.311 -1.44 0 O-C-N 123.638 1.336 . . . . 0.0 110.531 179.873 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 44.7 Cg_endo -71.49 -35.23 8.39 Favored 'Trans proline' 0 C--N 1.311 -1.445 0 O-C-N 123.742 1.39 . . . . 0.0 110.27 179.771 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 29' ' ' ASP . . . . . 0.418 ' OD1' ' N ' ' B' ' 29' ' ' ASP . 38.2 p-10 -132.5 114.53 14.39 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.357 -0.839 . . . . 0.0 110.256 179.722 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 4.2 tp -67.91 -31.34 71.05 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.325 -0.86 . . . . 0.0 110.444 -179.829 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 31' ' ' VAL . . . . . 0.431 ' H ' HG23 ' B' ' 31' ' ' VAL . 44.6 t -49.77 -56.51 3.21 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.751 0 O-C-N 121.174 -0.954 . . . . 0.0 110.088 179.718 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 32' ' ' ASP . . . . . 0.403 ' HB2' ' OD2' ' B' ' 29' ' ' ASP . 0.9 OUTLIER -64.0 -45.63 88.12 Favored 'General case' 0 C--N 1.302 -1.482 0 O-C-N 121.577 -0.702 . . . . 0.0 110.102 179.919 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 33' ' ' PHE . . . . . . . . . . . . . 74.8 t80 -57.56 -40.07 78.1 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.045 -1.034 . . . . 0.0 109.628 179.519 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 34' ' ' ALA . . . . . 0.514 ' HB2' ' OH ' ' B' ' 18' ' ' TYR . . . -60.99 -43.67 98.51 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.338 -0.851 . . . . 0.0 109.992 179.668 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 35' ' ' VAL . . . . . 0.493 HG13 ' OG1' ' A' ' 39' ' ' THR . 58.9 t -70.53 -40.79 77.75 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.289 0 O-C-N 121.251 -0.906 . . . . 0.0 110.072 179.77 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -74.03 -21.58 59.9 Favored 'General case' 0 N--CA 1.487 1.404 0 O-C-N 121.293 -0.879 . . . . 0.0 109.712 179.961 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 37' ' ' TYR . . . . . 0.448 ' CE1' ' OE1' ' B' ' 21' ' ' GLU . 28.3 t80 -79.58 -64.46 1.18 Allowed 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.119 -0.988 . . . . 0.0 110.515 -179.864 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 38' ' ' PHE . . . . . 0.561 ' HE1' HD23 ' B' ' 14' ' ' LEU . 22.8 m-85 -60.04 -46.88 88.06 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.265 -0.897 . . . . 0.0 110.656 -179.613 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 39' ' ' THR . . . . . 0.407 ' OG1' HG13 ' A' ' 35' ' ' VAL . 72.9 m -53.68 -54.89 31.47 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.096 -1.002 . . . . 0.0 110.152 179.952 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 41.8 ttt180 -62.7 -22.62 66.63 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.225 -0.922 . . . . 0.0 110.019 179.688 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -59.67 -51.01 71.63 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.317 -0.864 . . . . 0.0 110.063 179.943 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -50.41 -24.93 3.39 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.22 -0.925 . . . . 0.0 110.545 179.969 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 43' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.624 0 O-C-N 121.248 -0.907 . . . . 0.0 110.872 -179.669 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 2' ' ' LEU . . . . . 1.036 HD13 HD22 ' A' ' 23' ' ' LEU . 67.7 tp . . . . . 0 N--CA 1.492 1.637 0 CA-C-O 121.238 0.542 . . . . 0.0 110.162 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 3' ' ' ILE . . . . . . . . . . . . . 47.2 mm -75.71 -36.73 34.42 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.576 0 O-C-N 121.213 -0.929 . . . . 0.0 110.19 -179.969 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 4' ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 -74.98 -3.91 35.12 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.34 -0.85 . . . . 0.0 110.747 -179.971 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 5' ' ' THR . . . . . . . . . . . . . 2.3 p -105.72 -66.58 0.98 Allowed 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.051 -1.03 . . . . 0.0 110.209 -179.915 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 6' ' ' ALA . . . . . . . . . . . . . . . -54.26 -43.78 71.27 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.318 -0.864 . . . . 0.0 110.205 -179.928 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 7' ' ' SER . . . . . 0.53 ' O ' HG12 ' C' ' 10' ' ' VAL . 8.5 t -57.64 -25.31 59.98 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.202 -0.936 . . . . 0.0 110.106 179.951 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 8' ' ' SER . . . . . . . . . . . . . 47.4 t -83.27 -24.5 32.23 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.268 -0.895 . . . . 0.0 110.051 179.84 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 9' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -75.97 -34.61 59.79 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.352 -0.843 . . . . 0.0 110.098 179.993 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 10' ' ' VAL . . . . . 0.709 HG23 HG23 ' A' ' 12' ' ' THR . 6.4 p -67.7 -24.21 30.63 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.56 0 O-C-N 121.311 -0.868 . . . . 0.0 110.072 179.916 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' C' C ' 11' ' ' LYS . . . . . . . . . . . . . 1.2 ttmt -76.17 -47.01 25.79 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.264 -0.898 . . . . 0.0 110.039 179.776 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' C' C ' 12' ' ' ASN . . . . . . . . . . . . . 96.2 m-20 . . . . . 0 N--CA 1.492 1.632 0 O-C-N 121.286 -0.884 . . . . 0.0 110.407 179.68 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.269 0 N-CA-C 109.34 -1.504 . . . . 0.0 109.34 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.51 ' O ' HD23 ' A' ' 15' ' ' LEU . 7.1 tt -66.23 -26.6 67.45 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.219 -1.165 . . . . 0.0 110.095 179.924 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 63.4 m -74.24 -28.98 61.49 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.293 -0.879 . . . . 0.0 110.055 179.868 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -71.51 -41.32 69.38 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.358 -0.839 . . . . 0.0 110.008 179.864 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 28.1 tp -72.72 -41.76 64.86 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.31 -0.869 . . . . 0.0 110.071 179.902 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.533 HD12 HD21 ' B' ' 15' ' ' LEU . 2.8 mm? -58.03 -50.02 74.85 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.2 -0.937 . . . . 0.0 110.116 179.902 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . 0.496 ' O ' HG23 ' A' ' 20' ' ' VAL . 3.3 mt-30 -55.04 -43.3 73.64 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.207 -0.933 . . . . 0.0 109.698 179.731 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -53.24 -36.69 53.24 Favored Glycine 0 N--CA 1.493 2.486 0 N-CA-C 109.185 -1.566 . . . . 0.0 109.185 179.486 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . 0.627 ' O ' HG23 ' A' ' 22' ' ' VAL . 28.2 t80 -69.91 -54.63 12.54 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.441 -1.034 . . . . 0.0 109.363 179.307 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . 0.765 ' O ' HD12 ' A' ' 23' ' ' LEU . 47.8 m -52.47 -27.65 17.06 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.373 -0.829 . . . . 0.0 109.982 179.373 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.496 HG23 ' O ' ' A' ' 16' ' ' GLN . 43.9 t -71.54 -74.9 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.61 0 O-C-N 121.419 -0.801 . . . . 0.0 109.83 179.812 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.433 ' O ' ' CG ' ' A' ' 25' ' ' GLN . 21.8 pt-20 -48.54 -42.93 34.83 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.378 -0.826 . . . . 0.0 110.77 -179.665 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.673 HG11 HD11 ' A' ' 30' ' ' LEU . 97.1 t -55.2 -39.0 49.24 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.649 0 O-C-N 121.145 -0.972 . . . . 0.0 110.38 -179.815 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.765 HD12 ' O ' ' A' ' 19' ' ' THR . 30.7 mt -88.65 -22.71 23.3 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.211 -0.931 . . . . 0.0 110.295 -179.88 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -81.24 -37.63 28.25 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.189 -0.945 . . . . 0.0 110.264 179.994 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . 0.508 ' NE2' ' CE1' ' A' ' 33' ' ' PHE . 0.0 OUTLIER -105.72 -20.19 13.53 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.18 -0.95 . . . . 0.0 110.34 179.84 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . 0.419 ' N ' ' HG3' ' A' ' 25' ' ' GLN . 0.9 OUTLIER 47.82 83.23 0.22 Allowed Pre-proline 0 N--CA 1.494 1.735 0 O-C-N 121.197 -0.939 . . . . 0.0 110.655 -179.983 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 46.1 Cg_endo -72.91 160.83 45.13 Favored 'Trans proline' 0 C--N 1.311 -1.416 0 O-C-N 123.749 1.394 . . . . 0.0 110.446 179.957 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 43.0 Cg_endo -69.52 -25.39 29.77 Favored 'Trans proline' 0 C--N 1.312 -1.367 0 O-C-N 123.653 1.344 . . . . 0.0 110.256 179.936 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 33.3 m-20 -148.9 114.03 5.49 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.418 -0.801 . . . . 0.0 109.935 179.851 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.673 HD11 HG11 ' A' ' 22' ' ' VAL . 0.1 OUTLIER -57.38 -52.2 66.31 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.33 -0.856 . . . . 0.0 110.11 -179.866 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.413 ' O ' HG23 ' A' ' 35' ' ' VAL . 60.8 t -49.01 -62.14 0.49 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.699 0 O-C-N 121.291 -0.881 . . . . 0.0 110.15 179.742 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -55.91 -36.49 67.74 Favored 'General case' 0 C--N 1.3 -1.565 0 O-C-N 121.548 -0.72 . . . . 0.0 109.658 179.491 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . 0.508 ' CE1' ' NE2' ' A' ' 25' ' ' GLN . 55.5 t80 -66.1 -50.53 63.73 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.269 -0.895 . . . . 0.0 109.537 179.393 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . 0.532 ' HB2' ' OH ' ' A' ' 18' ' ' TYR . . . -56.27 -38.51 71.29 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.397 -0.814 . . . . 0.0 109.798 179.535 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.543 HG13 ' OG1' ' B' ' 39' ' ' THR . 91.2 t -73.03 -34.57 46.05 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.339 0 O-C-N 121.373 -0.829 . . . . 0.0 109.993 179.782 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -80.43 -31.69 37.48 Favored 'General case' 0 C--N 1.303 -1.447 0 O-C-N 121.308 -0.87 . . . . 0.0 109.675 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 78.3 t80 -75.01 -65.3 0.89 Allowed 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.129 -0.982 . . . . 0.0 110.386 -179.859 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 12.9 m-85 -52.9 -49.56 65.69 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.228 -0.92 . . . . 0.0 110.626 -179.523 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . 0.546 ' OG1' HG13 ' B' ' 35' ' ' VAL . 35.9 m -52.88 -37.71 60.81 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 120.989 -1.07 . . . . 0.0 110.037 179.944 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -72.35 -27.25 62.28 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.171 -0.955 . . . . 0.0 110.056 179.646 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 1.1 tt -65.35 -34.0 77.3 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.277 -0.89 . . . . 0.0 110.04 179.892 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.16 -24.15 62.8 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.299 -0.875 . . . . 0.0 109.894 179.72 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -76.7 -56.78 4.3 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.317 -0.864 . . . . 0.0 110.118 179.939 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.599 0 O-C-N 121.326 -0.859 . . . . 0.0 110.172 179.813 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 49.0 Cg_endo . . . . . 0 N--CA 1.485 1.013 0 N-CA-C 110.317 -0.686 . . . . 0.0 110.317 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' B' B ' 9' ' ' PRO . . . . . . . . . . . . . 49.5 Cg_endo -74.43 153.97 45.11 Favored 'Trans proline' 0 C--N 1.311 -1.397 0 O-C-N 123.497 1.261 . . . . 0.0 110.477 -179.968 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 111.58 -25.05 14.04 Favored Glycine 0 N--CA 1.49 2.292 0 N-CA-C 109.553 -1.419 . . . . 0.0 109.553 179.889 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -69.05 -22.91 64.0 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.224 -1.162 . . . . 0.0 110.214 -179.986 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 91.6 m -78.96 -35.11 43.65 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.159 -0.963 . . . . 0.0 110.281 -179.956 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 28.1 mt-10 -65.88 -44.25 85.88 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.191 -0.943 . . . . 0.0 110.389 -179.928 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -67.89 -32.87 73.65 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.239 -0.913 . . . . 0.0 110.545 -179.803 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . 0.533 HD21 HD12 ' A' ' 15' ' ' LEU . 2.5 mp -77.76 -42.32 34.51 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.192 -0.943 . . . . 0.0 110.559 -179.733 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 16' ' ' GLN . . . . . 0.735 ' O ' HG23 ' B' ' 20' ' ' VAL . 0.9 OUTLIER -53.16 -44.03 67.5 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.035 -1.041 . . . . 0.0 110.011 179.93 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 17' ' ' GLY . . . . . . . . . . . . . . . -62.26 -51.42 56.72 Favored Glycine 0 N--CA 1.489 2.2 0 N-CA-C 109.346 -1.502 . . . . 0.0 109.346 179.902 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 18' ' ' TYR . . . . . 0.564 ' O ' HG23 ' B' ' 22' ' ' VAL . 16.3 t80 -56.12 -33.78 65.46 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.341 -1.093 . . . . 0.0 110.279 179.895 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 62.6 m -71.55 -31.76 67.36 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.26 -0.9 . . . . 0.0 110.354 -179.887 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 20' ' ' VAL . . . . . 0.735 HG23 ' O ' ' B' ' 16' ' ' GLN . 48.6 t -75.14 -17.47 16.07 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.645 0 O-C-N 121.271 -0.893 . . . . 0.0 110.487 -179.885 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 21' ' ' GLU . . . . . 0.449 ' HG3' ' HA ' ' B' ' 18' ' ' TYR . 0.8 OUTLIER -89.15 -50.31 6.23 Favored 'General case' 0 N--CA 1.497 1.92 0 O-C-N 121.137 -0.977 . . . . 0.0 109.281 179.906 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 22' ' ' VAL . . . . . 0.564 HG23 ' O ' ' B' ' 18' ' ' TYR . 23.8 t -60.79 -24.59 32.81 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.515 0 O-C-N 121.776 -0.577 . . . . 0.0 110.323 -179.637 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 23' ' ' LEU . . . . . 0.476 HD23 ' HA ' ' B' ' 23' ' ' LEU . 6.8 mt -90.15 -31.65 16.99 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.214 -0.929 . . . . 0.0 110.492 -179.835 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -87.4 -51.71 5.79 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.189 -0.944 . . . . 0.0 110.591 -179.643 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 25' ' ' GLN . . . . . 0.425 ' O ' ' HG3' ' B' ' 26' ' ' GLN . 14.0 tp60 -85.15 -19.77 31.26 Favored 'General case' 0 N--CA 1.486 1.335 0 O-C-N 121.146 -0.971 . . . . 0.0 110.477 -179.557 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 26' ' ' GLN . . . . . 0.425 ' HG3' ' O ' ' B' ' 25' ' ' GLN . 9.0 pt20 36.26 74.82 0.55 Allowed Pre-proline 0 N--CA 1.507 2.376 0 O-C-N 121.81 -0.556 . . . . 0.0 111.893 -179.92 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 27' ' ' PRO . . . . . . . . . . . . . 44.4 Cg_endo -70.04 166.94 26.26 Favored 'Trans proline' 0 C--N 1.311 -1.429 0 O-C-N 123.532 1.28 . . . . 0.0 110.565 179.887 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 45.4 Cg_endo -71.79 -52.96 0.18 Allowed 'Trans proline' 0 C--N 1.313 -1.317 0 O-C-N 123.611 1.322 . . . . 0.0 110.551 -179.969 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -114.66 122.26 45.92 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.225 -0.922 . . . . 0.0 110.195 -179.899 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 3.8 tp -74.59 -39.44 62.2 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.194 -0.941 . . . . 0.0 110.264 179.957 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 86.2 t -49.73 -66.81 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.711 0 O-C-N 121.169 -0.957 . . . . 0.0 110.097 179.726 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 1.5 t0 -56.28 -38.44 71.19 Favored 'General case' 0 C--N 1.301 -1.536 0 O-C-N 121.626 -0.671 . . . . 0.0 110.101 179.744 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 33' ' ' PHE . . . . . . . . . . . . . 69.5 t80 -62.95 -44.38 96.22 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.215 -0.928 . . . . 0.0 109.845 179.747 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 34' ' ' ALA . . . . . 0.477 ' HB2' ' OH ' ' B' ' 18' ' ' TYR . . . -56.44 -31.93 64.42 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.206 -0.934 . . . . 0.0 109.78 179.65 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 35' ' ' VAL . . . . . 0.546 HG13 ' OG1' ' A' ' 39' ' ' THR . 89.9 t -73.91 -53.57 17.27 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.37 0 O-C-N 121.303 -0.873 . . . . 0.0 110.097 179.8 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -59.55 -24.75 63.97 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.342 -0.849 . . . . 0.0 110.491 -179.779 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 37' ' ' TYR . . . . . 0.432 ' CD2' ' CD1' ' B' ' 18' ' ' TYR . 14.2 t80 -78.66 -69.03 0.59 Allowed 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.191 -0.943 . . . . 0.0 110.54 -179.751 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 38' ' ' PHE . . . . . 0.411 ' HB2' HG22 ' A' ' 35' ' ' VAL . 26.0 m-85 -53.53 -39.24 64.53 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.2 -0.937 . . . . 0.0 110.165 -179.832 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 39' ' ' THR . . . . . 0.543 ' OG1' HG13 ' A' ' 35' ' ' VAL . 55.2 m -57.71 -49.91 74.97 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.145 -0.972 . . . . 0.0 109.901 179.835 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.0 -24.1 65.08 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.222 -0.924 . . . . 0.0 109.936 179.873 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -69.52 -31.48 69.74 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.352 -0.843 . . . . 0.0 110.128 179.807 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -74.26 -40.73 62.16 Favored 'General case' 0 C--N 1.305 -1.352 0 O-C-N 121.329 -0.857 . . . . 0.0 109.688 179.916 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 43' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 . . . . . 0 N--CA 1.492 1.627 0 O-C-N 121.329 -0.857 . . . . 0.0 110.36 179.838 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' C' C ' 2' ' ' LEU . . . . . 0.427 HD21 HD13 ' A' ' 23' ' ' LEU . 0.5 OUTLIER . . . . . 0 N--CA 1.492 1.654 0 CA-C-O 121.256 0.551 . . . . 0.0 110.159 . . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 3' ' ' ILE . . . . . . . . . . . . . 1.5 tt -70.09 -18.07 21.44 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.66 0 O-C-N 121.319 -0.863 . . . . 0.0 110.462 -179.878 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 4' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -78.95 -44.13 23.12 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.112 -0.993 . . . . 0.0 110.32 -179.861 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 5' ' ' THR . . . . . 0.509 HG23 ' N ' ' C' ' 6' ' ' ALA . 13.5 t -83.17 -41.83 18.01 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.269 -0.894 . . . . 0.0 110.211 -179.754 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 6' ' ' ALA . . . . . 0.509 ' N ' HG23 ' C' ' 5' ' ' THR . . . -54.58 -45.63 73.61 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.441 -0.787 . . . . 0.0 110.295 -179.998 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' C' C ' 7' ' ' SER . . . . . . . . . . . . . 61.4 p -75.69 -28.42 58.64 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.211 -0.931 . . . . 0.0 110.337 -179.944 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 8' ' ' SER . . . . . . . . . . . . . 12.6 t -79.5 -33.31 42.24 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.309 -0.869 . . . . 0.0 110.363 -179.953 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 9' ' ' LEU . . . . . . . . . . . . . 7.1 tt -66.52 -53.0 39.78 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.191 -0.943 . . . . 0.0 110.361 -179.83 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 10' ' ' VAL . . . . . . . . . . . . . 25.8 m -58.62 -26.15 30.48 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.693 0 O-C-N 121.282 -0.887 . . . . 0.0 110.291 -179.795 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 11' ' ' LYS . . . . . . . . . . . . . 1.2 ttmm -68.94 -52.39 29.72 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.328 -0.857 . . . . 0.0 110.311 -179.806 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' C' C ' 12' ' ' ASN . . . . . . . . . . . . . 13.8 t30 . . . . . 0 N--CA 1.491 1.622 0 O-C-N 121.195 -0.941 . . . . 0.0 110.513 -179.979 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.325 0 N-CA-C 109.63 -1.388 . . . . 0.0 109.63 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.466 HD21 HG11 ' B' ' 22' ' ' VAL . 0.1 OUTLIER -66.66 -32.48 73.83 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.218 -1.166 . . . . 0.0 110.242 179.997 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . 0.408 HG23 HG11 ' C' ' 10' ' ' VAL . 65.9 m -57.42 -63.18 1.32 Allowed 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.268 -0.895 . . . . 0.0 110.355 -179.806 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -51.0 -41.15 59.58 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.295 -0.878 . . . . 0.0 110.533 -179.86 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -64.32 -42.79 96.15 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.317 -0.865 . . . . 0.0 110.28 -179.891 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.78 HD22 HD11 ' B' ' 15' ' ' LEU . 59.8 mt -70.24 -47.4 61.53 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.195 -0.941 . . . . 0.0 110.14 -179.934 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . 0.404 ' O ' HG23 ' A' ' 20' ' ' VAL . 0.0 OUTLIER -54.49 -39.91 68.0 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.158 -0.964 . . . . 0.0 109.947 179.882 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . 0.405 ' O ' ' HG3' ' A' ' 21' ' ' GLU . . . -57.04 -49.81 68.93 Favored Glycine 0 N--CA 1.49 2.266 0 N-CA-C 109.202 -1.559 . . . . 0.0 109.202 179.671 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . 0.603 ' O ' HG23 ' A' ' 22' ' ' VAL . 23.7 t80 -58.65 -21.39 53.88 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.358 -1.083 . . . . 0.0 110.109 179.729 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 1.3 m -82.77 -28.57 30.26 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.285 -0.884 . . . . 0.0 110.077 -179.992 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.404 HG23 ' O ' ' A' ' 16' ' ' GLN . 61.6 t -79.92 -18.1 12.6 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.701 0 O-C-N 121.356 -0.84 . . . . 0.0 110.294 179.997 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.405 ' HG3' ' O ' ' A' ' 17' ' ' GLY . 1.0 OUTLIER -90.79 -46.99 7.9 Favored 'General case' 0 N--CA 1.499 1.986 0 O-C-N 121.131 -0.981 . . . . 0.0 109.09 179.939 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.603 HG23 ' O ' ' A' ' 18' ' ' TYR . 86.1 t -59.71 -38.52 76.25 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.512 0 O-C-N 121.669 -0.644 . . . . 0.0 110.029 -179.976 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -75.87 -36.28 59.61 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.347 -0.846 . . . . 0.0 109.959 179.701 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.98 -26.12 53.54 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.288 -0.883 . . . . 0.0 110.233 179.928 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 73.4 mm-40 -97.96 -38.58 9.34 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.257 -0.902 . . . . 0.0 110.409 -179.856 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 1.7 mt-30 53.35 56.54 13.93 Favored Pre-proline 0 N--CA 1.492 1.634 0 O-C-N 121.247 -0.908 . . . . 0.0 110.028 -179.834 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 45.0 Cg_endo -71.09 156.9 58.96 Favored 'Trans proline' 0 C--N 1.312 -1.387 0 O-C-N 123.757 1.399 . . . . 0.0 110.606 -179.798 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 44.6 Cg_endo -70.93 -21.31 28.22 Favored 'Trans proline' 0 C--N 1.312 -1.371 0 O-C-N 123.768 1.404 . . . . 0.0 110.469 179.9 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 4.4 p-10 -139.36 123.61 18.03 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.28 -0.888 . . . . 0.0 110.204 179.987 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 5.3 tp -88.82 -31.04 18.52 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.2 -0.938 . . . . 0.0 110.125 179.851 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.435 HG23 ' H ' ' A' ' 31' ' ' VAL . 42.9 t -50.71 -58.4 1.83 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.769 0 O-C-N 121.27 -0.894 . . . . 0.0 110.124 179.865 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 8.0 t0 -64.23 -42.88 96.36 Favored 'General case' 0 C--N 1.302 -1.487 0 O-C-N 121.509 -0.745 . . . . 0.0 110.12 179.87 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 89.4 t80 -61.57 -40.32 94.31 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.212 -0.93 . . . . 0.0 109.904 179.722 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . 0.467 ' HB2' ' OH ' ' A' ' 18' ' ' TYR . . . -56.72 -37.28 70.74 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.279 -0.888 . . . . 0.0 110.204 179.905 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.467 HG13 ' OG1' ' B' ' 39' ' ' THR . 90.1 t -74.18 -37.79 46.93 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.346 0 O-C-N 121.277 -0.889 . . . . 0.0 110.403 -179.798 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -68.76 -37.95 79.74 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.187 -0.945 . . . . 0.0 110.507 -179.819 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 33.0 t80 -63.99 -56.76 12.74 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.222 -0.924 . . . . 0.0 110.592 -179.691 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 20.0 m-85 -68.15 -48.75 64.52 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.252 -0.905 . . . . 0.0 110.908 -179.391 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . 0.508 ' OG1' HG13 ' B' ' 35' ' ' VAL . 55.5 m -52.17 -46.73 65.61 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.048 -1.033 . . . . 0.0 110.209 -179.786 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 7.1 ttt-85 -64.13 -29.0 70.15 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.199 -0.938 . . . . 0.0 110.018 179.83 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -64.82 -28.27 69.45 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.338 -0.851 . . . . 0.0 110.279 179.982 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.07 -22.02 62.17 Favored 'General case' 0 C--N 1.306 -1.307 0 O-C-N 121.212 -0.93 . . . . 0.0 109.853 179.871 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -106.8 -12.52 15.49 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.228 -0.92 . . . . 0.0 110.549 179.9 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.668 0 O-C-N 121.08 -1.012 . . . . 0.0 110.705 -179.782 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 48.8 Cg_endo . . . . . 0 N--CA 1.486 1.033 0 N-CA-C 110.614 -0.572 . . . . 0.0 110.614 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' B' B ' 9' ' ' PRO . . . . . . . . . . . . . 48.3 Cg_endo -75.14 -172.91 1.4 Allowed 'Trans proline' 0 C--N 1.312 -1.355 0 O-C-N 123.551 1.29 . . . . 0.0 110.33 179.797 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 94.37 -18.88 56.07 Favored Glycine 0 N--CA 1.491 2.335 0 N-CA-C 109.822 -1.311 . . . . 0.0 109.822 -179.963 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 11' ' ' LEU . . . . . 0.618 HD23 ' O ' ' B' ' 11' ' ' LEU . 3.3 tt -88.53 -19.32 26.53 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.183 -1.186 . . . . 0.0 110.367 -180.0 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 64.8 m -63.55 -50.55 69.05 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.193 -0.942 . . . . 0.0 110.398 -179.88 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -51.53 -34.52 36.67 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.302 -0.874 . . . . 0.0 110.34 -179.892 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -69.14 -55.69 9.92 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.294 -0.879 . . . . 0.0 110.145 179.983 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . 0.78 HD11 HD22 ' A' ' 15' ' ' LEU . 1.0 OUTLIER -55.35 -41.2 72.19 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.214 -0.929 . . . . 0.0 109.919 179.872 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 1.7 tt0 -59.29 -39.23 82.34 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.233 -0.917 . . . . 0.0 109.734 179.679 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 17' ' ' GLY . . . . . . . . . . . . . . . -62.39 -39.67 98.07 Favored Glycine 0 N--CA 1.489 2.225 0 N-CA-C 109.152 -1.579 . . . . 0.0 109.152 179.621 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 18' ' ' TYR . . . . . 0.607 ' OH ' ' HB2' ' B' ' 34' ' ' ALA . 16.8 t80 -71.56 -43.91 65.5 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.261 -1.14 . . . . 0.0 109.935 179.676 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 10.3 m -53.55 -35.42 60.72 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.346 -0.846 . . . . 0.0 109.919 179.683 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 42.2 t -69.76 -73.62 0.1 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.614 0 O-C-N 121.364 -0.835 . . . . 0.0 109.904 179.769 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 7.8 pt-20 -46.75 -42.96 17.66 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.449 -0.782 . . . . 0.0 110.912 -179.752 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 22' ' ' VAL . . . . . 0.51 HG23 ' O ' ' B' ' 18' ' ' TYR . 55.1 t -57.47 -36.25 52.71 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.622 0 O-C-N 121.108 -0.995 . . . . 0.0 109.506 179.445 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 8.2 tp -89.47 -22.32 22.54 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.347 -0.846 . . . . 0.0 109.964 179.612 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -86.85 -61.89 1.63 Allowed 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.268 -0.895 . . . . 0.0 110.139 179.782 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 29.5 mm-40 -58.84 -33.09 70.03 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.313 -0.867 . . . . 0.0 110.271 179.968 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER 49.7 59.92 16.05 Favored Pre-proline 0 N--CA 1.492 1.656 0 O-C-N 121.326 -0.859 . . . . 0.0 110.411 -179.903 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 27' ' ' PRO . . . . . . . . . . . . . 45.3 Cg_endo -71.52 158.52 53.67 Favored 'Trans proline' 0 C--N 1.311 -1.446 0 O-C-N 123.81 1.427 . . . . 0.0 110.523 -179.859 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 44.0 Cg_endo -70.16 -37.9 7.6 Favored 'Trans proline' 0 C--N 1.311 -1.435 0 O-C-N 123.704 1.371 . . . . 0.0 110.113 179.769 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -127.47 119.35 25.9 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.286 -0.884 . . . . 0.0 109.924 179.677 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 5.0 tp -73.49 -29.85 62.77 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.249 -0.907 . . . . 0.0 110.299 -179.731 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 42.0 t -52.19 -64.79 0.34 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.664 0 O-C-N 121.177 -0.952 . . . . 0.0 110.052 179.749 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 11.8 t0 -56.7 -42.6 79.41 Favored 'General case' 0 C--N 1.302 -1.458 0 O-C-N 121.444 -0.785 . . . . 0.0 110.171 179.806 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 33' ' ' PHE . . . . . . . . . . . . . 22.9 t80 -60.06 -53.58 56.1 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.163 -0.96 . . . . 0.0 109.783 179.497 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 34' ' ' ALA . . . . . 0.607 ' HB2' ' OH ' ' B' ' 18' ' ' TYR . . . -51.01 -33.31 24.39 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.369 -0.832 . . . . 0.0 110.296 179.679 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 35' ' ' VAL . . . . . 0.508 HG13 ' OG1' ' A' ' 39' ' ' THR . 88.9 t -79.44 -41.54 22.51 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.406 0 O-C-N 121.166 -0.959 . . . . 0.0 110.222 179.946 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -66.51 -39.04 88.47 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.307 -0.871 . . . . 0.0 110.548 -179.783 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 37' ' ' TYR . . . . . . . . . . . . . 61.1 t80 -67.14 -66.72 0.52 Allowed 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.136 -0.978 . . . . 0.0 110.423 -179.691 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 10.6 m-85 -51.26 -48.84 62.08 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.142 -0.974 . . . . 0.0 110.519 -179.586 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 39' ' ' THR . . . . . 0.467 ' OG1' HG13 ' A' ' 35' ' ' VAL . 45.6 m -53.75 -32.44 52.27 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.096 -1.003 . . . . 0.0 109.905 179.961 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -76.14 -30.5 58.18 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.174 -0.954 . . . . 0.0 109.775 179.589 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -61.9 -28.64 69.65 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.318 -0.864 . . . . 0.0 109.823 179.563 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.43 -22.11 65.53 Favored 'General case' 0 C--N 1.304 -1.391 0 O-C-N 121.363 -0.836 . . . . 0.0 109.91 179.793 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 43' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.491 1.608 0 O-C-N 121.27 -0.894 . . . . 0.0 110.198 -179.884 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 2' ' ' LEU . . . . . . . . . . . . . 1.1 pp . . . . . 0 N--CA 1.492 1.633 0 CA-C-O 121.31 0.576 . . . . 0.0 110.155 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' C' C ' 3' ' ' ILE . . . . . . . . . . . . . 5.3 mt -58.28 -58.05 8.17 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.64 0 O-C-N 121.295 -0.878 . . . . 0.0 110.176 179.912 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 4' ' ' GLU . . . . . . . . . . . . . 6.8 tm-20 -53.36 -41.18 65.56 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.204 -0.935 . . . . 0.0 109.968 179.976 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 5' ' ' THR . . . . . . . . . . . . . 1.3 m -63.32 -34.08 76.91 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.289 -0.882 . . . . 0.0 109.892 179.886 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 6' ' ' ALA . . . . . . . . . . . . . . . -75.77 -32.62 60.02 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.281 -0.887 . . . . 0.0 110.101 179.934 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 7' ' ' SER . . . . . . . . . . . . . 27.8 t -68.6 -34.53 75.93 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.192 -0.943 . . . . 0.0 110.187 179.899 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 8' ' ' SER . . . . . . . . . . . . . 46.7 t -67.94 -32.96 73.77 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.341 -0.85 . . . . 0.0 110.285 179.89 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' C' C ' 9' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -68.35 -36.02 78.62 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.176 -0.952 . . . . 0.0 110.17 179.919 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 10' ' ' VAL . . . . . 0.408 HG11 HG23 ' A' ' 12' ' ' THR . 95.0 t -57.53 -44.25 84.59 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 O-C-N 121.293 -0.879 . . . . 0.0 110.125 -179.978 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.18 -55.38 34.54 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.377 -0.827 . . . . 0.0 110.192 179.951 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' C' C ' 12' ' ' ASN . . . . . . . . . . . . . 1.2 m-80 . . . . . 0 N--CA 1.491 1.599 0 O-C-N 121.289 -0.882 . . . . 0.0 110.384 -179.877 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.294 0 N-CA-C 109.528 -1.429 . . . . 0.0 109.528 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 11.6 tp -52.88 -46.39 67.9 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.282 -1.128 . . . . 0.0 110.066 179.869 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 98.2 m -59.19 -47.07 86.68 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.193 -0.942 . . . . 0.0 110.151 179.864 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.6 tm-20 -57.47 -29.23 64.07 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.232 -0.917 . . . . 0.0 110.057 179.846 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.672 HD21 ' CE1' ' A' ' 38' ' ' PHE . 4.0 tt -78.41 -44.56 24.51 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.267 -0.895 . . . . 0.0 110.242 179.924 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.638 HD22 HD11 ' B' ' 15' ' ' LEU . 98.4 mt -70.39 -50.53 37.78 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.288 -0.883 . . . . 0.0 110.271 -179.859 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -53.3 -46.81 69.53 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.164 -0.96 . . . . 0.0 110.052 179.959 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -56.89 -40.35 90.08 Favored Glycine 0 N--CA 1.491 2.301 0 N-CA-C 109.137 -1.585 . . . . 0.0 109.137 179.613 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . 0.605 ' O ' HG23 ' A' ' 22' ' ' VAL . 22.8 t80 -66.64 -44.74 81.16 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.309 -1.113 . . . . 0.0 109.812 179.668 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 52.4 m -57.3 -26.85 61.54 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.366 -0.834 . . . . 0.0 109.902 179.632 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 44.2 t -73.53 -72.27 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.569 0 O-C-N 121.381 -0.824 . . . . 0.0 110.258 179.995 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.443 ' OE2' ' CD1' ' A' ' 37' ' ' TYR . 10.1 pt-20 -46.42 -43.56 16.5 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.39 -0.819 . . . . 0.0 111.144 -179.476 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.605 HG23 ' O ' ' A' ' 18' ' ' TYR . 99.6 t -58.52 -37.34 64.08 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.657 0 O-C-N 120.914 -1.116 . . . . 0.0 110.004 179.955 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.487 HD13 ' HG ' ' C' ' 2' ' ' LEU . 0.4 OUTLIER -78.57 -20.63 50.12 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.362 -0.836 . . . . 0.0 110.298 179.939 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -95.23 -58.33 2.17 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.284 -0.885 . . . . 0.0 110.462 -179.736 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . 0.43 ' O ' ' CG ' ' A' ' 26' ' ' GLN . 7.9 mp0 -63.11 -22.34 66.79 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.218 -0.926 . . . . 0.0 110.531 -179.73 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . 0.43 ' CG ' ' O ' ' A' ' 25' ' ' GLN . 3.4 pt20 36.49 59.24 3.46 Favored Pre-proline 0 N--CA 1.505 2.279 0 O-C-N 122.013 -0.429 . . . . 0.0 111.589 -179.9 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo -69.95 161.22 46.78 Favored 'Trans proline' 0 C--N 1.31 -1.459 0 O-C-N 123.796 1.419 . . . . 0.0 110.763 -179.735 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 43.4 Cg_endo -69.81 -46.34 1.24 Allowed 'Trans proline' 0 C--N 1.311 -1.398 0 O-C-N 123.84 1.442 . . . . 0.0 110.33 179.975 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -120.54 116.45 25.4 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.355 -0.84 . . . . 0.0 110.048 179.86 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 6.7 tp -70.22 -30.8 67.98 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.391 -0.818 . . . . 0.0 110.273 -179.992 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.416 HG23 ' H ' ' A' ' 31' ' ' VAL . 41.5 t -51.3 -64.8 0.31 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.663 0 O-C-N 121.239 -0.913 . . . . 0.0 109.956 179.929 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 1.4 t0 -55.3 -39.36 69.8 Favored 'General case' 0 C--N 1.302 -1.467 0 O-C-N 121.429 -0.794 . . . . 0.0 110.022 179.654 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . 0.401 ' CZ ' ' OE2' ' A' ' 21' ' ' GLU . 66.4 t80 -62.35 -44.69 95.89 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.267 -0.896 . . . . 0.0 109.876 179.63 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . 0.463 ' HB2' ' OH ' ' A' ' 18' ' ' TYR . . . -59.34 -42.9 92.58 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.31 -0.868 . . . . 0.0 110.116 179.887 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.508 HG13 ' OG1' ' B' ' 39' ' ' THR . 71.9 t -73.09 -24.39 20.8 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.382 0 O-C-N 121.209 -0.932 . . . . 0.0 109.977 179.903 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -80.98 -36.64 30.51 Favored 'General case' 0 C--N 1.304 -1.398 0 O-C-N 121.288 -0.883 . . . . 0.0 109.793 -179.911 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . 0.443 ' CD1' ' OE2' ' A' ' 21' ' ' GLU . 61.4 t80 -74.94 -61.28 1.94 Allowed 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.15 -0.969 . . . . 0.0 110.318 -179.826 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . 0.672 ' CE1' HD21 ' A' ' 14' ' ' LEU . 14.9 m-85 -52.15 -51.36 58.47 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.316 -0.865 . . . . 0.0 110.415 -179.925 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . 0.507 ' OG1' HG13 ' B' ' 35' ' ' VAL . 21.2 m -51.91 -43.25 63.32 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.189 -0.944 . . . . 0.0 110.069 179.914 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.73 -30.52 70.03 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.232 -0.918 . . . . 0.0 110.14 179.829 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -57.86 -36.5 72.44 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.235 -0.916 . . . . 0.0 109.966 179.917 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 8.4 mtm180 -50.61 -26.86 5.86 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.321 -0.862 . . . . 0.0 109.933 179.563 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . 0.604 ' O ' ' HB3' ' A' ' 44' ' ' ALA . 1.4 mm-40 -104.16 -61.22 1.47 Allowed 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.501 -0.749 . . . . 0.0 109.855 179.679 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . 0.604 ' HB3' ' O ' ' A' ' 43' ' ' GLU . . . . . . . . 0 N--CA 1.501 2.104 0 O-C-N 121.525 -0.734 . . . . 0.0 110.78 179.816 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 48.8 Cg_endo . . . . . 0 N--CA 1.482 0.806 0 N-CA-C 110.32 -0.684 . . . . 0.0 110.32 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' B' B ' 9' ' ' PRO . . . . . . . . . . . . . 46.1 Cg_endo -73.27 153.83 51.18 Favored 'Trans proline' 0 C--N 1.312 -1.36 0 O-C-N 123.535 1.282 . . . . 0.0 110.396 -179.854 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 117.76 -23.38 9.5 Favored Glycine 0 N--CA 1.49 2.282 0 N-CA-C 109.508 -1.437 . . . . 0.0 109.508 -179.863 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 11' ' ' LEU . . . . . 0.432 HD21 HG11 ' A' ' 22' ' ' VAL . 0.2 OUTLIER -73.5 -46.74 46.11 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.229 -1.16 . . . . 0.0 110.215 -179.961 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 95.6 m -54.78 -30.0 55.72 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.156 -0.965 . . . . 0.0 110.138 -179.955 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 4.4 tt0 -64.59 -48.77 73.71 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.314 -0.866 . . . . 0.0 110.18 179.999 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -68.82 -31.02 69.7 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.3 -0.875 . . . . 0.0 110.23 179.901 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . 0.638 HD11 HD22 ' A' ' 15' ' ' LEU . 2.1 mm? -65.27 -55.38 18.69 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.223 -0.923 . . . . 0.0 110.254 -179.978 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -53.11 -45.16 68.16 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.26 -0.9 . . . . 0.0 110.177 179.837 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 17' ' ' GLY . . . . . . . . . . . . . . . -56.35 -36.88 71.22 Favored Glycine 0 N--CA 1.49 2.285 0 N-CA-C 109.256 -1.538 . . . . 0.0 109.256 179.733 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 18' ' ' TYR . . . . . . . . . . . . . 38.5 t80 -73.41 -44.88 57.47 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.386 -1.067 . . . . 0.0 110.063 179.811 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 19' ' ' THR . . . . . 0.801 ' O ' HD23 ' B' ' 23' ' ' LEU . 52.2 m -57.28 -23.31 47.55 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.239 -0.913 . . . . 0.0 110.05 179.923 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 37.6 t -78.58 -70.34 0.38 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.649 0 O-C-N 121.409 -0.807 . . . . 0.0 110.143 -179.982 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 21' ' ' GLU . . . . . 0.444 ' HG3' HG23 ' B' ' 22' ' ' VAL . 10.2 pt-20 -44.58 -42.81 7.63 Favored 'General case' 0 N--CA 1.497 1.906 0 O-C-N 121.514 -0.741 . . . . 0.0 111.065 -179.507 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 22' ' ' VAL . . . . . 0.444 HG23 ' HG3' ' B' ' 21' ' ' GLU . 84.7 t -66.23 -34.59 71.21 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.551 0 O-C-N 121.051 -1.031 . . . . 0.0 109.64 179.556 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 23' ' ' LEU . . . . . 0.801 HD23 ' O ' ' B' ' 19' ' ' THR . 1.8 mm? -75.47 -28.72 59.36 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.342 -0.849 . . . . 0.0 109.923 179.802 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -90.58 -65.2 1.04 Allowed 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.377 -0.827 . . . . 0.0 110.187 -179.876 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 25' ' ' GLN . . . . . 0.446 ' CG ' ' O ' ' B' ' 25' ' ' GLN . 1.9 tt0 -85.29 56.56 4.0 Favored 'General case' 0 C--N 1.305 -1.35 0 O-C-N 121.114 -0.991 . . . . 0.0 109.845 179.911 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 10.1 mt-30 -38.29 98.8 0.17 Allowed Pre-proline 0 N--CA 1.499 1.986 0 O-C-N 121.896 -0.503 . . . . 0.0 111.56 -179.717 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 27' ' ' PRO . . . . . . . . . . . . . 47.3 Cg_endo -74.26 160.05 42.86 Favored 'Trans proline' 0 C--N 1.311 -1.421 0 O-C-N 123.909 1.478 . . . . 0.0 110.41 -179.909 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 44.4 Cg_endo -71.39 -28.16 18.41 Favored 'Trans proline' 0 C--N 1.312 -1.363 0 O-C-N 123.677 1.356 . . . . 0.0 109.967 179.691 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -146.59 112.38 5.67 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.392 -0.818 . . . . 0.0 109.926 179.695 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 30' ' ' LEU . . . . . 0.471 HD23 HD13 ' A' ' 14' ' ' LEU . 1.7 tp -57.09 -33.74 67.61 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.226 -0.921 . . . . 0.0 109.882 -179.994 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 47.5 t -53.55 -55.9 11.13 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.653 0 O-C-N 121.353 -0.842 . . . . 0.0 109.898 179.59 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -65.21 -40.35 94.03 Favored 'General case' 0 C--N 1.301 -1.506 0 O-C-N 121.58 -0.7 . . . . 0.0 110.191 -179.93 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 33' ' ' PHE . . . . . 0.443 ' CE2' HG22 ' B' ' 22' ' ' VAL . 79.3 t80 -63.83 -43.29 96.64 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.214 -0.928 . . . . 0.0 109.757 179.642 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -59.01 -38.69 79.8 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.31 -0.868 . . . . 0.0 110.109 179.846 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 35' ' ' VAL . . . . . 0.507 HG13 ' OG1' ' A' ' 39' ' ' THR . 70.7 t -79.84 -25.57 12.1 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.358 0 O-C-N 121.245 -0.909 . . . . 0.0 109.901 179.791 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -81.88 -36.83 27.76 Favored 'General case' 0 C--N 1.304 -1.391 0 O-C-N 121.297 -0.877 . . . . 0.0 110.112 -179.791 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 37' ' ' TYR . . . . . 0.429 ' CZ ' ' OE1' ' B' ' 21' ' ' GLU . 87.5 t80 -76.1 -59.52 2.73 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.043 -1.036 . . . . 0.0 110.629 -179.658 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 38' ' ' PHE . . . . . 0.457 ' HB3' ' CG2' ' A' ' 35' ' ' VAL . 4.3 m-85 -55.48 -46.38 76.87 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.232 -0.917 . . . . 0.0 110.655 -179.554 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 39' ' ' THR . . . . . 0.508 ' OG1' HG13 ' A' ' 35' ' ' VAL . 8.7 m -53.23 -48.73 67.94 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 120.939 -1.101 . . . . 0.0 109.975 179.993 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -55.74 -42.46 75.43 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.222 -0.924 . . . . 0.0 110.255 179.989 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 1.6 mt -54.56 -40.96 69.25 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.206 -0.934 . . . . 0.0 109.913 179.75 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.16 -25.46 67.77 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.233 -0.917 . . . . 0.0 109.907 179.79 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 43' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 . . . . . 0 N--CA 1.491 1.614 0 O-C-N 121.364 -0.835 . . . . 0.0 110.103 179.798 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' C' C ' 2' ' ' LEU . . . . . 0.487 ' HG ' HD13 ' A' ' 23' ' ' LEU . 0.6 OUTLIER . . . . . 0 N--CA 1.501 2.111 0 CA-C-O 121.191 0.519 . . . . 0.0 110.419 . . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 3' ' ' ILE . . . . . . . . . . . . . 49.3 mm -66.3 -53.93 31.57 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.636 0 O-C-N 121.078 -1.014 . . . . 0.0 110.254 -179.895 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 4' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -51.77 -38.03 53.85 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.248 -0.908 . . . . 0.0 110.327 -179.981 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 5' ' ' THR . . . . . . . . . . . . . 93.1 m -72.62 -48.42 39.75 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.387 -0.821 . . . . 0.0 110.364 -179.921 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 6' ' ' ALA . . . . . 0.433 ' O ' HG12 ' C' ' 10' ' ' VAL . . . -56.35 -25.65 49.99 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.254 -0.903 . . . . 0.0 110.477 -179.781 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 7' ' ' SER . . . . . . . . . . . . . 63.1 m -83.79 -39.12 20.41 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.124 -0.985 . . . . 0.0 110.267 -179.897 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 8' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -75.39 -37.43 60.52 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.18 -0.95 . . . . 0.0 110.107 179.923 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 9' ' ' LEU . . . . . . . . . . . . . 2.6 tp -66.34 -56.68 9.96 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.246 -0.909 . . . . 0.0 110.065 179.85 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 10' ' ' VAL . . . . . 0.433 HG12 ' O ' ' C' ' 6' ' ' ALA . 10.9 p -51.64 -28.38 8.9 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.597 0 O-C-N 121.309 -0.869 . . . . 0.0 110.405 179.966 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' C' C ' 11' ' ' LYS . . . . . . . . . . . . . 8.9 mttm -67.98 -49.0 64.25 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.266 -0.897 . . . . 0.0 110.269 179.969 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' C' C ' 12' ' ' ASN . . . . . . . . . . . . . 28.4 m-20 . . . . . 0 N--CA 1.492 1.65 0 O-C-N 121.269 -0.895 . . . . 0.0 110.761 179.985 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.314 0 N-CA-C 109.807 -1.317 . . . . 0.0 109.807 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.46 HD11 HD13 ' B' ' 30' ' ' LEU . 1.7 mp -84.36 -24.36 29.74 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.152 -1.205 . . . . 0.0 110.492 -179.739 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 71.5 m -54.8 -57.14 12.77 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.153 -0.967 . . . . 0.0 110.589 -179.754 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -56.94 -48.71 77.65 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.276 -0.89 . . . . 0.0 110.631 -179.593 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.617 HD22 ' CD2' ' B' ' 30' ' ' LEU . 3.5 tp -50.75 -58.13 6.66 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.277 -0.889 . . . . 0.0 110.692 -179.489 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 2.4 mp -56.36 -49.41 74.49 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.199 -0.938 . . . . 0.0 110.389 -179.752 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . 0.65 ' OE1' HG21 ' C' ' 10' ' ' VAL . 0.9 OUTLIER -50.41 -49.15 55.44 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.185 -0.947 . . . . 0.0 110.324 179.981 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -55.25 -38.84 69.24 Favored Glycine 0 N--CA 1.491 2.333 0 N-CA-C 109.055 -1.618 . . . . 0.0 109.055 179.658 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . 0.763 ' O ' HG23 ' A' ' 22' ' ' VAL . 24.7 t80 -67.42 -50.65 58.53 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.407 -1.055 . . . . 0.0 109.708 179.492 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 70.9 m -57.01 -32.83 66.54 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.282 -0.886 . . . . 0.0 109.807 179.621 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.571 HG23 ' O ' ' A' ' 16' ' ' GLN . 44.8 t -63.46 -73.76 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.545 0 O-C-N 121.357 -0.839 . . . . 0.0 110.22 179.959 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.414 ' OE1' ' CE1' ' A' ' 37' ' ' TYR . 10.3 pt-20 -45.06 -43.26 9.3 Favored 'General case' 0 N--CA 1.498 1.931 0 O-C-N 121.461 -0.774 . . . . 0.0 111.035 -179.575 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.763 HG23 ' O ' ' A' ' 18' ' ' TYR . 94.6 t -51.92 -53.84 15.99 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.713 0 O-C-N 121.1 -1.0 . . . . 0.0 110.144 179.888 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.434 HD22 HD21 ' C' ' 2' ' ' LEU . 0.9 OUTLIER -56.81 -35.27 68.57 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.271 -0.893 . . . . 0.0 110.115 179.874 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 1.4 mmt180 -77.34 -62.9 1.5 Allowed 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.31 -0.869 . . . . 0.0 110.331 -179.925 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 34.9 mm-40 -57.84 -39.34 77.45 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.218 -0.926 . . . . 0.0 110.26 -179.955 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 51.79 56.93 16.34 Favored Pre-proline 0 N--CA 1.492 1.661 0 O-C-N 121.235 -0.916 . . . . 0.0 110.102 -179.794 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 43.8 Cg_endo -70.06 161.06 47.39 Favored 'Trans proline' 0 C--N 1.311 -1.403 0 O-C-N 123.735 1.387 . . . . 0.0 110.51 -179.996 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 45.4 Cg_endo -71.5 -34.04 10.0 Favored 'Trans proline' 0 C--N 1.311 -1.401 0 O-C-N 123.694 1.365 . . . . 0.0 110.23 -179.976 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -130.12 119.45 23.04 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.325 -0.859 . . . . 0.0 110.264 -179.847 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 5.3 tp -75.28 -35.57 61.29 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.342 -0.848 . . . . 0.0 109.816 179.802 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.611 HG12 ' HD2' ' B' ' 42' ' ' ARG . 44.9 t -51.55 -59.18 1.46 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.695 0 O-C-N 121.279 -0.888 . . . . 0.0 109.855 179.564 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 6.0 t0 -58.55 -40.1 82.08 Favored 'General case' 0 C--N 1.301 -1.529 0 O-C-N 121.683 -0.636 . . . . 0.0 109.932 179.753 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 42.4 t80 -62.05 -48.78 78.7 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.157 -0.965 . . . . 0.0 109.511 179.448 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . 0.627 ' HB2' ' OH ' ' A' ' 18' ' ' TYR . . . -52.97 -38.2 61.94 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.389 -0.819 . . . . 0.0 110.121 179.716 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.546 HG13 ' OG1' ' B' ' 39' ' ' THR . 97.1 t -70.06 -35.73 65.24 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.367 0 O-C-N 121.25 -0.906 . . . . 0.0 110.174 -179.958 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -83.14 -20.17 35.28 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.294 -0.879 . . . . 0.0 110.444 -179.989 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . 0.414 ' CE1' ' OE1' ' A' ' 21' ' ' GLU . 33.7 t80 -73.31 -62.21 1.55 Allowed 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.205 -0.935 . . . . 0.0 110.565 -179.665 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . 0.45 ' CE1' HD21 ' A' ' 14' ' ' LEU . 29.3 m-85 -67.18 -45.21 77.63 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.204 -0.935 . . . . 0.0 110.644 -179.571 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . 0.542 ' OG1' HG13 ' B' ' 35' ' ' VAL . 42.7 m -52.53 -39.28 61.21 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.156 -0.965 . . . . 0.0 110.252 -179.939 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 3.6 mtp85 -74.37 -34.59 63.41 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.204 -0.935 . . . . 0.0 110.008 179.773 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 10.5 tp -65.97 -19.95 66.04 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.38 -0.825 . . . . 0.0 110.396 -179.939 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -82.69 -21.91 34.73 Favored 'General case' 0 C--N 1.305 -1.367 0 O-C-N 121.139 -0.976 . . . . 0.0 109.915 179.977 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 12.2 mt-10 -104.21 -4.99 22.35 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.194 -0.941 . . . . 0.0 110.816 -179.983 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.652 0 O-C-N 120.933 -1.104 . . . . 0.0 110.318 179.93 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 45.0 Cg_endo . . . . . 0 N--CA 1.485 1.027 0 N-CA-C 110.628 -0.566 . . . . 0.0 110.628 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' B' B ' 9' ' ' PRO . . . . . . . . . . . . . 47.9 Cg_endo -73.72 156.82 48.68 Favored 'Trans proline' 0 C--N 1.312 -1.369 0 O-C-N 123.654 1.344 . . . . 0.0 110.248 179.675 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 135.25 -31.27 2.71 Favored Glycine 0 N--CA 1.49 2.28 0 N-CA-C 109.606 -1.398 . . . . 0.0 109.606 179.884 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 1.8 mp -78.32 -22.96 47.32 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.276 -1.132 . . . . 0.0 110.151 179.941 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 89.3 m -54.4 -42.15 70.08 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.378 -0.826 . . . . 0.0 110.302 179.985 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -79.4 -36.09 39.68 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.282 -0.886 . . . . 0.0 110.274 179.976 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 2.8 tp -65.2 -49.95 67.78 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.235 -0.916 . . . . 0.0 110.151 -179.994 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 6.0 mp -62.78 -50.29 71.62 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.319 -0.863 . . . . 0.0 110.391 -179.971 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 16' ' ' GLN . . . . . 0.713 ' O ' HG23 ' B' ' 20' ' ' VAL . 1.1 mt-30 -52.04 -40.5 61.18 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.153 -0.967 . . . . 0.0 110.139 179.972 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 17' ' ' GLY . . . . . . . . . . . . . . . -57.6 -51.67 56.51 Favored Glycine 0 N--CA 1.491 2.301 0 N-CA-C 109.169 -1.572 . . . . 0.0 109.169 179.649 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 18' ' ' TYR . . . . . 0.904 ' OH ' ' HB2' ' B' ' 34' ' ' ALA . 12.0 t80 -54.04 -38.99 65.8 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.369 -1.077 . . . . 0.0 110.19 179.891 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 51.9 m -71.03 -32.94 69.84 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.391 -0.818 . . . . 0.0 110.307 -179.862 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 20' ' ' VAL . . . . . 0.713 HG23 ' O ' ' B' ' 16' ' ' GLN . 90.3 t -70.1 -17.38 20.91 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.625 0 O-C-N 121.216 -0.927 . . . . 0.0 110.473 -179.892 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 21' ' ' GLU . . . . . 0.472 ' OE1' ' CD1' ' B' ' 37' ' ' TYR . 0.7 OUTLIER -92.23 -57.79 2.59 Favored 'General case' 0 N--CA 1.497 1.905 0 O-C-N 121.09 -1.006 . . . . 0.0 109.439 -179.927 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 22' ' ' VAL . . . . . . . . . . . . . 96.5 t -49.85 -26.34 2.76 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.528 0 O-C-N 121.565 -0.71 . . . . 0.0 110.476 -179.952 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 1.2 mt -84.78 -47.34 10.49 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.214 -0.929 . . . . 0.0 110.076 179.722 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.47 -66.6 0.64 Allowed 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.205 -0.934 . . . . 0.0 110.178 179.82 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 25' ' ' GLN . . . . . 0.429 ' O ' ' CG ' ' B' ' 25' ' ' GLN . 0.2 OUTLIER -91.68 59.69 3.8 Favored 'General case' 0 C--N 1.306 -1.292 0 O-C-N 121.039 -1.038 . . . . 0.0 109.917 179.903 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 21.2 mt-30 -38.42 98.63 0.17 Allowed Pre-proline 0 N--CA 1.5 2.056 0 O-C-N 122.042 -0.411 . . . . 0.0 111.676 -179.646 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 27' ' ' PRO . . . . . 0.515 ' HG3' ' CD2' ' B' ' 33' ' ' PHE . 49.4 Cg_endo -77.42 163.66 29.57 Favored 'Trans proline' 0 C--N 1.311 -1.422 0 O-C-N 123.821 1.432 . . . . 0.0 110.55 -179.986 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 45.1 Cg_endo -71.84 -52.65 0.19 Allowed 'Trans proline' 0 C--N 1.313 -1.34 0 O-C-N 123.679 1.357 . . . . 0.0 110.745 -179.946 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 58.0 m-20 -117.53 116.83 27.89 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.12 -0.988 . . . . 0.0 110.31 -179.826 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 30' ' ' LEU . . . . . 0.617 ' CD2' HD22 ' A' ' 14' ' ' LEU . 0.5 OUTLIER -60.5 -45.49 93.59 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.28 -0.888 . . . . 0.0 110.169 179.991 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 31' ' ' VAL . . . . . 0.504 ' O ' HG23 ' B' ' 35' ' ' VAL . 43.5 t -50.6 -63.05 0.44 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.761 0 O-C-N 121.233 -0.917 . . . . 0.0 109.964 179.737 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 4.8 t0 -57.92 -33.37 68.72 Favored 'General case' 0 C--N 1.303 -1.43 0 O-C-N 121.477 -0.764 . . . . 0.0 109.855 179.711 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 33' ' ' PHE . . . . . 0.515 ' CD2' ' HG3' ' B' ' 27' ' ' PRO . 32.7 t80 -67.24 -51.32 54.56 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.316 -0.865 . . . . 0.0 109.477 179.38 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 34' ' ' ALA . . . . . 0.904 ' HB2' ' OH ' ' B' ' 18' ' ' TYR . . . -54.05 -32.14 53.67 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.399 -0.813 . . . . 0.0 109.961 179.698 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 35' ' ' VAL . . . . . 0.542 HG13 ' OG1' ' A' ' 39' ' ' THR . 87.5 t -71.8 -38.19 64.69 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.355 0 O-C-N 121.277 -0.889 . . . . 0.0 110.117 -179.981 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -73.45 -34.36 65.36 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.182 -0.949 . . . . 0.0 110.23 179.922 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 37' ' ' TYR . . . . . 0.472 ' CD1' ' OE1' ' B' ' 21' ' ' GLU . 19.1 t80 -70.57 -66.62 0.58 Allowed 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.24 -0.913 . . . . 0.0 110.328 -179.945 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 24.8 m-85 -51.36 -53.49 35.78 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.24 -0.912 . . . . 0.0 110.428 -179.877 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 39' ' ' THR . . . . . 0.546 ' OG1' HG13 ' A' ' 35' ' ' VAL . 51.6 m -51.27 -30.88 19.25 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.152 -0.968 . . . . 0.0 110.006 179.79 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -82.83 -28.19 30.33 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.306 -0.871 . . . . 0.0 109.799 179.642 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -54.09 -43.87 70.71 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.4 -0.813 . . . . 0.0 110.094 179.817 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 42' ' ' ARG . . . . . 0.611 ' HD2' HG12 ' A' ' 31' ' ' VAL . 0.0 OUTLIER -51.9 -30.3 23.62 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.27 -0.894 . . . . 0.0 110.645 -179.733 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 43' ' ' GLU . . . . . . . . . . . . . 18.4 mm-40 . . . . . 0 N--CA 1.493 1.687 0 O-C-N 121.126 -0.984 . . . . 0.0 110.803 -179.738 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' C' C ' 2' ' ' LEU . . . . . 0.434 HD21 HD22 ' A' ' 23' ' ' LEU . 0.5 OUTLIER . . . . . 0 N--CA 1.499 2.013 0 CA-C-O 121.086 0.47 . . . . 0.0 110.528 . . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 3' ' ' ILE . . . . . . . . . . . . . 15.1 tt -55.03 -22.97 12.05 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.68 0 O-C-N 121.235 -0.916 . . . . 0.0 110.684 -179.78 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 4' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -86.34 -0.23 55.42 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.121 -0.987 . . . . 0.0 110.841 -179.769 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 5' ' ' THR . . . . . . . . . . . . . 86.2 m -125.01 -34.84 2.73 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.043 -1.036 . . . . 0.0 110.369 -179.913 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 6' ' ' ALA . . . . . . . . . . . . . . . -72.28 -38.06 68.88 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.154 -0.966 . . . . 0.0 110.383 -179.811 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 7' ' ' SER . . . . . . . . . . . . . 16.2 m -62.42 -45.84 91.28 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.216 -0.927 . . . . 0.0 110.479 -179.794 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 8' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -72.63 -25.2 61.21 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.2 -0.938 . . . . 0.0 110.37 -179.742 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 9' ' ' LEU . . . . . . . . . . . . . 1.7 tp -61.88 -51.21 69.13 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.296 -0.878 . . . . 0.0 110.194 179.978 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' C' C ' 10' ' ' VAL . . . . . 0.65 HG21 ' OE1' ' A' ' 16' ' ' GLN . 88.5 t -54.31 -47.97 68.3 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.645 0 O-C-N 121.232 -0.918 . . . . 0.0 110.162 179.881 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.98 -46.14 68.13 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.309 -0.869 . . . . 0.0 110.328 179.996 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' C' C ' 12' ' ' ASN . . . . . . . . . . . . . 48.6 t-20 . . . . . 0 N--CA 1.49 1.547 0 O-C-N 121.221 -0.924 . . . . 0.0 110.424 -179.86 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.321 0 N-CA-C 109.729 -1.348 . . . . 0.0 109.729 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -70.37 -29.68 66.41 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.2 -1.176 . . . . 0.0 110.352 -179.898 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 21.9 m -62.14 -60.65 3.28 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.229 -0.919 . . . . 0.0 110.317 -179.885 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . 0.425 ' HG3' ' N ' ' A' ' 14' ' ' LEU . 4.5 pt-20 -52.24 -25.22 8.75 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.278 -0.889 . . . . 0.0 110.391 -179.857 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.66 HD13 HD23 ' B' ' 30' ' ' LEU . 9.0 mt -79.48 -50.1 11.27 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.235 -0.916 . . . . 0.0 110.508 -179.889 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.532 ' CD1' HD22 ' B' ' 15' ' ' LEU . 3.9 mm? -70.75 -50.0 40.72 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.212 -0.93 . . . . 0.0 110.269 -179.853 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . 0.728 ' HG2' ' HB1' ' C' ' 6' ' ' ALA . 1.2 tt0 -57.42 -42.49 82.44 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.274 -0.891 . . . . 0.0 109.949 179.929 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -59.04 -41.49 96.49 Favored Glycine 0 N--CA 1.492 2.371 0 N-CA-C 109.592 -1.403 . . . . 0.0 109.592 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . 0.59 ' O ' HG23 ' A' ' 22' ' ' VAL . 60.4 t80 -68.99 -43.74 74.26 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.159 -1.201 . . . . 0.0 109.959 179.868 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 86.0 m -58.69 -28.27 65.6 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.361 -0.837 . . . . 0.0 110.136 179.883 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 25.4 t -75.4 -70.89 0.28 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.653 0 O-C-N 121.265 -0.897 . . . . 0.0 110.031 179.961 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -47.08 -45.59 21.97 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.341 -0.849 . . . . 0.0 111.032 -179.433 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.59 HG23 ' O ' ' A' ' 18' ' ' TYR . 81.8 t -54.8 -57.63 6.17 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.586 0 O-C-N 120.912 -1.118 . . . . 0.0 110.13 179.96 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 8.4 mt -68.07 -15.15 63.47 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.369 -0.832 . . . . 0.0 110.686 -179.799 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 5.5 tpt180 -80.37 -58.85 2.94 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.088 -1.008 . . . . 0.0 110.47 -179.832 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 5.9 pt20 -81.65 -22.18 37.71 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.241 -0.912 . . . . 0.0 110.443 -179.738 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER 53.22 75.65 0.61 Allowed Pre-proline 0 N--CA 1.491 1.582 0 O-C-N 121.165 -0.959 . . . . 0.0 110.162 -179.837 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 45.0 Cg_endo -71.95 156.86 55.78 Favored 'Trans proline' 0 C--N 1.312 -1.369 0 O-C-N 123.563 1.296 . . . . 0.0 110.415 -179.899 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 43.2 Cg_endo -69.74 -24.36 29.87 Favored 'Trans proline' 0 C--N 1.311 -1.43 0 O-C-N 123.712 1.375 . . . . 0.0 110.043 179.693 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -143.44 117.71 9.59 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.353 -0.842 . . . . 0.0 109.902 179.585 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.41 ' CD1' ' OH ' ' A' ' 18' ' ' TYR . 17.4 tp -72.67 -39.11 67.34 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.269 -0.894 . . . . 0.0 110.307 -179.851 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.583 HG12 ' HG2' ' B' ' 42' ' ' ARG . 45.0 t -49.74 -61.71 0.57 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.767 0 O-C-N 121.242 -0.911 . . . . 0.0 110.22 179.933 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . 0.408 ' OD2' ' NH2' ' B' ' 42' ' ' ARG . 7.1 t0 -58.07 -34.73 70.45 Favored 'General case' 0 C--N 1.302 -1.459 0 O-C-N 121.454 -0.779 . . . . 0.0 110.206 -179.906 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . 0.519 ' CE2' HG22 ' A' ' 22' ' ' VAL . 68.6 t80 -66.64 -44.19 82.64 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.173 -0.954 . . . . 0.0 109.557 179.533 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -56.62 -40.53 75.53 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.429 -0.794 . . . . 0.0 110.257 179.685 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.541 HG13 ' OG1' ' B' ' 39' ' ' THR . 90.5 t -75.7 -26.67 18.17 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.423 0 O-C-N 121.232 -0.917 . . . . 0.0 110.164 -179.999 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . 0.428 ' OE1' ' CA ' ' A' ' 36' ' ' GLU . 1.5 tp10 -81.73 -41.94 20.54 Favored 'General case' 0 C--N 1.303 -1.452 0 O-C-N 121.336 -0.853 . . . . 0.0 109.759 -179.88 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 88.4 t80 -69.39 -59.35 3.05 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.211 -0.931 . . . . 0.0 110.356 -179.836 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . 0.403 ' HB3' ' CG2' ' B' ' 35' ' ' VAL . 6.1 m-85 -54.1 -52.42 61.07 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.231 -0.918 . . . . 0.0 110.451 -179.789 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . 0.51 ' OG1' HG13 ' B' ' 35' ' ' VAL . 24.3 m -52.82 -27.51 18.55 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.135 -0.978 . . . . 0.0 109.988 179.973 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.97 -26.53 60.53 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.21 -0.931 . . . . 0.0 109.986 179.758 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -77.67 -34.75 52.88 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.232 -0.917 . . . . 0.0 110.064 179.82 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -55.7 -28.99 58.61 Favored 'General case' 0 C--N 1.306 -1.297 0 O-C-N 121.226 -0.921 . . . . 0.0 109.271 179.484 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . 0.612 ' O ' ' HB3' ' A' ' 44' ' ' ALA . 0.6 OUTLIER -99.32 -59.56 1.7 Allowed 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.522 -0.736 . . . . 0.0 109.638 179.417 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . 0.612 ' HB3' ' O ' ' A' ' 43' ' ' GLU . . . . . . . . 0 N--CA 1.497 1.88 0 CA-C-O 121.734 0.778 . . . . 0.0 110.275 179.822 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 8' ' ' PRO . . . . . 0.47 ' HB2' ' CB ' ' B' ' 11' ' ' LEU . 44.1 Cg_endo . . . . . 0 N--CA 1.487 1.132 0 N-CA-C 110.662 -0.553 . . . . 0.0 110.662 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 9' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_endo -86.27 123.38 2.26 Favored 'Trans proline' 0 C--N 1.313 -1.322 0 O-C-N 123.597 1.314 . . . . 0.0 111.246 -179.619 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 73.74 2.27 60.49 Favored Glycine 0 N--CA 1.492 2.411 0 C-N-CA 120.262 -0.97 . . . . 0.0 110.887 179.055 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 11' ' ' LEU . . . . . 0.47 ' CB ' ' HB2' ' B' ' 8' ' ' PRO . 0.1 OUTLIER -90.38 -28.86 18.4 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 120.728 -1.454 . . . . 0.0 110.44 -179.935 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 82.0 m -58.13 -39.87 79.83 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.139 -0.976 . . . . 0.0 110.202 179.891 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -60.64 -40.07 90.6 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.351 -0.843 . . . . 0.0 110.106 179.969 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 14' ' ' LEU . . . . . 0.441 ' HA ' HD13 ' B' ' 14' ' ' LEU . 0.5 OUTLIER -60.19 -42.15 94.44 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.254 -0.903 . . . . 0.0 110.252 -179.975 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . 0.532 HD22 ' CD1' ' A' ' 15' ' ' LEU . 65.1 mt -74.64 -44.21 51.6 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.241 -0.912 . . . . 0.0 109.963 179.956 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 16' ' ' GLN . . . . . 0.563 ' O ' HG23 ' B' ' 20' ' ' VAL . 0.9 OUTLIER -54.09 -37.7 64.54 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.308 -0.87 . . . . 0.0 109.956 179.837 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 17' ' ' GLY . . . . . . . . . . . . . . . -67.99 -49.64 46.34 Favored Glycine 0 N--CA 1.49 2.264 0 N-CA-C 109.397 -1.481 . . . . 0.0 109.397 179.862 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 18' ' ' TYR . . . . . 0.44 ' HA ' ' HG3' ' B' ' 21' ' ' GLU . 18.4 t80 -60.02 -34.89 73.98 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.345 -1.091 . . . . 0.0 110.181 179.895 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 95.4 m -63.87 -33.64 76.14 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.18 -0.95 . . . . 0.0 110.525 -179.912 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 20' ' ' VAL . . . . . 0.563 HG23 ' O ' ' B' ' 16' ' ' GLN . 59.4 t -75.46 -22.68 16.53 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.751 0 O-C-N 121.147 -0.971 . . . . 0.0 110.29 -179.811 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 21' ' ' GLU . . . . . 0.44 ' HG3' ' HA ' ' B' ' 18' ' ' TYR . 0.6 OUTLIER -88.92 -52.89 4.86 Favored 'General case' 0 N--CA 1.497 1.915 0 O-C-N 121.153 -0.967 . . . . 0.0 108.702 179.685 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 22' ' ' VAL . . . . . 0.436 HG13 HD13 ' B' ' 30' ' ' LEU . 57.0 t -50.38 -31.8 8.98 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.5 0 O-C-N 121.665 -0.647 . . . . 0.0 110.07 179.498 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -86.34 -39.26 16.64 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.275 -0.891 . . . . 0.0 110.057 179.758 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 1.8 tpt180 -75.86 -52.23 10.8 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.278 -0.889 . . . . 0.0 110.271 -179.95 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 1.9 mm100 -64.04 -40.58 96.61 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.247 -0.908 . . . . 0.0 110.28 -179.961 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 26' ' ' GLN . . . . . 0.401 ' N ' ' CD ' ' B' ' 27' ' ' PRO . 0.2 OUTLIER 51.83 55.71 15.55 Favored Pre-proline 0 N--CA 1.491 1.624 0 O-C-N 121.278 -0.888 . . . . 0.0 110.026 -179.856 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 27' ' ' PRO . . . . . 0.401 ' CD ' ' N ' ' B' ' 26' ' ' GLN . 43.3 Cg_endo -69.6 158.97 55.28 Favored 'Trans proline' 0 C--N 1.313 -1.336 0 O-C-N 123.789 1.415 . . . . 0.0 110.687 -179.629 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_endo -70.0 -22.35 31.11 Favored 'Trans proline' 0 C--N 1.311 -1.406 0 O-C-N 123.724 1.381 . . . . 0.0 110.182 179.811 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 10.4 m-20 -140.2 115.56 9.95 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.369 -0.832 . . . . 0.0 110.123 179.709 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 30' ' ' LEU . . . . . 0.66 HD23 HD13 ' A' ' 14' ' ' LEU . 7.0 tp -72.2 -32.95 67.25 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.297 -0.877 . . . . 0.0 110.008 179.886 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 31' ' ' VAL . . . . . 0.406 ' H ' HG23 ' B' ' 31' ' ' VAL . 33.2 t -57.05 -65.3 0.42 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.715 0 O-C-N 121.316 -0.865 . . . . 0.0 109.879 179.656 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -56.25 -31.74 63.85 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.477 -0.764 . . . . 0.0 109.984 179.868 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 33' ' ' PHE . . . . . . . . . . . . . 47.8 t80 -68.88 -45.48 70.88 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.305 -0.872 . . . . 0.0 109.691 179.462 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -58.49 -37.1 74.84 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.495 -0.753 . . . . 0.0 110.124 179.772 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 35' ' ' VAL . . . . . 0.51 HG13 ' OG1' ' A' ' 39' ' ' THR . 98.3 t -73.2 -46.7 49.7 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.399 0 O-C-N 121.161 -0.962 . . . . 0.0 110.311 179.975 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -60.14 -44.37 94.99 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.165 -0.959 . . . . 0.0 110.416 -179.85 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 37' ' ' TYR . . . . . . . . . . . . . 28.1 t80 -64.45 -67.94 0.39 Allowed 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.209 -0.932 . . . . 0.0 110.606 -179.72 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 13.1 m-85 -51.12 -48.78 61.69 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.279 -0.888 . . . . 0.0 110.776 -179.552 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 39' ' ' THR . . . . . 0.541 ' OG1' HG13 ' A' ' 35' ' ' VAL . 35.7 m -52.35 -32.86 40.34 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 120.959 -1.088 . . . . 0.0 110.002 -179.816 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -68.59 -41.65 79.33 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.266 -0.896 . . . . 0.0 109.848 179.651 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -55.39 -28.31 53.2 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.261 -0.9 . . . . 0.0 109.818 179.658 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 42' ' ' ARG . . . . . 0.583 ' HG2' HG12 ' A' ' 31' ' ' VAL . 7.2 mmm180 -78.63 -19.85 51.71 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.276 -0.89 . . . . 0.0 110.297 179.843 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 43' ' ' GLU . . . . . . . . . . . . . 7.3 mm-40 . . . . . 0 N--CA 1.492 1.665 0 O-C-N 121.136 -0.978 . . . . 0.0 110.649 -179.95 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' C' C ' 2' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.491 1.62 0 CA-C-O 121.16 0.505 . . . . 0.0 110.276 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 3' ' ' ILE . . . . . . . . . . . . . 97.0 mt -63.67 -38.53 82.53 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.629 0 O-C-N 121.19 -0.944 . . . . 0.0 110.3 -179.946 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 4' ' ' GLU . . . . . . . . . . . . . 6.5 mt-10 -66.38 -36.9 84.03 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.229 -0.919 . . . . 0.0 110.397 -179.873 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 5' ' ' THR . . . . . . . . . . . . . 99.0 m -76.46 -56.05 4.98 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.207 -0.933 . . . . 0.0 110.24 -179.956 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 6' ' ' ALA . . . . . 0.728 ' HB1' ' HG2' ' A' ' 16' ' ' GLN . . . -54.42 -35.25 62.71 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.284 -0.885 . . . . 0.0 110.187 -179.983 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 7' ' ' SER . . . . . . . . . . . . . 84.0 p -69.78 -30.25 67.76 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.28 -0.887 . . . . 0.0 110.18 -179.992 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 8' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -96.68 -21.08 17.82 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.29 -0.882 . . . . 0.0 110.215 179.97 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 9' ' ' LEU . . . . . . . . . . . . . 9.3 tt -69.56 -47.47 63.53 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.32 -0.862 . . . . 0.0 110.179 -179.938 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' C' C ' 10' ' ' VAL . . . . . 0.52 HG23 ' N ' ' C' ' 11' ' ' LYS . 33.6 m -57.63 -40.61 76.18 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.66 0 O-C-N 121.184 -0.948 . . . . 0.0 110.038 179.996 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 11' ' ' LYS . . . . . 0.52 ' N ' HG23 ' C' ' 10' ' ' VAL . 18.4 mttt -59.46 -38.61 81.23 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.299 -0.875 . . . . 0.0 110.038 179.817 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' C' C ' 12' ' ' ASN . . . . . . . . . . . . . 8.0 m-20 . . . . . 0 N--CA 1.491 1.613 0 O-C-N 121.31 -0.869 . . . . 0.0 110.053 179.861 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.338 0 N-CA-C 109.748 -1.341 . . . . 0.0 109.748 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 6.8 tp -53.58 -55.58 24.48 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.131 -1.217 . . . . 0.0 110.211 -179.932 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . 0.748 HG23 HG21 ' C' ' 10' ' ' VAL . 57.0 m -53.53 -56.33 17.92 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.259 -0.901 . . . . 0.0 110.411 -179.851 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -53.75 -41.09 66.75 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.302 -0.874 . . . . 0.0 110.498 -179.698 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -75.19 -27.67 59.73 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.179 -0.951 . . . . 0.0 110.419 -179.761 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 5.3 mp -86.44 -55.38 3.92 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.1 -1.0 . . . . 0.0 110.307 -179.967 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . 0.721 ' O ' HG23 ' A' ' 20' ' ' VAL . 1.6 mt-30 -51.48 -37.73 50.43 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.14 -0.975 . . . . 0.0 109.877 179.694 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . 0.421 ' O ' ' CG ' ' A' ' 21' ' ' GLU . . . -69.18 -55.5 10.35 Favored Glycine 0 N--CA 1.489 2.232 0 N-CA-C 108.988 -1.645 . . . . 0.0 108.988 179.45 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . 0.497 ' O ' HG23 ' A' ' 22' ' ' VAL . 21.5 t80 -50.48 -32.12 17.18 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.349 -1.089 . . . . 0.0 110.088 179.673 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . 0.477 HG21 ' HA ' ' C' ' 6' ' ' ALA . 94.4 m -76.25 -32.45 58.87 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.465 -0.772 . . . . 0.0 110.053 179.936 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.721 HG23 ' O ' ' A' ' 16' ' ' GLN . 95.1 t -78.5 -18.78 13.4 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.62 0 O-C-N 121.296 -0.877 . . . . 0.0 110.673 -179.858 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.44 ' HG3' ' HA ' ' A' ' 18' ' ' TYR . 1.3 mt-10 -84.87 -57.99 2.88 Favored 'General case' 0 N--CA 1.498 1.933 0 O-C-N 121.008 -1.057 . . . . 0.0 109.036 179.91 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.497 HG23 ' O ' ' A' ' 18' ' ' TYR . 39.8 t -51.65 -34.25 15.92 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.477 0 O-C-N 121.643 -0.661 . . . . 0.0 109.94 179.821 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.466 ' HB3' HD21 ' C' ' 2' ' ' LEU . 2.4 mp -76.53 -37.94 55.9 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.389 -0.82 . . . . 0.0 109.774 179.51 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . 0.405 ' HG3' ' O ' ' A' ' 20' ' ' VAL . 0.4 OUTLIER -66.36 -24.67 66.54 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.37 -0.831 . . . . 0.0 110.002 179.874 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' GLN . . . . . 0.405 ' O ' ' C ' ' A' ' 26' ' ' GLN . 0.8 OUTLIER -143.81 59.45 1.37 Allowed 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.265 -0.897 . . . . 0.0 110.212 -179.991 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . 0.405 ' C ' ' O ' ' A' ' 25' ' ' GLN . 6.2 pt20 -34.72 95.56 0.09 OUTLIER Pre-proline 0 N--CA 1.505 2.28 0 CA-C-O 120.959 0.409 . . . . 0.0 111.741 -179.75 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' PRO . . . . . 0.401 ' HD3' ' O ' ' A' ' 25' ' ' GLN . 46.7 Cg_endo -73.72 161.01 42.77 Favored 'Trans proline' 0 C--N 1.312 -1.348 0 O-C-N 123.876 1.461 . . . . 0.0 110.515 -179.614 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 43.5 Cg_endo -70.18 -29.54 21.73 Favored 'Trans proline' 0 C--N 1.31 -1.451 0 O-C-N 123.689 1.363 . . . . 0.0 110.224 179.79 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -142.83 118.46 10.42 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.207 -0.933 . . . . 0.0 110.086 179.712 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.574 ' CD2' HD13 ' B' ' 14' ' ' LEU . 4.9 tp -76.79 -24.58 52.86 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.264 -0.897 . . . . 0.0 109.937 179.934 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.421 HG23 ' H ' ' A' ' 31' ' ' VAL . 43.7 t -52.83 -62.96 0.53 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.61 0 O-C-N 121.313 -0.867 . . . . 0.0 110.05 179.791 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -60.82 -43.03 98.78 Favored 'General case' 0 C--N 1.302 -1.457 0 O-C-N 121.504 -0.748 . . . . 0.0 110.02 179.826 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' PHE . . . . . 0.421 ' CE2' HG22 ' A' ' 22' ' ' VAL . 90.7 t80 -59.79 -43.71 94.27 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.128 -0.983 . . . . 0.0 109.678 179.502 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' ALA . . . . . 0.579 ' HB1' ' CD2' ' B' ' 38' ' ' PHE . . . -54.68 -43.99 72.96 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.311 -0.868 . . . . 0.0 109.735 179.626 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.55 HG13 ' OG1' ' B' ' 39' ' ' THR . 54.5 t -71.77 -49.28 46.58 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.335 0 O-C-N 121.309 -0.87 . . . . 0.0 109.94 179.741 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -62.04 -27.65 69.03 Favored 'General case' 0 N--CA 1.487 1.38 0 O-C-N 121.276 -0.89 . . . . 0.0 109.812 179.829 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 73.7 t80 -72.67 -72.04 0.26 Allowed 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.215 -0.928 . . . . 0.0 110.414 -179.734 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . 0.431 ' CD2' ' HB1' ' B' ' 34' ' ' ALA . 27.3 m-85 -54.63 -47.79 73.04 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.209 -0.932 . . . . 0.0 110.446 -179.796 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' THR . . . . . 0.509 ' OG1' HG13 ' B' ' 35' ' ' VAL . 99.1 m -52.39 -34.19 46.94 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.102 -0.999 . . . . 0.0 109.94 179.84 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 1.9 tpt85 -75.92 -23.05 55.46 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.312 -0.867 . . . . 0.0 109.902 179.645 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.446 ' HA ' HD22 ' A' ' 41' ' ' LEU . 0.2 OUTLIER -65.54 -40.7 93.21 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.253 -0.904 . . . . 0.0 110.189 179.967 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.78 -22.29 34.81 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.321 -0.862 . . . . 0.0 110.431 -179.847 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 -83.25 -31.87 26.74 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.252 -0.905 . . . . 0.0 110.457 -179.725 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 1.682 0 O-C-N 121.213 -0.929 . . . . 0.0 110.764 -179.782 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 46.5 Cg_endo . . . . . 0 N--CA 1.485 0.975 0 N-CA-C 110.626 -0.567 . . . . 0.0 110.626 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' B' B ' 9' ' ' PRO . . . . . . . . . . . . . 45.9 Cg_endo -72.93 -176.61 2.45 Favored 'Trans proline' 0 C--N 1.313 -1.339 0 O-C-N 123.592 1.311 . . . . 0.0 110.386 179.986 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 118.51 -26.97 7.46 Favored Glycine 0 N--CA 1.491 2.337 0 N-CA-C 109.573 -1.411 . . . . 0.0 109.573 179.969 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 11' ' ' LEU . . . . . 0.43 ' HG ' HD23 ' B' ' 15' ' ' LEU . 4.5 tt -73.64 -24.07 59.96 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.279 -1.13 . . . . 0.0 110.314 -179.921 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 23.4 m -57.94 -58.75 7.03 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.227 -0.921 . . . . 0.0 110.119 -179.989 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 4.5 mt-10 -53.9 -44.7 70.74 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.415 -0.803 . . . . 0.0 110.195 -179.975 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 14' ' ' LEU . . . . . 0.574 HD13 ' CD2' ' A' ' 30' ' ' LEU . 6.5 mt -55.71 -57.94 9.92 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.209 -0.932 . . . . 0.0 110.124 179.967 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 15' ' ' LEU . . . . . 0.51 ' HA ' HD13 ' B' ' 15' ' ' LEU . 3.6 mm? -60.86 -37.94 83.86 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.315 -0.866 . . . . 0.0 110.122 179.92 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 16' ' ' GLN . . . . . 0.472 ' O ' HG23 ' B' ' 20' ' ' VAL . 2.3 tt0 -51.94 -52.01 53.09 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.241 -0.912 . . . . 0.0 110.314 179.899 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 17' ' ' GLY . . . . . 0.409 ' O ' ' HG3' ' B' ' 21' ' ' GLU . . . -56.14 -51.53 55.21 Favored Glycine 0 N--CA 1.49 2.249 0 N-CA-C 109.142 -1.583 . . . . 0.0 109.142 179.665 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 18' ' ' TYR . . . . . 0.673 ' OH ' ' HB2' ' B' ' 34' ' ' ALA . 14.8 t80 -53.98 -40.16 66.67 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.332 -1.099 . . . . 0.0 110.083 179.684 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 54.1 m -62.75 -41.4 99.19 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.435 -0.79 . . . . 0.0 110.386 -179.844 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 20' ' ' VAL . . . . . 0.472 HG23 ' O ' ' B' ' 16' ' ' GLN . 48.9 t -65.42 -18.81 24.54 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.66 0 O-C-N 121.148 -0.97 . . . . 0.0 110.378 -179.938 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 21' ' ' GLU . . . . . 0.468 ' HG3' ' HA ' ' B' ' 18' ' ' TYR . 1.4 mt-10 -93.32 -49.84 5.75 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.126 -0.984 . . . . 0.0 109.051 179.793 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 22' ' ' VAL . . . . . 0.604 ' CG1' HD11 ' B' ' 30' ' ' LEU . 85.7 t -58.92 -28.4 38.15 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.461 0 O-C-N 121.719 -0.613 . . . . 0.0 110.02 179.962 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 8.5 tp -85.18 -43.47 13.79 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.26 -0.9 . . . . 0.0 109.891 179.583 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -78.34 -64.16 1.23 Allowed 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.36 -0.838 . . . . 0.0 110.1 179.874 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 25' ' ' GLN . . . . . 0.404 ' HB3' ' HD3' ' B' ' 27' ' ' PRO . 0.0 OUTLIER -55.06 -37.88 67.3 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.323 -0.86 . . . . 0.0 110.127 179.824 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 2.0 tt0 52.16 60.54 13.31 Favored Pre-proline 0 N--CA 1.491 1.61 0 O-C-N 121.246 -0.908 . . . . 0.0 110.306 -179.947 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 27' ' ' PRO . . . . . 0.404 ' HD3' ' HB3' ' B' ' 25' ' ' GLN . 45.2 Cg_endo -71.35 151.5 60.01 Favored 'Trans proline' 0 C--N 1.313 -1.341 0 O-C-N 123.586 1.308 . . . . 0.0 110.505 -179.973 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 45.2 Cg_endo -70.62 -33.25 13.62 Favored 'Trans proline' 0 C--N 1.311 -1.421 0 O-C-N 123.637 1.335 . . . . 0.0 110.392 179.873 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 29' ' ' ASP . . . . . 0.403 ' O ' ' HB2' ' B' ' 33' ' ' PHE . 2.1 m-20 -118.35 117.13 28.24 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.304 -0.873 . . . . 0.0 110.207 -179.998 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 30' ' ' LEU . . . . . 0.604 HD11 ' CG1' ' B' ' 22' ' ' VAL . 0.1 OUTLIER -82.3 -46.49 13.58 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.296 -0.877 . . . . 0.0 110.013 179.9 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 31' ' ' VAL . . . . . 0.58 ' O ' HG23 ' B' ' 35' ' ' VAL . 40.7 t -53.62 -51.83 39.39 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.695 0 O-C-N 121.384 -0.823 . . . . 0.0 109.608 179.569 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 7.9 t0 -67.95 -35.78 78.98 Favored 'General case' 0 C--N 1.303 -1.45 0 O-C-N 121.648 -0.657 . . . . 0.0 109.782 179.812 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 33' ' ' PHE . . . . . 0.403 ' HB2' ' O ' ' B' ' 29' ' ' ASP . 44.0 t80 -67.03 -44.69 79.58 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.23 -0.919 . . . . 0.0 109.396 179.359 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 34' ' ' ALA . . . . . 0.673 ' HB2' ' OH ' ' B' ' 18' ' ' TYR . . . -57.49 -36.89 72.07 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.363 -0.835 . . . . 0.0 109.777 179.604 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 35' ' ' VAL . . . . . 0.58 HG23 ' O ' ' B' ' 31' ' ' VAL . 99.4 t -69.5 -43.91 80.28 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.301 0 O-C-N 121.298 -0.876 . . . . 0.0 110.018 179.79 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -67.28 -30.47 70.35 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.244 -0.91 . . . . 0.0 110.046 179.755 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 37' ' ' TYR . . . . . 0.468 ' CE1' ' OE1' ' B' ' 21' ' ' GLU . 82.9 t80 -73.67 -63.39 1.21 Allowed 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.349 -0.844 . . . . 0.0 110.185 179.977 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 38' ' ' PHE . . . . . 0.579 ' CD2' ' HB1' ' A' ' 34' ' ' ALA . 9.3 m-85 -57.04 -48.7 77.9 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.259 -0.901 . . . . 0.0 110.413 -179.976 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 39' ' ' THR . . . . . 0.55 ' OG1' HG13 ' A' ' 35' ' ' VAL . 57.4 m -53.93 -36.63 62.98 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.139 -0.976 . . . . 0.0 110.013 179.848 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.36 -25.85 61.68 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.292 -0.88 . . . . 0.0 109.923 179.706 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 4.7 mt -72.79 -28.87 62.85 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.254 -0.904 . . . . 0.0 110.025 179.879 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -76.5 -23.46 53.73 Favored 'General case' 0 C--N 1.306 -1.284 0 O-C-N 121.302 -0.874 . . . . 0.0 109.717 179.882 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 43' ' ' GLU . . . . . . . . . . . . . 26.3 mt-10 . . . . . 0 N--CA 1.491 1.599 0 O-C-N 121.297 -0.877 . . . . 0.0 110.188 179.907 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' C' C ' 2' ' ' LEU . . . . . 0.466 HD21 ' HB3' ' A' ' 23' ' ' LEU . 5.5 mp . . . . . 0 N--CA 1.493 1.688 0 CA-C-O 121.192 0.52 . . . . 0.0 110.585 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 3' ' ' ILE . . . . . . . . . . . . . 19.3 tt -88.27 -18.87 7.92 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.636 0 O-C-N 121.165 -0.96 . . . . 0.0 110.295 179.894 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 4' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -98.35 -9.22 25.68 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.179 -0.951 . . . . 0.0 110.785 -179.892 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 5' ' ' THR . . . . . 0.528 HG22 ' CD1' ' C' ' 9' ' ' LEU . 65.9 m -113.29 -54.12 2.64 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 120.983 -1.073 . . . . 0.0 110.511 -179.807 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 6' ' ' ALA . . . . . 0.477 ' HA ' HG21 ' A' ' 19' ' ' THR . . . -61.76 -56.95 14.14 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.124 -0.985 . . . . 0.0 110.316 -179.785 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 7' ' ' SER . . . . . 0.4 ' O ' ' HB2' ' C' ' 11' ' ' LYS . 47.4 m -65.4 -25.2 67.44 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.224 -0.923 . . . . 0.0 110.339 -179.857 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 8' ' ' SER . . . . . . . . . . . . . 1.1 t -82.87 -39.49 21.54 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.206 -0.934 . . . . 0.0 110.403 -179.916 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' C' C ' 9' ' ' LEU . . . . . 0.528 ' CD1' HG22 ' C' ' 5' ' ' THR . 29.7 mt -61.06 -55.39 33.17 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.207 -0.933 . . . . 0.0 110.399 -179.891 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 10' ' ' VAL . . . . . 0.748 HG21 HG23 ' A' ' 12' ' ' THR . 12.3 p -58.17 -38.97 71.19 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.601 0 O-C-N 121.163 -0.961 . . . . 0.0 110.213 -179.941 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 11' ' ' LYS . . . . . 0.515 ' N ' HG13 ' C' ' 10' ' ' VAL . 5.2 tttm -54.76 -57.79 10.13 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.239 -0.913 . . . . 0.0 110.211 -179.927 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' C' C ' 12' ' ' ASN . . . . . . . . . . . . . 2.8 m-20 . . . . . 0 N--CA 1.49 1.567 0 O-C-N 121.161 -0.962 . . . . 0.0 110.064 179.917 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 2.1 t-160 . . . . . 0 N--CA 1.492 1.633 0 CA-C-O 121.288 0.566 . . . . 0.0 110.29 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -151.22 121.42 7.24 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.287 -0.883 . . . . 0.0 110.128 179.947 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 108.91 59.06 0.53 Allowed Glycine 0 N--CA 1.491 2.308 0 N-CA-C 109.577 -1.409 . . . . 0.0 109.577 -179.983 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -162.49 158.42 23.63 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.254 -1.145 . . . . 0.0 110.091 179.932 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 5.8 tp -102.2 155.25 4.98 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.621 0 O-C-N 121.291 -0.881 . . . . 0.0 110.075 179.985 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -135.24 105.75 6.43 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.297 -0.877 . . . . 0.0 110.338 -179.981 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 31.2 mm -101.34 108.72 56.39 Favored Pre-proline 0 N--CA 1.49 1.561 0 O-C-N 121.283 -0.886 . . . . 0.0 109.986 179.849 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 44.5 Cg_endo -70.4 131.01 19.49 Favored 'Trans proline' 0 C--N 1.312 -1.355 0 O-C-N 123.484 1.255 . . . . 0.0 110.467 -179.948 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 48.1 Cg_endo -74.73 155.41 44.25 Favored 'Trans proline' 0 C--N 1.313 -1.332 0 O-C-N 123.531 1.279 . . . . 0.0 110.401 -179.979 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 121.68 -23.99 7.3 Favored Glycine 0 N--CA 1.49 2.238 0 N-CA-C 109.498 -1.441 . . . . 0.0 109.498 -179.922 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.676 HD22 HD11 ' A' ' 15' ' ' LEU . 0.8 OUTLIER -76.0 -21.98 56.32 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.232 -1.158 . . . . 0.0 110.099 179.937 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 92.6 m -74.07 -37.35 64.26 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.236 -0.915 . . . . 0.0 110.213 -179.97 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -82.04 -47.46 12.6 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.367 -0.833 . . . . 0.0 110.208 179.986 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -53.45 -41.72 66.41 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.177 -0.952 . . . . 0.0 110.115 179.86 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.891 HD22 HD11 ' B' ' 15' ' ' LEU . 71.0 mt -71.48 -37.53 71.29 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.191 -0.943 . . . . 0.0 109.989 179.789 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . 0.723 ' O ' HG23 ' A' ' 20' ' ' VAL . 0.0 OUTLIER -64.38 -34.13 77.46 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.275 -0.891 . . . . 0.0 110.137 179.893 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -67.43 -45.23 80.38 Favored Glycine 0 N--CA 1.491 2.315 0 N-CA-C 109.218 -1.553 . . . . 0.0 109.218 179.721 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . 0.629 ' OH ' ' HB2' ' A' ' 34' ' ' ALA . 20.4 t80 -63.6 -47.22 82.33 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.346 -1.091 . . . . 0.0 109.697 179.581 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 59.4 m -57.42 -27.1 62.1 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.329 -0.857 . . . . 0.0 110.139 179.715 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.723 HG23 ' O ' ' A' ' 16' ' ' GLN . 46.1 t -74.74 -73.91 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.59 0 O-C-N 121.396 -0.815 . . . . 0.0 110.316 -179.959 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.469 ' OE1' ' CE1' ' A' ' 37' ' ' TYR . 10.3 pt-20 -44.7 -44.32 9.05 Favored 'General case' 0 N--CA 1.497 1.898 0 O-C-N 121.482 -0.761 . . . . 0.0 111.319 -179.443 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.588 HG23 ' O ' ' A' ' 18' ' ' TYR . 89.6 t -55.21 -50.84 61.08 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.638 0 O-C-N 120.96 -1.087 . . . . 0.0 110.188 179.969 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.53 HD13 HD11 ' C' ' 2' ' ' LEU . 88.8 mt -77.34 -3.64 41.05 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.319 -0.863 . . . . 0.0 110.892 -179.734 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -106.72 -52.78 2.72 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 120.923 -1.111 . . . . 0.0 110.388 -179.919 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 3.3 tp-100 -78.89 -24.98 43.83 Favored 'General case' 0 C--N 1.306 -1.322 0 O-C-N 121.278 -0.889 . . . . 0.0 109.831 -179.999 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 2.7 mt-30 52.77 70.85 1.64 Allowed Pre-proline 0 N--CA 1.491 1.59 0 O-C-N 121.192 -0.942 . . . . 0.0 110.091 179.996 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 45.4 Cg_endo -70.3 159.7 52.08 Favored 'Trans proline' 0 C--N 1.31 -1.485 0 O-C-N 123.67 1.353 . . . . 0.0 110.5 -179.95 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 44.4 Cg_endo -71.22 -30.4 15.95 Favored 'Trans proline' 0 C--N 1.311 -1.402 0 O-C-N 123.761 1.4 . . . . 0.0 110.278 179.96 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -140.26 116.01 10.23 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.267 -0.896 . . . . 0.0 110.17 179.864 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 16.7 tp -67.45 -38.73 84.92 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.221 -0.924 . . . . 0.0 109.955 179.972 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 42.6 t -55.06 -66.55 0.26 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.632 0 O-C-N 121.379 -0.825 . . . . 0.0 109.837 179.796 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -56.78 -34.63 67.81 Favored 'General case' 0 N--CA 1.487 1.406 0 O-C-N 121.48 -0.763 . . . . 0.0 109.819 179.735 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 46.1 t80 -64.18 -47.71 78.76 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.269 -0.895 . . . . 0.0 109.609 179.337 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.629 ' HB2' ' OH ' ' A' ' 18' ' ' TYR . . . -52.53 -32.07 38.7 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.369 -0.832 . . . . 0.0 110.132 179.762 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.471 HG13 ' OG1' ' B' ' 39' ' ' THR . 58.5 t -74.86 -39.04 45.0 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.388 0 O-C-N 121.379 -0.826 . . . . 0.0 110.356 -179.963 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 39.5 mm-40 -72.23 -32.0 66.33 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.148 -0.97 . . . . 0.0 110.479 -179.763 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . 0.469 ' CE1' ' OE1' ' A' ' 21' ' ' GLU . 34.1 t80 -73.37 -68.88 0.46 Allowed 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.256 -0.902 . . . . 0.0 110.594 -179.686 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . 0.471 ' CD2' ' O ' ' A' ' 34' ' ' ALA . 24.1 m-85 -50.28 -49.51 53.16 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.207 -0.933 . . . . 0.0 110.665 -179.565 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . 0.464 ' OG1' HG13 ' B' ' 35' ' ' VAL . 45.5 m -52.35 -40.51 62.05 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.151 -0.968 . . . . 0.0 109.941 179.912 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 12.0 mtt85 -74.93 -27.0 60.03 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.253 -0.904 . . . . 0.0 109.717 179.562 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -58.23 -32.38 68.27 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.317 -0.865 . . . . 0.0 109.745 179.655 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.417 ' NH2' ' OD1' ' B' ' 32' ' ' ASP . 5.0 ttp180 -53.09 -43.42 66.77 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.385 -0.822 . . . . 0.0 110.158 179.945 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 5.5 mt-10 -75.32 -30.88 60.46 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.327 -0.858 . . . . 0.0 110.468 -179.748 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -56.86 -75.99 0.04 OUTLIER 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.185 -0.947 . . . . 0.0 110.663 -179.787 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -49.54 157.51 0.52 Allowed 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.404 -0.81 . . . . 0.0 110.731 -179.118 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.493 1.678 0 CA-C-O 117.88 -1.057 . . . . 0.0 110.22 -179.948 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 1' ' ' HIS . . . . . . . . . . . . . 3.7 m170 . . . . . 0 N--CA 1.492 1.644 0 CA-C-O 121.085 0.469 . . . . 0.0 110.263 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 2' ' ' MET . . . . . . . . . . . . . 2.5 ttm -62.62 155.95 24.68 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.278 -0.888 . . . . 0.0 110.206 -179.996 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 3' ' ' GLY . . . . . . . . . . . . . . . 108.11 -122.85 6.87 Favored Glycine 0 N--CA 1.491 2.304 0 N-CA-C 109.51 -1.436 . . . . 0.0 109.51 179.985 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 4' ' ' HIS . . . . . . . . . . . . . 1.2 t-80 -165.16 -65.72 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.218 -1.166 . . . . 0.0 110.222 -179.951 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 5' ' ' ILE . . . . . . . . . . . . . 35.5 mm -117.22 148.89 19.67 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.622 0 O-C-N 121.253 -0.904 . . . . 0.0 110.206 179.929 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 6' ' ' GLN . . . . . . . . . . . . . 5.2 mt-30 -137.19 179.93 6.1 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.232 -0.918 . . . . 0.0 110.338 179.998 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 7' ' ' ILE . . . . . 0.485 HD11 HD12 ' C' ' 2' ' ' LEU . 38.6 mm -53.16 109.36 1.44 Allowed Pre-proline 0 N--CA 1.492 1.66 0 O-C-N 121.285 -0.884 . . . . 0.0 110.394 -179.839 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 47.8 Cg_endo -72.6 134.94 23.11 Favored 'Trans proline' 0 C--N 1.313 -1.315 0 O-C-N 123.562 1.296 . . . . 0.0 110.671 179.997 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 9' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_endo -76.82 165.21 28.95 Favored 'Trans proline' 0 C--N 1.313 -1.34 0 O-C-N 123.594 1.312 . . . . 0.0 110.378 179.848 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 108.65 -26.09 17.21 Favored Glycine 0 N--CA 1.491 2.33 0 N-CA-C 109.93 -1.268 . . . . 0.0 109.93 179.64 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . 0.626 HD23 HD23 ' B' ' 15' ' ' LEU . 0.4 OUTLIER -80.2 -26.8 39.04 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.16 -1.2 . . . . 0.0 110.267 -179.89 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 88.8 m -68.53 -36.99 79.61 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.194 -0.941 . . . . 0.0 110.344 179.993 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -74.27 -40.48 62.3 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.28 -0.888 . . . . 0.0 110.111 179.923 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 14' ' ' LEU . . . . . 0.44 HD23 ' HA ' ' B' ' 14' ' ' LEU . 3.2 mt -62.68 -37.6 87.1 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.183 -0.948 . . . . 0.0 110.055 179.786 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . 0.891 HD11 HD22 ' A' ' 15' ' ' LEU . 1.3 mm? -72.84 -49.07 32.45 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.324 -0.86 . . . . 0.0 110.054 179.859 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 16' ' ' GLN . . . . . 0.793 ' O ' HG23 ' B' ' 20' ' ' VAL . 2.5 mt-30 -55.52 -37.54 68.04 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.282 -0.886 . . . . 0.0 110.013 179.789 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 17' ' ' GLY . . . . . . . . . . . . . . . -62.59 -40.29 98.95 Favored Glycine 0 N--CA 1.489 2.224 0 N-CA-C 109.0 -1.64 . . . . 0.0 109.0 179.769 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 18' ' ' TYR . . . . . 0.621 ' OH ' ' HB2' ' B' ' 34' ' ' ALA . 34.1 t80 -71.17 -53.71 13.53 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.304 -1.116 . . . . 0.0 109.722 179.572 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 90.6 m -51.1 -27.07 7.48 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.239 -0.913 . . . . 0.0 110.185 179.721 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 20' ' ' VAL . . . . . 0.793 HG23 ' O ' ' B' ' 16' ' ' GLN . 55.7 t -73.88 -75.44 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.651 0 O-C-N 121.316 -0.865 . . . . 0.0 109.829 179.669 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 21' ' ' GLU . . . . . 0.443 ' HG3' ' N ' ' B' ' 22' ' ' VAL . 11.0 pt-20 -47.09 -41.5 17.28 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.459 -0.775 . . . . 0.0 110.793 -179.849 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 22' ' ' VAL . . . . . 0.72 ' CG1' HD11 ' B' ' 30' ' ' LEU . 78.7 t -55.94 -44.9 79.59 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.575 0 O-C-N 121.176 -0.953 . . . . 0.0 110.116 179.912 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -73.22 -26.18 61.03 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.196 -0.94 . . . . 0.0 110.4 -179.86 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.55 -55.47 4.11 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.113 -0.992 . . . . 0.0 110.425 -179.868 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 25' ' ' GLN . . . . . 0.437 ' O ' ' CG ' ' B' ' 26' ' ' GLN . 5.6 mp0 -65.67 -20.35 66.26 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.147 -0.97 . . . . 0.0 110.657 -179.708 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 26' ' ' GLN . . . . . 0.437 ' CG ' ' O ' ' B' ' 25' ' ' GLN . 12.7 pt20 36.45 55.22 2.91 Favored Pre-proline 0 N--CA 1.507 2.38 0 O-C-N 122.058 -0.401 . . . . 0.0 111.534 -179.791 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 27' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_endo -68.09 152.02 76.82 Favored 'Trans proline' 0 C--N 1.31 -1.488 0 O-C-N 123.678 1.357 . . . . 0.0 110.526 -179.798 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 44.3 Cg_endo -71.06 -14.41 31.96 Favored 'Trans proline' 0 C--N 1.312 -1.392 0 O-C-N 123.755 1.397 . . . . 0.0 110.503 -179.958 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 12.5 m-20 -137.46 111.2 8.16 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.066 -1.021 . . . . 0.0 110.282 179.915 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 30' ' ' LEU . . . . . 0.72 HD11 ' CG1' ' B' ' 22' ' ' VAL . 0.2 OUTLIER -76.73 -34.19 58.11 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.345 -0.847 . . . . 0.0 109.492 179.641 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 21.6 t -61.93 -50.8 78.65 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.603 0 CA-C-O 121.658 0.742 . . . . 0.0 109.468 179.484 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 32' ' ' ASP . . . . . 0.417 ' OD1' ' NH2' ' A' ' 42' ' ' ARG . 10.5 t70 -67.61 -30.25 69.78 Favored 'General case' 0 C--N 1.303 -1.456 0 O-C-N 121.643 -0.661 . . . . 0.0 109.97 179.775 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 33' ' ' PHE . . . . . . . . . . . . . 83.5 t80 -72.68 -39.48 67.03 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.273 -0.892 . . . . 0.0 109.501 179.284 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 34' ' ' ALA . . . . . 0.621 ' HB2' ' OH ' ' B' ' 18' ' ' TYR . . . -65.83 -38.35 88.67 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.376 -0.827 . . . . 0.0 109.938 179.633 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 35' ' ' VAL . . . . . 0.464 HG13 ' OG1' ' A' ' 39' ' ' THR . 96.8 t -73.8 -32.58 35.01 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.325 0 O-C-N 121.309 -0.87 . . . . 0.0 110.195 179.886 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -80.13 -30.18 38.98 Favored 'General case' 0 N--CA 1.487 1.42 0 O-C-N 121.262 -0.899 . . . . 0.0 109.592 179.892 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 37' ' ' TYR . . . . . . . . . . . . . 16.5 t80 -76.96 -64.14 1.2 Allowed 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.18 -0.95 . . . . 0.0 110.205 -179.957 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 12.7 m-85 -51.95 -50.27 61.54 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.255 -0.903 . . . . 0.0 110.444 -179.845 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 39' ' ' THR . . . . . 0.471 ' OG1' HG13 ' A' ' 35' ' ' VAL . 43.1 m -53.19 -40.98 64.82 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.2 -0.938 . . . . 0.0 110.031 179.853 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 16.6 ttt85 -72.13 -25.27 61.66 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.266 -0.896 . . . . 0.0 110.076 179.766 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -57.68 -55.27 37.02 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.262 -0.899 . . . . 0.0 110.089 179.856 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.93 -36.22 26.95 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.16 -0.963 . . . . 0.0 110.633 -179.958 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 43' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -75.77 -21.01 57.83 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.211 -0.931 . . . . 0.0 110.371 -179.844 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -71.18 -69.3 0.38 Allowed 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.171 -0.956 . . . . 0.0 110.28 179.949 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 45' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.16 -30.68 7.1 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.56 -0.713 . . . . 0.0 110.684 -179.233 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.491 1.617 0 CA-C-O 118.024 -0.988 . . . . 0.0 110.174 -179.979 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 1' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.618 0 CA-C-O 121.331 0.586 . . . . 0.0 110.185 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 2' ' ' LEU . . . . . 0.53 HD11 HD13 ' A' ' 23' ' ' LEU . 4.0 tp -130.03 -43.87 1.19 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.237 -0.914 . . . . 0.0 110.222 179.933 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 3' ' ' ILE . . . . . . . . . . . . . 1.8 pp -63.09 -23.16 32.55 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.591 0 O-C-N 121.339 -0.851 . . . . 0.0 110.239 -179.977 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 4' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 -78.6 -32.35 47.54 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.235 -0.916 . . . . 0.0 110.329 -179.918 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 5' ' ' THR . . . . . . . . . . . . . 93.1 m -74.82 -34.57 62.38 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.221 -0.924 . . . . 0.0 110.262 -179.958 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 6' ' ' ALA . . . . . 0.436 ' HA ' ' HB2' ' C' ' 9' ' ' LEU . . . -77.7 -37.92 48.48 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.243 -0.911 . . . . 0.0 110.306 -179.895 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 7' ' ' SER . . . . . . . . . . . . . 31.9 m -52.44 -69.85 0.1 Allowed 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.157 -0.964 . . . . 0.0 110.204 -179.885 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 8' ' ' SER . . . . . . . . . . . . . 1.9 m -58.68 -24.54 61.52 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.262 -0.899 . . . . 0.0 110.265 179.908 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 9' ' ' LEU . . . . . 0.436 ' HB2' ' HA ' ' C' ' 6' ' ' ALA . 0.4 OUTLIER -52.24 -43.14 64.15 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.248 -0.907 . . . . 0.0 110.301 -179.923 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' C' C ' 10' ' ' VAL . . . . . . . . . . . . . 71.1 t -71.95 -30.11 35.73 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.595 0 O-C-N 121.166 -0.959 . . . . 0.0 110.309 -179.887 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 11' ' ' LYS . . . . . . . . . . . . . 34.4 mmtm -66.05 -48.6 70.51 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.19 -0.944 . . . . 0.0 110.361 -179.901 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 12' ' ' ASN . . . . . . . . . . . . . 28.7 m-80 -65.89 -27.11 67.96 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.288 -0.882 . . . . 0.0 110.262 -179.918 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 13' ' ' ALA . . . . . . . . . . . . . . . -71.32 -41.17 70.22 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.192 -0.943 . . . . 0.0 110.284 -179.958 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 14' ' ' ILE . . . . . . . . . . . . . 91.7 mt -66.86 -46.6 84.86 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.658 0 O-C-N 121.232 -0.917 . . . . 0.0 110.202 -179.943 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 15' ' ' GLN . . . . . 0.42 ' O ' ' N ' ' C' ' 17' ' ' SER . 2.1 mm-40 -58.61 -58.32 9.08 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.153 -0.967 . . . . 0.0 110.249 179.944 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 16' ' ' LEU . . . . . . . . . . . . . 1.4 tp -68.81 65.5 0.13 Allowed 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.415 -0.803 . . . . 0.0 110.175 179.939 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 17' ' ' SER . . . . . 0.42 ' N ' ' O ' ' C' ' 15' ' ' GLN . 7.5 t -175.06 -57.74 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.178 -0.952 . . . . 0.0 110.144 -179.864 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 18' ' ' ILE . . . . . 0.423 ' O ' ' N ' ' C' ' 20' ' ' GLN . 1.3 pp -80.84 -20.45 11.4 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.615 0 O-C-N 121.288 -0.882 . . . . 0.0 110.381 -179.909 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 19' ' ' GLU . . . . . 0.626 ' O ' HG23 ' C' ' 22' ' ' VAL . 14.2 tt0 -70.68 64.41 0.3 Allowed 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.247 -0.908 . . . . 0.0 109.251 179.409 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 20' ' ' GLN . . . . . 0.423 ' N ' ' O ' ' C' ' 18' ' ' ILE . 0.2 OUTLIER 55.53 25.99 8.54 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.257 -0.902 . . . . 0.0 109.135 -179.003 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' C' C ' 21' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER 56.18 47.97 18.35 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.526 -0.734 . . . . 0.0 109.818 -179.599 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 22' ' ' VAL . . . . . 0.626 HG23 ' O ' ' C' ' 19' ' ' GLU . 69.5 t . . . . . 0 N--CA 1.491 1.622 0 CA-C-O 118.005 -0.998 . . . . 0.0 110.002 -179.987 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 2.6 t60 . . . . . 0 N--CA 1.492 1.629 0 CA-C-O 121.232 0.539 . . . . 0.0 110.2 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 3.2 mtt -99.47 40.55 1.21 Allowed 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.279 -0.888 . . . . 0.0 110.075 179.862 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 76.19 109.9 0.12 Allowed Glycine 0 N--CA 1.49 2.284 0 N-CA-C 109.506 -1.437 . . . . 0.0 109.506 -179.903 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 8.9 p-80 -119.96 27.52 8.63 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.248 -1.148 . . . . 0.0 110.295 -179.959 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -128.1 151.52 35.02 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.591 0 O-C-N 121.179 -0.951 . . . . 0.0 110.491 -179.79 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 16.2 tt0 -146.65 63.52 1.2 Allowed 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.262 -0.899 . . . . 0.0 110.185 179.845 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 8.2 mt -114.19 104.16 54.86 Favored Pre-proline 0 N--CA 1.491 1.591 0 O-C-N 121.266 -0.896 . . . . 0.0 110.3 179.994 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 46.7 Cg_endo -72.19 124.2 9.81 Favored 'Trans proline' 0 C--N 1.311 -1.421 0 O-C-N 123.633 1.333 . . . . 0.0 110.52 179.996 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 47.4 Cg_endo -72.78 157.25 52.17 Favored 'Trans proline' 0 C--N 1.314 -1.254 0 O-C-N 123.522 1.275 . . . . 0.0 110.465 179.88 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 109.48 -26.33 15.03 Favored Glycine 0 N--CA 1.492 2.396 0 N-CA-C 109.608 -1.397 . . . . 0.0 109.608 179.924 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -69.06 -23.14 64.0 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.236 -1.156 . . . . 0.0 110.35 -179.881 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 31.9 m -76.91 -51.15 11.72 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.221 -0.925 . . . . 0.0 110.259 -179.96 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -57.77 -31.71 66.79 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.262 -0.899 . . . . 0.0 110.272 -179.923 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 3.1 mp -72.29 -40.35 67.64 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.357 -0.84 . . . . 0.0 110.282 -179.882 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 5.8 mp -77.79 -52.76 8.4 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.284 -0.885 . . . . 0.0 110.246 -179.94 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . 0.435 ' O ' HG23 ' A' ' 20' ' ' VAL . 1.0 OUTLIER -51.79 -44.27 63.38 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.185 -0.947 . . . . 0.0 110.257 179.956 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -58.38 -47.76 87.82 Favored Glycine 0 N--CA 1.49 2.297 0 N-CA-C 109.149 -1.58 . . . . 0.0 109.149 179.729 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . 0.645 ' O ' HG23 ' A' ' 22' ' ' VAL . 46.8 t80 -61.15 -47.19 87.37 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.271 -1.135 . . . . 0.0 109.629 179.466 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 7.9 m -56.58 -36.11 68.97 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.361 -0.837 . . . . 0.0 110.147 179.743 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.435 HG23 ' O ' ' A' ' 16' ' ' GLN . 41.6 t -67.15 -71.95 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.674 0 O-C-N 121.293 -0.879 . . . . 0.0 110.216 -179.981 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 5.4 pt-20 -46.58 -49.11 19.33 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.357 -0.839 . . . . 0.0 111.425 -179.392 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.746 HG11 HD11 ' B' ' 11' ' ' LEU . 93.5 t -50.8 -44.28 26.16 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.717 0 O-C-N 120.774 -1.204 . . . . 0.0 110.529 -179.777 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.42 ' HB3' HD11 ' C' ' 2' ' ' LEU . 0.2 OUTLIER -73.26 -25.1 60.56 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.218 -0.926 . . . . 0.0 110.252 -179.987 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -76.49 -69.39 0.51 Allowed 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.255 -0.903 . . . . 0.0 110.417 -179.929 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . 0.407 ' HG3' ' HD3' ' A' ' 27' ' ' PRO . 2.7 pt20 -71.94 -33.67 68.42 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.126 -0.984 . . . . 0.0 110.285 -179.845 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 52.13 81.38 0.26 Allowed Pre-proline 0 N--CA 1.492 1.662 0 O-C-N 121.275 -0.891 . . . . 0.0 110.18 179.965 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . 0.407 ' HD3' ' HG3' ' A' ' 25' ' ' GLN . 44.8 Cg_endo -71.82 162.3 42.4 Favored 'Trans proline' 0 C--N 1.311 -1.442 0 O-C-N 123.727 1.383 . . . . 0.0 110.528 -179.82 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo -70.14 -26.4 25.81 Favored 'Trans proline' 0 C--N 1.311 -1.44 0 O-C-N 123.803 1.423 . . . . 0.0 110.142 179.828 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 9.6 m-20 -139.15 112.22 8.0 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.361 -0.837 . . . . 0.0 109.726 179.588 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 3.5 tp -74.7 -33.49 62.44 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.32 -0.862 . . . . 0.0 110.29 -179.7 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.417 ' H ' HG23 ' A' ' 31' ' ' VAL . 43.2 t -50.78 -54.66 9.12 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.714 0 O-C-N 121.275 -0.89 . . . . 0.0 110.112 179.812 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 1.5 t70 -66.19 -44.18 84.7 Favored 'General case' 0 C--N 1.301 -1.533 0 O-C-N 121.565 -0.709 . . . . 0.0 110.148 179.911 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 36.7 t80 -58.18 -50.3 74.0 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.082 -1.011 . . . . 0.0 109.756 179.532 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.416 ' HB2' ' OH ' ' A' ' 18' ' ' TYR . . . -49.22 -39.48 30.04 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.42 -0.8 . . . . 0.0 110.515 179.891 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.556 HG13 ' OG1' ' B' ' 39' ' ' THR . 90.3 t -73.88 -38.85 51.01 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.366 0 O-C-N 121.221 -0.924 . . . . 0.0 110.423 -179.883 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -74.17 -20.56 60.17 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.201 -0.937 . . . . 0.0 110.548 -179.661 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 26.6 t80 -75.65 -59.61 2.67 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.191 -0.943 . . . . 0.0 110.466 -179.899 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . 0.407 ' CD2' ' HB1' ' B' ' 34' ' ' ALA . 23.6 m-85 -67.44 -48.69 66.5 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.225 -0.922 . . . . 0.0 110.51 -179.824 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . 0.484 ' OG1' HG13 ' B' ' 35' ' ' VAL . 94.8 m -50.42 -41.56 52.62 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.174 -0.954 . . . . 0.0 110.29 -179.943 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 1.5 ttt180 -70.25 -25.2 63.26 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.177 -0.952 . . . . 0.0 110.13 179.697 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -62.54 -34.23 76.5 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.258 -0.901 . . . . 0.0 109.954 179.888 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.421 ' HD3' HG12 ' B' ' 31' ' ' VAL . 0.0 OUTLIER -54.64 -37.49 65.73 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.352 -0.843 . . . . 0.0 110.275 179.92 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -84.01 -25.53 29.87 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.217 -0.927 . . . . 0.0 110.4 -179.887 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -57.66 -78.52 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.169 -0.957 . . . . 0.0 110.345 -179.983 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER 45.33 -152.78 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.68 -0.637 . . . . 0.0 111.013 -179.695 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 3.2 ptt180 . . . . . 0 N--CA 1.492 1.635 0 CA-C-O 118.062 -0.971 . . . . 0.0 110.175 179.945 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 1' ' ' HIS . . . . . 0.44 ' CD2' ' N ' ' B' ' 1' ' ' HIS . 6.1 p80 . . . . . 0 N--CA 1.492 1.671 0 CA-C-O 121.189 0.518 . . . . 0.0 110.24 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 2' ' ' MET . . . . . . . . . . . . . 3.9 ttt -134.67 -62.21 0.74 Allowed 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.276 -0.89 . . . . 0.0 110.388 -179.834 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 3' ' ' GLY . . . . . . . . . . . . . . . -103.96 -164.88 24.97 Favored Glycine 0 N--CA 1.49 2.286 0 N-CA-C 109.684 -1.367 . . . . 0.0 109.684 -179.833 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 4' ' ' HIS . . . . . . . . . . . . . 9.8 p-80 -169.01 -172.38 1.54 Allowed 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.364 -1.08 . . . . 0.0 110.205 -179.99 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 5' ' ' ILE . . . . . 0.406 HG13 ' N ' ' B' ' 6' ' ' GLN . 9.8 tp -124.57 164.79 22.53 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.548 0 O-C-N 121.237 -0.914 . . . . 0.0 110.26 -179.936 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 6' ' ' GLN . . . . . 0.406 ' N ' HG13 ' B' ' 5' ' ' ILE . 12.0 tp60 -139.14 79.42 1.72 Allowed 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.225 -0.922 . . . . 0.0 110.198 -179.983 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 7' ' ' ILE . . . . . 0.618 ' CD1' HG21 ' C' ' 5' ' ' THR . 14.4 mt -146.69 108.59 4.08 Favored Pre-proline 0 N--CA 1.491 1.601 0 O-C-N 121.239 -0.913 . . . . 0.0 110.198 -179.983 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 47.7 Cg_endo -72.44 127.32 12.43 Favored 'Trans proline' 0 C--N 1.311 -1.409 0 O-C-N 123.591 1.311 . . . . 0.0 110.349 179.927 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 9' ' ' PRO . . . . . . . . . . . . . 45.3 Cg_endo -72.53 177.8 7.01 Favored 'Trans proline' 0 C--N 1.313 -1.34 0 O-C-N 123.522 1.275 . . . . 0.0 110.49 179.967 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 99.28 -40.28 2.49 Favored Glycine 0 N--CA 1.491 2.3 0 N-CA-C 109.473 -1.451 . . . . 0.0 109.473 -179.943 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . 0.746 HD11 HG11 ' A' ' 22' ' ' VAL . 0.2 OUTLIER -63.22 -23.94 67.65 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.306 -1.114 . . . . 0.0 110.26 179.994 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 95.5 m -62.94 -61.38 2.43 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.223 -0.923 . . . . 0.0 110.214 179.929 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 -52.3 -32.81 39.38 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.342 -0.849 . . . . 0.0 110.248 -179.979 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 14.1 mt -66.59 -56.94 8.41 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.285 -0.884 . . . . 0.0 110.429 -179.852 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . 0.657 HD11 ' CD2' ' B' ' 11' ' ' LEU . 14.3 mt -66.03 -48.95 69.41 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.218 -0.926 . . . . 0.0 110.27 -179.943 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -52.02 -47.49 64.98 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.139 -0.976 . . . . 0.0 110.028 179.826 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 17' ' ' GLY . . . . . 0.404 ' O ' ' HB ' ' B' ' 20' ' ' VAL . . . -55.14 -42.54 82.04 Favored Glycine 0 N--CA 1.49 2.3 0 N-CA-C 109.066 -1.614 . . . . 0.0 109.066 179.508 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 18' ' ' TYR . . . . . 0.453 ' O ' HG23 ' B' ' 22' ' ' VAL . 19.0 t80 -64.87 -45.27 86.73 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.323 -1.104 . . . . 0.0 109.561 179.365 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 19' ' ' THR . . . . . 0.603 HG21 ' O ' ' C' ' 13' ' ' ALA . 6.6 m -58.28 -24.08 58.36 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.424 -0.798 . . . . 0.0 110.022 179.675 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 20' ' ' VAL . . . . . 0.404 ' HB ' ' O ' ' B' ' 17' ' ' GLY . 51.2 t -78.07 -74.07 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.608 0 O-C-N 121.351 -0.843 . . . . 0.0 110.413 -179.828 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -45.28 -44.62 11.52 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.464 -0.772 . . . . 0.0 111.194 -179.305 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 22' ' ' VAL . . . . . 0.502 HG22 ' CE2' ' B' ' 33' ' ' PHE . 86.0 t -59.24 -47.17 91.25 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.6 0 O-C-N 120.947 -1.096 . . . . 0.0 109.737 179.808 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 3.0 tp -72.65 -19.45 61.44 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.293 -0.879 . . . . 0.0 110.038 179.594 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 24' ' ' ARG . . . . . 0.6 ' HD3' HG11 ' C' ' 22' ' ' VAL . 0.0 OUTLIER -81.5 -59.07 2.75 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.297 -0.877 . . . . 0.0 110.33 -179.913 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 25' ' ' GLN . . . . . 0.438 ' HG3' ' N ' ' B' ' 26' ' ' GLN . 0.0 OUTLIER -89.82 -23.01 21.82 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.206 -0.934 . . . . 0.0 110.586 -179.653 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 26' ' ' GLN . . . . . 0.438 ' N ' ' HG3' ' B' ' 25' ' ' GLN . 7.6 mt-30 47.96 81.78 0.25 Allowed Pre-proline 0 N--CA 1.494 1.76 0 O-C-N 121.159 -0.963 . . . . 0.0 110.674 179.752 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 27' ' ' PRO . . . . . . . . . . . . . 44.9 Cg_endo -73.09 166.55 29.71 Favored 'Trans proline' 0 C--N 1.31 -1.483 0 O-C-N 123.615 1.324 . . . . 0.0 110.598 -179.815 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 44.3 Cg_endo -70.52 -49.17 0.47 Allowed 'Trans proline' 0 C--N 1.311 -1.41 0 O-C-N 123.749 1.394 . . . . 0.0 110.176 179.785 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 10.0 m-20 -119.37 116.87 27.08 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.237 -0.914 . . . . 0.0 110.081 179.718 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 30' ' ' LEU . . . . . 0.448 ' HG ' ' HH ' ' B' ' 18' ' ' TYR . 0.6 OUTLIER -71.46 -29.26 64.65 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.27 -0.894 . . . . 0.0 110.444 -179.708 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 31' ' ' VAL . . . . . 0.421 HG12 ' HD3' ' A' ' 42' ' ' ARG . 43.4 t -49.9 -65.39 0.24 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.784 0 O-C-N 121.189 -0.945 . . . . 0.0 110.054 179.83 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 4.3 t0 -56.54 -46.54 80.59 Favored 'General case' 0 C--N 1.302 -1.492 0 O-C-N 121.466 -0.771 . . . . 0.0 109.961 179.679 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 33' ' ' PHE . . . . . 0.502 ' CE2' HG22 ' B' ' 22' ' ' VAL . 67.7 t80 -54.83 -47.35 74.21 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.174 -0.954 . . . . 0.0 109.832 179.68 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 34' ' ' ALA . . . . . 0.417 ' HB2' ' OH ' ' B' ' 18' ' ' TYR . . . -56.1 -40.19 73.31 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.324 -0.86 . . . . 0.0 109.935 179.74 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 35' ' ' VAL . . . . . 0.484 HG13 ' OG1' ' A' ' 39' ' ' THR . 76.9 t -77.32 -45.65 29.31 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.323 0 O-C-N 121.306 -0.871 . . . . 0.0 109.82 179.77 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -61.23 -36.26 79.48 Favored 'General case' 0 N--CA 1.487 1.403 0 O-C-N 121.3 -0.875 . . . . 0.0 109.329 179.495 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 37' ' ' TYR . . . . . . . . . . . . . 61.6 t80 -68.9 -59.34 3.13 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.295 -0.878 . . . . 0.0 110.141 179.872 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 12.1 m-85 -64.19 -49.57 71.52 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.257 -0.902 . . . . 0.0 110.576 -179.65 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 39' ' ' THR . . . . . 0.556 ' OG1' HG13 ' A' ' 35' ' ' VAL . 94.2 m -51.53 -27.7 11.54 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.1 -1.0 . . . . 0.0 110.056 179.953 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -75.49 -35.65 60.76 Favored 'General case' 0 N--CA 1.489 1.505 0 O-C-N 121.295 -0.878 . . . . 0.0 109.77 179.528 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.02 -27.83 68.61 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.389 -0.82 . . . . 0.0 110.301 179.926 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.26 -28.28 63.02 Favored 'General case' 0 N--CA 1.486 1.343 0 O-C-N 121.263 -0.898 . . . . 0.0 110.04 -179.922 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 43' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -104.88 13.56 30.95 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.125 -0.984 . . . . 0.0 110.565 179.937 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -120.42 -70.44 0.79 Allowed 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.107 -0.996 . . . . 0.0 110.369 179.956 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 45' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -49.96 102.86 0.04 OUTLIER 'General case' 0 N--CA 1.488 1.435 0 O-C-N 121.525 -0.734 . . . . 0.0 110.608 -179.147 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.588 0 CA-C-O 117.948 -1.025 . . . . 0.0 110.226 -179.981 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 1' ' ' LEU . . . . . 0.438 ' O ' ' N ' ' C' ' 3' ' ' ILE . 0.8 OUTLIER . . . . . 0 N--CA 1.492 1.643 0 CA-C-O 120.906 0.384 . . . . 0.0 110.634 . . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 2' ' ' LEU . . . . . 0.42 HD11 ' HB3' ' A' ' 23' ' ' LEU . 0.1 OUTLIER 63.96 -72.87 0.05 Allowed 'General case' 0 N--CA 1.498 1.972 0 O-C-N 121.346 -0.846 . . . . 0.0 110.553 -179.938 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' C' C ' 3' ' ' ILE . . . . . 0.438 ' N ' ' O ' ' C' ' 1' ' ' LEU . 2.9 mp -55.48 -23.37 13.97 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.61 0 O-C-N 121.083 -1.011 . . . . 0.0 110.321 -179.888 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 4' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -103.62 20.49 17.87 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.278 -0.889 . . . . 0.0 110.306 -179.883 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 5' ' ' THR . . . . . 0.618 HG21 ' CD1' ' B' ' 7' ' ' ILE . 78.7 m -138.34 -47.93 0.53 Allowed 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.189 -0.944 . . . . 0.0 110.078 179.825 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 6' ' ' ALA . . . . . 0.581 ' O ' HG22 ' C' ' 10' ' ' VAL . . . -61.39 -36.18 79.55 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.235 -0.916 . . . . 0.0 110.065 179.877 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 7' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -60.79 -45.43 94.4 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.28 -0.888 . . . . 0.0 110.117 179.884 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 8' ' ' SER . . . . . . . . . . . . . 6.3 t -70.92 -29.62 65.72 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.276 -0.89 . . . . 0.0 110.095 179.8 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 9' ' ' LEU . . . . . . . . . . . . . 3.2 tp -68.68 -62.8 1.23 Allowed 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.277 -0.89 . . . . 0.0 110.158 179.945 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 10' ' ' VAL . . . . . 0.742 ' O ' HD12 ' C' ' 14' ' ' ILE . 35.2 m -53.85 -27.78 16.07 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.628 0 O-C-N 121.314 -0.866 . . . . 0.0 110.173 -179.94 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 11' ' ' LYS . . . . . . . . . . . . . 1.8 tppt? -70.37 -38.72 74.8 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.291 -0.881 . . . . 0.0 110.255 -179.951 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 12' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 -81.94 -25.83 34.54 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.241 -0.912 . . . . 0.0 110.139 179.937 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 13' ' ' ALA . . . . . 0.603 ' O ' HG21 ' B' ' 19' ' ' THR . . . -69.75 -29.88 67.34 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.255 -0.903 . . . . 0.0 110.176 179.868 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 14' ' ' ILE . . . . . 0.742 HD12 ' O ' ' C' ' 10' ' ' VAL . 19.6 mt -87.17 -42.26 15.19 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.616 0 O-C-N 121.289 -0.882 . . . . 0.0 110.127 179.988 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 15' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -65.87 -80.92 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.249 -0.907 . . . . 0.0 110.246 -179.969 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 16' ' ' LEU . . . . . 0.409 ' HA ' HD22 ' C' ' 16' ' ' LEU . 0.1 OUTLIER 52.79 28.84 6.78 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.2 -0.937 . . . . 0.0 110.179 -179.948 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' C' C ' 17' ' ' SER . . . . . . . . . . . . . 6.2 t 53.08 62.11 2.84 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.135 -0.978 . . . . 0.0 110.061 -179.901 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 18' ' ' ILE . . . . . 0.524 HG22 ' O ' ' C' ' 18' ' ' ILE . 55.1 mt 54.45 40.37 0.31 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.694 0 O-C-N 121.328 -0.858 . . . . 0.0 110.084 -179.737 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 19' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER 51.89 55.58 9.07 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 120.935 -1.103 . . . . 0.0 109.02 -179.194 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 20' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 54.84 24.79 6.03 Favored 'General case' 0 N--CA 1.49 1.57 0 N-CA-C 108.382 -0.97 . . . . 0.0 108.382 -177.811 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 21' ' ' LEU . . . . . 0.633 HD23 ' O ' ' C' ' 21' ' ' LEU . 1.6 tt 46.32 42.04 9.87 Favored 'General case' 0 N--CA 1.49 1.55 0 CA-C-O 121.887 0.851 . . . . 0.0 109.999 -179.238 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 22' ' ' VAL . . . . . 0.6 HG11 ' HD3' ' B' ' 24' ' ' ARG . 8.7 p . . . . . 0 N--CA 1.489 1.492 0 CA-C-O 117.993 -1.004 . . . . 0.0 110.676 -179.96 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 99.3 m-70 . . . . . 0 N--CA 1.492 1.673 0 CA-C-O 121.248 0.547 . . . . 0.0 110.172 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 7.3 ttp 52.96 69.82 0.65 Allowed 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.242 -0.911 . . . . 0.0 110.063 -179.847 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 90.4 21.3 38.27 Favored Glycine 0 N--CA 1.491 2.339 0 N-CA-C 109.588 -1.405 . . . . 0.0 109.588 -179.844 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 84.2 t60 -119.91 -34.15 3.8 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.276 -1.132 . . . . 0.0 109.936 179.912 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 8.8 tp -101.26 143.39 14.45 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.625 0 O-C-N 121.344 -0.847 . . . . 0.0 109.989 179.844 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -121.81 -150.35 0.45 Allowed 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.211 -0.931 . . . . 0.0 110.226 -179.845 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . 0.434 HD13 ' N ' ' A' ' 8' ' ' PRO . 0.2 OUTLIER -47.21 123.6 8.44 Favored Pre-proline 0 N--CA 1.489 1.508 0 O-C-N 121.357 -0.84 . . . . 0.0 110.579 -179.734 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.434 ' N ' HD13 ' A' ' 7' ' ' ILE . 48.8 Cg_endo -74.13 136.42 22.33 Favored 'Trans proline' 0 C--N 1.314 -1.255 0 O-C-N 123.441 1.232 . . . . 0.0 110.448 -179.632 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 47.9 Cg_endo -76.08 152.2 35.61 Favored 'Trans proline' 0 C--N 1.312 -1.393 0 O-C-N 123.546 1.287 . . . . 0.0 110.357 179.885 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 120.57 -29.53 5.85 Favored Glycine 0 N--CA 1.492 2.414 0 N-CA-C 109.615 -1.394 . . . . 0.0 109.615 179.955 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 22.3 tp -64.36 -23.15 67.19 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.239 -1.154 . . . . 0.0 110.338 -179.904 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 7.5 m -63.25 -62.81 1.45 Allowed 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.218 -0.926 . . . . 0.0 110.231 -179.987 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 31.6 tt0 -54.77 -30.49 56.79 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.352 -0.843 . . . . 0.0 110.223 -179.99 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -72.65 -49.82 29.22 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.205 -0.935 . . . . 0.0 110.222 179.93 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -70.7 -56.58 6.08 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.141 -0.974 . . . . 0.0 110.113 179.944 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . 0.583 ' HG3' HG11 ' C' ' 10' ' ' VAL . 0.0 OUTLIER -54.38 -41.67 69.49 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.147 -0.971 . . . . 0.0 109.646 179.607 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -55.57 -41.03 80.53 Favored Glycine 0 N--CA 1.489 2.205 0 N-CA-C 109.248 -1.541 . . . . 0.0 109.248 179.554 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . 0.559 ' O ' HG23 ' A' ' 22' ' ' VAL . 63.7 t80 -67.08 -43.15 83.35 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.296 -1.12 . . . . 0.0 109.736 179.624 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 1.6 m -54.41 -29.19 48.16 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.198 -0.939 . . . . 0.0 109.88 179.557 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 45.0 t -76.86 -71.68 0.26 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.593 0 O-C-N 121.407 -0.808 . . . . 0.0 110.238 -179.955 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.409 ' HG3' ' N ' ' A' ' 22' ' ' VAL . 10.0 pt-20 -45.31 -43.09 10.43 Favored 'General case' 0 N--CA 1.497 1.903 0 O-C-N 121.447 -0.783 . . . . 0.0 111.094 -179.489 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.559 HG23 ' O ' ' A' ' 18' ' ' TYR . 71.2 t -55.94 -54.07 31.06 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.581 0 O-C-N 121.001 -1.062 . . . . 0.0 109.596 179.706 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.676 ' HB3' HD11 ' C' ' 2' ' ' LEU . 4.0 mt -66.73 -23.79 66.15 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.311 -0.868 . . . . 0.0 109.976 179.713 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . 0.482 ' NH1' HD13 ' C' ' 2' ' ' LEU . 0.0 OUTLIER -81.34 -71.15 0.49 Allowed 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.258 -0.901 . . . . 0.0 109.944 179.899 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -55.18 -35.26 64.63 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.381 -0.824 . . . . 0.0 110.199 179.907 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER 51.25 64.61 7.77 Favored Pre-proline 0 N--CA 1.491 1.612 0 O-C-N 121.173 -0.954 . . . . 0.0 110.272 -179.944 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 46.2 Cg_endo -70.69 159.44 52.7 Favored 'Trans proline' 0 C--N 1.31 -1.452 0 O-C-N 123.76 1.4 . . . . 0.0 110.475 -179.953 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 43.7 Cg_endo -70.63 -23.03 27.29 Favored 'Trans proline' 0 C--N 1.31 -1.461 0 O-C-N 123.713 1.375 . . . . 0.0 110.149 179.876 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . 0.425 ' OD2' ' CB ' ' A' ' 32' ' ' ASP . 32.8 p-10 -142.4 115.26 8.7 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.384 -0.823 . . . . 0.0 109.917 179.697 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.415 ' CD1' ' OH ' ' A' ' 18' ' ' TYR . 10.8 tp -70.61 -34.93 72.66 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.273 -0.892 . . . . 0.0 110.318 -179.691 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 42.4 t -49.83 -59.9 0.92 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.832 0 O-C-N 121.261 -0.899 . . . . 0.0 109.925 179.714 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . 0.425 ' CB ' ' OD2' ' A' ' 29' ' ' ASP . 6.4 t0 -60.1 -46.1 90.72 Favored 'General case' 0 C--N 1.301 -1.503 0 O-C-N 121.619 -0.675 . . . . 0.0 109.972 179.801 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 53.3 t80 -56.56 -48.79 76.57 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.169 -0.957 . . . . 0.0 109.568 179.524 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -55.06 -43.45 73.85 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.329 -0.857 . . . . 0.0 109.659 179.579 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.43 HG13 ' OG1' ' B' ' 39' ' ' THR . 69.2 t -72.34 -23.42 21.34 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.36 0 O-C-N 121.486 -0.759 . . . . 0.0 109.878 179.712 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -81.7 -44.07 17.61 Favored 'General case' 0 C--N 1.303 -1.418 0 O-C-N 121.23 -0.919 . . . . 0.0 109.782 -179.749 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 51.5 t80 -62.71 -61.47 2.39 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.182 -0.949 . . . . 0.0 110.752 -179.63 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 29.7 m-85 -57.51 -52.95 63.32 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.241 -0.912 . . . . 0.0 111.123 -179.321 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . 0.662 ' OG1' HG13 ' B' ' 35' ' ' VAL . 22.8 m -49.73 -41.79 44.55 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 121.065 -1.022 . . . . 0.0 110.195 -179.656 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 34.4 ttt-85 -71.59 -20.87 61.94 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.187 -0.946 . . . . 0.0 109.843 179.473 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -63.49 -43.21 97.91 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.302 -0.874 . . . . 0.0 110.242 179.998 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.498 ' HD2' HG12 ' B' ' 31' ' ' VAL . 0.0 OUTLIER -49.44 -25.71 2.77 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.198 -0.939 . . . . 0.0 110.22 179.771 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.589 ' O ' ' HB3' ' A' ' 44' ' ' ALA . 1.0 OUTLIER -106.29 -58.26 1.94 Allowed 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.433 -0.792 . . . . 0.0 109.777 179.611 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . 0.589 ' HB3' ' O ' ' A' ' 43' ' ' GLU . . . 67.05 -61.52 0.33 Allowed 'General case' 0 N--CA 1.501 2.098 0 O-C-N 121.624 -0.672 . . . . 0.0 110.73 179.835 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.45 ' N ' ' O ' ' A' ' 43' ' ' GLU . 0.0 OUTLIER -53.23 169.54 0.11 Allowed 'General case' 0 C--N 1.299 -1.616 0 O-C-N 121.512 -0.742 . . . . 0.0 110.51 -178.998 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.493 1.679 0 CA-C-O 118.036 -0.983 . . . . 0.0 110.286 179.975 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 1' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.491 1.614 0 CA-C-O 121.206 0.527 . . . . 0.0 110.262 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 2' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -94.9 48.39 1.19 Allowed 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.274 -0.891 . . . . 0.0 110.117 179.949 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 3' ' ' GLY . . . . . . . . . . . . . . . 67.04 168.7 3.51 Favored Glycine 0 N--CA 1.49 2.258 0 N-CA-C 109.459 -1.456 . . . . 0.0 109.459 -179.923 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 4' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -101.84 -10.7 19.65 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.322 -1.104 . . . . 0.0 110.636 -179.906 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 5' ' ' ILE . . . . . 0.404 HG23 HD12 ' B' ' 5' ' ' ILE . 47.6 mm -111.64 158.12 12.22 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.612 0 O-C-N 121.044 -1.035 . . . . 0.0 110.368 -179.941 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 6' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -152.41 -167.46 2.76 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.247 -0.908 . . . . 0.0 110.28 179.954 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 7' ' ' ILE . . . . . 0.669 HG13 HD21 ' A' ' 23' ' ' LEU . 4.3 mp -80.18 114.56 47.89 Favored Pre-proline 0 N--CA 1.492 1.632 0 O-C-N 121.151 -0.968 . . . . 0.0 109.806 179.929 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_endo -70.99 136.61 30.12 Favored 'Trans proline' 0 C--N 1.313 -1.32 0 O-C-N 123.482 1.254 . . . . 0.0 110.518 -179.802 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 9' ' ' PRO . . . . . . . . . . . . . 49.3 Cg_endo -78.61 2.17 8.39 Favored 'Trans proline' 0 C--N 1.313 -1.294 0 O-C-N 123.661 1.348 . . . . 0.0 111.418 -179.943 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . -72.03 -20.2 78.82 Favored Glycine 0 N--CA 1.491 2.3 0 N-CA-C 109.664 -1.374 . . . . 0.0 109.664 179.982 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . 0.503 HD11 HG11 ' A' ' 22' ' ' VAL . 0.4 OUTLIER -81.12 -16.92 51.66 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.272 -1.134 . . . . 0.0 110.519 -179.891 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 12' ' ' THR . . . . . 0.525 ' OG1' HD11 ' C' ' 9' ' ' LEU . 78.4 m -73.12 -36.21 66.68 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.074 -1.016 . . . . 0.0 110.374 -179.881 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -75.06 -25.23 58.49 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.277 -0.889 . . . . 0.0 110.156 179.999 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -74.02 -47.56 36.14 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.277 -0.89 . . . . 0.0 110.166 179.922 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 84.5 mt -64.08 -49.78 70.94 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.224 -0.922 . . . . 0.0 110.021 179.882 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 16' ' ' GLN . . . . . 0.535 ' OE1' HD22 ' C' ' 16' ' ' LEU . 0.0 OUTLIER -56.04 -42.35 76.43 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.264 -0.898 . . . . 0.0 109.871 179.764 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 17' ' ' GLY . . . . . 0.406 ' O ' ' CG ' ' B' ' 21' ' ' GLU . . . -57.92 -46.47 92.42 Favored Glycine 0 N--CA 1.49 2.257 0 N-CA-C 109.271 -1.532 . . . . 0.0 109.271 179.774 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 18' ' ' TYR . . . . . 0.492 ' OH ' ' HB2' ' B' ' 34' ' ' ALA . 39.4 t80 -63.38 -30.64 71.74 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.313 -1.11 . . . . 0.0 109.957 179.726 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 62.4 m -74.85 -27.69 60.37 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.343 -0.848 . . . . 0.0 110.237 179.993 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 20' ' ' VAL . . . . . 0.477 HG23 ' O ' ' B' ' 16' ' ' GLN . 87.1 t -78.1 -19.56 13.63 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.616 0 O-C-N 121.166 -0.958 . . . . 0.0 110.28 179.941 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 21' ' ' GLU . . . . . 0.456 ' HG3' ' HA ' ' B' ' 18' ' ' TYR . 0.6 OUTLIER -86.38 -45.79 10.86 Favored 'General case' 0 N--CA 1.499 1.991 0 O-C-N 121.138 -0.976 . . . . 0.0 108.895 179.605 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 22' ' ' VAL . . . . . 0.422 HG23 ' O ' ' B' ' 18' ' ' TYR . 78.2 t -63.31 -25.67 39.0 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.541 0 CA-C-O 121.308 0.575 . . . . 0.0 110.056 179.978 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 23' ' ' LEU . . . . . 0.44 HD23 ' HA ' ' B' ' 23' ' ' LEU . 4.4 mt -84.22 -31.6 24.95 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.26 -0.9 . . . . 0.0 110.09 179.777 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -87.6 -40.27 14.36 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.26 -0.9 . . . . 0.0 110.442 -179.847 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 1.8 tt0 -88.44 -40.85 13.17 Favored 'General case' 0 C--N 1.306 -1.303 0 O-C-N 121.28 -0.887 . . . . 0.0 110.298 -179.711 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 52.8 67.36 3.94 Favored Pre-proline 0 N--CA 1.492 1.628 0 O-C-N 121.318 -0.864 . . . . 0.0 110.211 179.945 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 27' ' ' PRO . . . . . . . . . . . . . 45.1 Cg_endo -70.94 167.45 25.95 Favored 'Trans proline' 0 C--N 1.312 -1.383 0 O-C-N 123.571 1.301 . . . . 0.0 110.558 -179.955 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 44.3 Cg_endo -71.26 -41.89 2.28 Favored 'Trans proline' 0 C--N 1.312 -1.359 0 O-C-N 123.734 1.386 . . . . 0.0 110.38 179.826 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 10.9 m-20 -123.22 120.88 34.45 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.222 -0.924 . . . . 0.0 110.164 179.935 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 2.7 tp -78.65 -31.55 46.86 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.289 -0.882 . . . . 0.0 109.898 179.747 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 31' ' ' VAL . . . . . 0.498 HG12 ' HD2' ' A' ' 42' ' ' ARG . 46.8 t -52.63 -67.38 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.678 0 O-C-N 121.278 -0.889 . . . . 0.0 109.967 179.787 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 1.6 t0 -55.5 -41.53 73.18 Favored 'General case' 0 C--N 1.303 -1.456 0 O-C-N 121.39 -0.819 . . . . 0.0 109.764 179.709 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 33' ' ' PHE . . . . . . . . . . . . . 59.4 t80 -58.2 -47.72 82.57 Favored 'General case' 0 N--CA 1.488 1.446 0 O-C-N 121.169 -0.957 . . . . 0.0 109.369 179.32 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 34' ' ' ALA . . . . . 0.492 ' HB2' ' OH ' ' B' ' 18' ' ' TYR . . . -58.54 -36.92 74.63 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.346 -0.846 . . . . 0.0 109.512 179.313 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 35' ' ' VAL . . . . . 0.662 HG13 ' OG1' ' A' ' 39' ' ' THR . 89.1 t -75.2 -51.43 21.38 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.32 0 O-C-N 121.471 -0.768 . . . . 0.0 109.994 179.704 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 36' ' ' GLU . . . . . 0.409 ' O ' ' HB2' ' B' ' 40' ' ' ARG . 3.0 mm-40 -58.96 -35.79 73.74 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.268 -0.895 . . . . 0.0 110.116 179.995 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 37' ' ' TYR . . . . . 0.447 ' CE1' ' OE2' ' B' ' 21' ' ' GLU . 43.2 t80 -62.29 -73.64 0.1 Allowed 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.295 -0.878 . . . . 0.0 110.107 179.957 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 20.9 m-85 -51.88 -45.36 64.09 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.242 -0.911 . . . . 0.0 110.521 -179.888 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 39' ' ' THR . . . . . 0.43 ' OG1' HG13 ' A' ' 35' ' ' VAL . 45.2 m -53.16 -28.53 26.67 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.174 -0.954 . . . . 0.0 110.032 179.835 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 40' ' ' ARG . . . . . 0.409 ' HB2' ' O ' ' B' ' 36' ' ' GLU . 0.0 OUTLIER -82.57 -30.61 29.52 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.292 -0.88 . . . . 0.0 109.953 179.686 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -59.69 -36.14 75.88 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.311 -0.868 . . . . 0.0 110.123 179.922 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 42' ' ' ARG . . . . . 0.415 ' NH1' ' OD2' ' A' ' 32' ' ' ASP . 0.0 OUTLIER -52.11 -38.0 55.94 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.221 -0.924 . . . . 0.0 110.194 179.934 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 43' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -80.05 -18.78 49.19 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.272 -0.893 . . . . 0.0 110.276 179.896 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -65.04 -72.19 0.16 Allowed 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.204 -0.935 . . . . 0.0 110.377 -179.958 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 45' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.62 113.54 0.85 Allowed 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.462 -0.774 . . . . 0.0 110.587 -179.348 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.616 0 CA-C-O 118.001 -1.0 . . . . 0.0 110.239 -179.905 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 1' ' ' LEU . . . . . 0.435 HD23 ' HB2' ' C' ' 4' ' ' GLU . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.657 0 CA-C-O 121.192 0.52 . . . . 0.0 110.248 . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 2' ' ' LEU . . . . . 0.676 HD11 ' HB3' ' A' ' 23' ' ' LEU . 0.1 OUTLIER -174.43 -37.46 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.234 -0.916 . . . . 0.0 110.392 -179.881 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' C' C ' 3' ' ' ILE . . . . . . . . . . . . . 10.5 mt -63.44 -28.86 45.86 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.651 0 O-C-N 121.294 -0.879 . . . . 0.0 110.316 -179.918 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 4' ' ' GLU . . . . . 0.435 ' HB2' HD23 ' C' ' 1' ' ' LEU . 26.2 mt-10 -94.92 -20.23 19.58 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.175 -0.953 . . . . 0.0 110.352 -179.921 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 5' ' ' THR . . . . . . . . . . . . . 9.2 m -98.56 -19.67 17.47 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.29 -0.881 . . . . 0.0 110.448 -179.83 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 6' ' ' ALA . . . . . 0.449 ' O ' HG23 ' C' ' 10' ' ' VAL . . . -77.27 -58.95 2.99 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.088 -1.007 . . . . 0.0 110.445 -179.826 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 7' ' ' SER . . . . . . . . . . . . . 2.9 t -62.19 -36.24 81.29 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.179 -0.951 . . . . 0.0 110.537 -179.718 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 8' ' ' SER . . . . . . . . . . . . . 4.2 t -65.17 -42.35 93.75 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.134 -0.978 . . . . 0.0 110.341 -179.863 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 9' ' ' LEU . . . . . 0.525 HD11 ' OG1' ' B' ' 12' ' ' THR . 3.3 tt -70.03 -48.56 57.46 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.205 -0.934 . . . . 0.0 110.236 179.991 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 10' ' ' VAL . . . . . 0.583 HG11 ' HG3' ' A' ' 16' ' ' GLN . 87.7 t -58.77 -56.34 17.31 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.669 0 O-C-N 121.221 -0.925 . . . . 0.0 110.317 -179.923 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 11' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -52.2 -40.02 60.98 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.28 -0.887 . . . . 0.0 110.474 -179.795 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 12' ' ' ASN . . . . . . . . . . . . . 28.7 t30 -65.5 -29.32 69.96 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.174 -0.954 . . . . 0.0 110.381 -179.895 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 13' ' ' ALA . . . . . . . . . . . . . . . -79.57 -26.75 41.25 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.212 -0.93 . . . . 0.0 110.369 -179.915 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 14' ' ' ILE . . . . . 0.409 ' HA ' HD13 ' C' ' 14' ' ' ILE . 38.9 mm -89.21 -17.62 8.14 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.613 0 O-C-N 121.259 -0.901 . . . . 0.0 110.544 -179.995 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 15' ' ' GLN . . . . . . . . . . . . . 7.6 mm100 -94.21 -80.6 0.39 Allowed 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.048 -1.033 . . . . 0.0 110.348 -179.958 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 16' ' ' LEU . . . . . 0.535 HD22 ' OE1' ' B' ' 16' ' ' GLN . 0.6 OUTLIER 52.11 -161.7 0.09 Allowed 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.264 -0.898 . . . . 0.0 110.149 -179.819 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' C' C ' 17' ' ' SER . . . . . . . . . . . . . 32.9 p -84.69 4.39 32.81 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.183 -0.948 . . . . 0.0 110.691 -179.889 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 18' ' ' ILE . . . . . . . . . . . . . 82.7 mt -81.35 -45.84 20.56 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.609 0 O-C-N 121.022 -1.049 . . . . 0.0 110.121 179.84 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 19' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -98.77 35.61 1.82 Allowed 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.313 -0.867 . . . . 0.0 110.26 -179.978 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 20' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -142.38 -42.48 0.33 Allowed 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.229 -0.919 . . . . 0.0 110.265 -179.999 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 21' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -79.51 -50.31 10.94 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.307 -0.871 . . . . 0.0 110.145 -179.959 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 22' ' ' VAL . . . . . . . . . . . . . 98.5 t . . . . . 0 N--CA 1.491 1.582 0 CA-C-O 117.975 -1.012 . . . . 0.0 110.25 -179.981 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 57.8 m80 . . . . . 0 N--CA 1.492 1.665 0 CA-C-O 121.216 0.531 . . . . 0.0 110.277 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 55.29 172.44 0.03 OUTLIER 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.282 -0.886 . . . . 0.0 110.432 179.804 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -64.27 147.75 50.89 Favored Glycine 0 N--CA 1.49 2.252 0 N-CA-C 109.646 -1.382 . . . . 0.0 109.646 -179.973 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . 0.601 ' C ' HD12 ' A' ' 5' ' ' ILE . 0.2 OUTLIER -146.07 120.69 9.79 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.287 -1.125 . . . . 0.0 110.051 179.925 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.601 HD12 ' C ' ' A' ' 4' ' ' HIS . 4.6 mp -143.5 110.37 1.58 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.526 0 O-C-N 121.214 -0.929 . . . . 0.0 110.445 -179.874 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 1.8 mt-30 -124.24 37.61 4.37 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 121.361 -0.837 . . . . 0.0 109.931 179.73 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . 0.622 HG23 ' O ' ' A' ' 7' ' ' ILE . 3.3 tp -106.64 93.05 7.98 Favored Pre-proline 0 N--CA 1.487 1.388 0 O-C-N 121.333 -0.854 . . . . 0.0 110.323 -179.789 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 47.6 Cg_endo -73.46 112.56 3.56 Favored 'Trans proline' 0 C--N 1.312 -1.353 0 O-C-N 123.558 1.294 . . . . 0.0 110.512 179.903 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 49.3 Cg_endo -76.5 160.36 35.27 Favored 'Trans proline' 0 C--N 1.313 -1.331 0 O-C-N 123.562 1.296 . . . . 0.0 110.638 -179.99 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 135.76 -25.49 3.23 Favored Glycine 0 N--CA 1.491 2.333 0 N-CA-C 109.65 -1.38 . . . . 0.0 109.65 179.795 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 49.0 tp -58.52 -27.2 64.3 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.294 -1.121 . . . . 0.0 110.538 -179.889 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . 0.709 HG23 HG23 ' C' ' 10' ' ' VAL . 86.6 m -68.37 -30.78 69.8 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.218 -0.926 . . . . 0.0 110.74 -179.658 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -76.8 -39.74 50.42 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.119 -0.988 . . . . 0.0 110.507 -179.66 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.719 HD21 ' CE1' ' A' ' 38' ' ' PHE . 7.7 tt -71.46 -36.76 71.31 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.13 -0.981 . . . . 0.0 110.511 -179.741 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.434 HD12 ' HA ' ' A' ' 15' ' ' LEU . 2.0 tp -65.55 -57.43 8.22 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.182 -0.949 . . . . 0.0 110.587 -179.708 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . 0.501 ' O ' HG23 ' A' ' 20' ' ' VAL . 0.9 OUTLIER -50.58 -34.88 27.48 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.129 -0.982 . . . . 0.0 110.242 -179.901 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -62.89 -50.13 66.42 Favored Glycine 0 N--CA 1.49 2.236 0 N-CA-C 109.245 -1.542 . . . . 0.0 109.245 179.651 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . 0.451 ' HA ' ' HG3' ' A' ' 21' ' ' GLU . 30.6 t80 -56.12 -41.46 75.33 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.244 -1.15 . . . . 0.0 110.119 179.807 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 57.6 m -61.52 -37.67 84.57 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.321 -0.862 . . . . 0.0 110.59 -179.803 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.501 HG23 ' O ' ' A' ' 16' ' ' GLN . 98.5 t -69.12 -22.09 25.82 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.72 0 O-C-N 121.264 -0.897 . . . . 0.0 110.437 -179.705 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.451 ' HG3' ' HA ' ' A' ' 18' ' ' TYR . 1.2 mt-10 -88.18 -48.48 7.67 Favored 'General case' 0 N--CA 1.499 2.016 0 O-C-N 121.209 -0.932 . . . . 0.0 108.818 179.666 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.447 HG23 ' O ' ' A' ' 18' ' ' TYR . 64.7 t -48.98 -31.63 4.2 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.473 0 O-C-N 121.75 -0.594 . . . . 0.0 110.339 179.936 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 1.036 HD22 HD13 ' C' ' 2' ' ' LEU . 0.1 OUTLIER -85.76 -40.15 16.38 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.268 -0.895 . . . . 0.0 110.158 -179.956 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -74.81 -52.66 10.83 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.169 -0.957 . . . . 0.0 110.289 179.933 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . 0.434 ' O ' ' CG ' ' A' ' 26' ' ' GLN . 3.8 mp0 -73.89 -19.4 60.72 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.225 -0.922 . . . . 0.0 110.603 -179.914 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . 0.434 ' CG ' ' O ' ' A' ' 25' ' ' GLN . 21.5 pt20 36.64 61.38 3.31 Favored Pre-proline 0 N--CA 1.506 2.343 0 O-C-N 121.937 -0.477 . . . . 0.0 111.912 -179.936 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . 0.504 ' HG3' ' CD2' ' A' ' 33' ' ' PHE . 44.1 Cg_endo -71.08 154.69 62.32 Favored 'Trans proline' 0 C--N 1.311 -1.4 0 O-C-N 123.564 1.297 . . . . 0.0 110.537 -179.957 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 46.2 Cg_endo -72.77 -42.69 1.05 Allowed 'Trans proline' 0 C--N 1.312 -1.387 0 O-C-N 123.734 1.386 . . . . 0.0 110.37 179.876 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 14.2 m-20 -113.85 122.89 48.4 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.31 -0.868 . . . . 0.0 110.14 179.887 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.7 HD21 HD12 ' B' ' 11' ' ' LEU . 0.2 OUTLIER -75.48 -47.11 28.57 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.169 -0.957 . . . . 0.0 110.195 179.971 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 39.9 t -50.28 -60.98 0.69 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.786 0 O-C-N 121.177 -0.952 . . . . 0.0 109.797 179.702 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 5.1 t0 -58.86 -39.51 81.56 Favored 'General case' 0 C--N 1.302 -1.49 0 O-C-N 121.653 -0.655 . . . . 0.0 109.808 179.526 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . 0.504 ' CD2' ' HG3' ' A' ' 27' ' ' PRO . 36.9 t80 -62.54 -46.58 87.74 Favored 'General case' 0 N--CA 1.488 1.436 0 O-C-N 121.163 -0.961 . . . . 0.0 109.526 179.44 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -56.13 -40.94 74.56 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.388 -0.82 . . . . 0.0 110.123 179.79 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.407 HG13 ' OG1' ' B' ' 39' ' ' THR . 97.9 t -64.74 -43.95 96.51 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.337 0 O-C-N 121.151 -0.968 . . . . 0.0 110.146 -179.979 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -63.04 -35.0 78.77 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.28 -0.887 . . . . 0.0 110.103 179.859 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . 0.419 ' CE1' ' OE2' ' A' ' 21' ' ' GLU . 20.4 t80 -69.08 -60.42 2.37 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.233 -0.917 . . . . 0.0 110.367 -179.841 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . 0.719 ' CE1' HD21 ' A' ' 14' ' ' LEU . 28.5 m-85 -61.68 -49.2 77.43 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.282 -0.886 . . . . 0.0 110.322 -179.791 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . 0.493 ' OG1' HG13 ' B' ' 35' ' ' VAL . 55.7 m -51.79 -41.39 61.65 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.195 -0.941 . . . . 0.0 110.22 179.965 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 2.9 mtp180 -72.61 -30.22 64.17 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.235 -0.916 . . . . 0.0 109.963 179.766 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.443 ' O ' HD23 ' A' ' 41' ' ' LEU . 1.4 tt -56.73 -40.89 76.51 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.353 -0.842 . . . . 0.0 110.085 179.914 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -51.54 -29.02 15.4 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.227 -0.92 . . . . 0.0 110.438 179.999 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 -106.86 -2.93 20.86 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.232 -0.917 . . . . 0.0 110.88 -179.931 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -59.31 -75.86 0.05 Allowed 'General case' 0 N--CA 1.493 1.684 0 O-C-N 120.947 -1.095 . . . . 0.0 110.28 179.928 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 1.2 mmt-85 -51.44 -79.4 0.02 OUTLIER 'General case' 0 N--CA 1.487 1.403 0 O-C-N 121.544 -0.722 . . . . 0.0 110.3 -179.504 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 5.8 ptp180 . . . . . 0 N--CA 1.49 1.575 0 CA-C-O 118.049 -0.977 . . . . 0.0 110.104 179.721 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 1' ' ' HIS . . . . . . . . . . . . . 1.2 t-80 . . . . . 0 N--CA 1.491 1.589 0 CA-C-O 121.243 0.544 . . . . 0.0 110.251 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 2' ' ' MET . . . . . . . . . . . . . 3.3 mtm -92.03 -52.52 4.67 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.219 -0.925 . . . . 0.0 110.156 -179.989 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 3' ' ' GLY . . . . . . . . . . . . . . . -66.45 -121.21 0.01 OUTLIER Glycine 0 N--CA 1.489 2.208 0 N-CA-C 109.495 -1.442 . . . . 0.0 109.495 179.888 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 4' ' ' HIS . . . . . . . . . . . . . 43.5 t60 -168.13 57.63 0.06 Allowed 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.218 -1.166 . . . . 0.0 110.28 179.923 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 5' ' ' ILE . . . . . 0.4 HG22 ' H ' ' B' ' 5' ' ' ILE . 2.0 tp -101.97 145.15 12.25 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.599 0 O-C-N 121.216 -0.928 . . . . 0.0 110.09 179.934 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 6' ' ' GLN . . . . . . . . . . . . . 1.8 tp60 -142.06 67.85 1.32 Allowed 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.271 -0.893 . . . . 0.0 110.345 -179.877 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 7' ' ' ILE . . . . . . . . . . . . . 48.3 mm -121.57 98.37 46.06 Favored Pre-proline 0 N--CA 1.491 1.577 0 O-C-N 121.26 -0.9 . . . . 0.0 110.091 179.853 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 46.0 Cg_endo -71.82 113.33 3.62 Favored 'Trans proline' 0 C--N 1.31 -1.499 0 O-C-N 123.676 1.356 . . . . 0.0 110.417 -179.878 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 9' ' ' PRO . . . . . . . . . . . . . 48.2 Cg_endo -72.81 -174.88 1.65 Allowed 'Trans proline' 0 C--N 1.312 -1.345 0 O-C-N 123.559 1.294 . . . . 0.0 110.273 179.931 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 102.59 -38.28 3.28 Favored Glycine 0 N--CA 1.491 2.328 0 N-CA-C 109.296 -1.522 . . . . 0.0 109.296 -179.985 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . 0.7 HD12 HD21 ' A' ' 30' ' ' LEU . 0.7 OUTLIER -59.03 -36.49 75.08 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.327 -1.102 . . . . 0.0 110.09 179.962 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 22.1 m -51.93 -63.04 1.27 Allowed 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.234 -0.916 . . . . 0.0 110.302 179.895 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -57.6 -23.34 50.37 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.324 -0.86 . . . . 0.0 110.19 179.943 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 14' ' ' LEU . . . . . 0.561 HD23 ' HE1' ' B' ' 38' ' ' PHE . 0.0 OUTLIER -78.97 -33.74 44.86 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.234 -0.916 . . . . 0.0 110.087 179.965 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . 0.611 HD13 ' HG ' ' B' ' 11' ' ' LEU . 4.9 mp -80.27 -47.13 15.05 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.237 -0.914 . . . . 0.0 110.122 179.963 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 16' ' ' GLN . . . . . 0.761 ' O ' HG23 ' B' ' 20' ' ' VAL . 0.0 OUTLIER -53.73 -45.87 70.66 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.268 -0.895 . . . . 0.0 109.818 179.648 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 17' ' ' GLY . . . . . 0.412 ' O ' ' CG ' ' B' ' 21' ' ' GLU . . . -60.93 -50.96 61.78 Favored Glycine 0 N--CA 1.49 2.247 0 N-CA-C 109.293 -1.523 . . . . 0.0 109.293 179.632 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 18' ' ' TYR . . . . . 0.699 ' O ' HG23 ' B' ' 22' ' ' VAL . 25.8 t80 -53.72 -31.95 50.19 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.322 -1.104 . . . . 0.0 110.103 179.809 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 88.8 m -75.83 -29.31 58.58 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.37 -0.831 . . . . 0.0 110.13 179.949 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 20' ' ' VAL . . . . . 0.761 HG23 ' O ' ' B' ' 16' ' ' GLN . 39.9 t -78.5 -19.58 13.3 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.664 0 O-C-N 121.327 -0.858 . . . . 0.0 110.252 -179.982 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 21' ' ' GLU . . . . . 0.448 ' OE1' ' CE1' ' B' ' 37' ' ' TYR . 1.3 mt-10 -87.07 -42.62 12.93 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.243 -0.911 . . . . 0.0 108.868 179.851 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 22' ' ' VAL . . . . . 0.699 HG23 ' O ' ' B' ' 18' ' ' TYR . 51.9 t -64.52 -29.37 47.16 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.508 0 O-C-N 121.743 -0.598 . . . . 0.0 110.13 -179.918 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 23' ' ' LEU . . . . . 0.576 HD21 HD13 ' A' ' 7' ' ' ILE . 1.4 mt -75.78 -48.13 22.96 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.315 -0.866 . . . . 0.0 110.064 179.798 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 7.1 mpt_? -69.3 -70.68 0.26 Allowed 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.249 -0.907 . . . . 0.0 110.113 179.898 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 1.1 tt0 -51.83 -41.02 61.47 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.237 -0.914 . . . . 0.0 110.408 179.94 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER 52.15 66.21 5.34 Favored Pre-proline 0 N--CA 1.491 1.601 0 O-C-N 121.408 -0.808 . . . . 0.0 110.381 179.945 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 27' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_endo -71.35 159.99 50.05 Favored 'Trans proline' 0 C--N 1.311 -1.44 0 O-C-N 123.638 1.336 . . . . 0.0 110.531 179.873 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 44.7 Cg_endo -71.49 -35.23 8.39 Favored 'Trans proline' 0 C--N 1.311 -1.445 0 O-C-N 123.742 1.39 . . . . 0.0 110.27 179.771 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 29' ' ' ASP . . . . . 0.418 ' OD1' ' N ' ' B' ' 29' ' ' ASP . 38.2 p-10 -132.5 114.53 14.39 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.357 -0.839 . . . . 0.0 110.256 179.722 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 4.2 tp -67.91 -31.34 71.05 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.325 -0.86 . . . . 0.0 110.444 -179.829 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 31' ' ' VAL . . . . . 0.431 ' H ' HG23 ' B' ' 31' ' ' VAL . 44.6 t -49.77 -56.51 3.21 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.751 0 O-C-N 121.174 -0.954 . . . . 0.0 110.088 179.718 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 32' ' ' ASP . . . . . 0.403 ' HB2' ' OD2' ' B' ' 29' ' ' ASP . 0.9 OUTLIER -64.0 -45.63 88.12 Favored 'General case' 0 C--N 1.302 -1.482 0 O-C-N 121.577 -0.702 . . . . 0.0 110.102 179.919 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 33' ' ' PHE . . . . . . . . . . . . . 74.8 t80 -57.56 -40.07 78.1 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.045 -1.034 . . . . 0.0 109.628 179.519 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 34' ' ' ALA . . . . . 0.514 ' HB2' ' OH ' ' B' ' 18' ' ' TYR . . . -60.99 -43.67 98.51 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.338 -0.851 . . . . 0.0 109.992 179.668 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 35' ' ' VAL . . . . . 0.493 HG13 ' OG1' ' A' ' 39' ' ' THR . 58.9 t -70.53 -40.79 77.75 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.289 0 O-C-N 121.251 -0.906 . . . . 0.0 110.072 179.77 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -74.03 -21.58 59.9 Favored 'General case' 0 N--CA 1.487 1.404 0 O-C-N 121.293 -0.879 . . . . 0.0 109.712 179.961 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 37' ' ' TYR . . . . . 0.448 ' CE1' ' OE1' ' B' ' 21' ' ' GLU . 28.3 t80 -79.58 -64.46 1.18 Allowed 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.119 -0.988 . . . . 0.0 110.515 -179.864 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 38' ' ' PHE . . . . . 0.561 ' HE1' HD23 ' B' ' 14' ' ' LEU . 22.8 m-85 -60.04 -46.88 88.06 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.265 -0.897 . . . . 0.0 110.656 -179.613 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 39' ' ' THR . . . . . 0.407 ' OG1' HG13 ' A' ' 35' ' ' VAL . 72.9 m -53.68 -54.89 31.47 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.096 -1.002 . . . . 0.0 110.152 179.952 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 41.8 ttt180 -62.7 -22.62 66.63 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.225 -0.922 . . . . 0.0 110.019 179.688 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -59.67 -51.01 71.63 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.317 -0.864 . . . . 0.0 110.063 179.943 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -50.41 -24.93 3.39 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.22 -0.925 . . . . 0.0 110.545 179.969 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 43' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -102.02 13.49 34.6 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.248 -0.907 . . . . 0.0 110.872 -179.669 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -65.44 -75.05 0.09 Allowed 'General case' 0 N--CA 1.493 1.697 0 O-C-N 120.998 -1.064 . . . . 0.0 110.313 179.868 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 45' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -48.61 -61.88 1.8 Allowed 'General case' 0 N--CA 1.488 1.475 0 O-C-N 121.579 -0.701 . . . . 0.0 110.797 -179.203 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.54 0 CA-C-O 117.975 -1.012 . . . . 0.0 110.383 -179.793 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 1' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.492 1.659 0 CA-C-O 121.251 0.548 . . . . 0.0 110.193 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 2' ' ' LEU . . . . . 1.036 HD13 HD22 ' A' ' 23' ' ' LEU . 67.7 tp -81.96 -21.02 37.41 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.261 -0.899 . . . . 0.0 110.162 -179.96 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 3' ' ' ILE . . . . . . . . . . . . . 47.2 mm -75.71 -36.73 34.42 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.576 0 O-C-N 121.213 -0.929 . . . . 0.0 110.19 -179.969 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 4' ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 -74.98 -3.91 35.12 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.34 -0.85 . . . . 0.0 110.747 -179.971 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 5' ' ' THR . . . . . . . . . . . . . 2.3 p -105.72 -66.58 0.98 Allowed 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.051 -1.03 . . . . 0.0 110.209 -179.915 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 6' ' ' ALA . . . . . . . . . . . . . . . -54.26 -43.78 71.27 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.318 -0.864 . . . . 0.0 110.205 -179.928 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 7' ' ' SER . . . . . 0.53 ' O ' HG12 ' C' ' 10' ' ' VAL . 8.5 t -57.64 -25.31 59.98 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.202 -0.936 . . . . 0.0 110.106 179.951 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 8' ' ' SER . . . . . . . . . . . . . 47.4 t -83.27 -24.5 32.23 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.268 -0.895 . . . . 0.0 110.051 179.84 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 9' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -75.97 -34.61 59.79 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.352 -0.843 . . . . 0.0 110.098 179.993 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 10' ' ' VAL . . . . . 0.709 HG23 HG23 ' A' ' 12' ' ' THR . 6.4 p -67.7 -24.21 30.63 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.56 0 O-C-N 121.311 -0.868 . . . . 0.0 110.072 179.916 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 11' ' ' LYS . . . . . . . . . . . . . 1.2 ttmt -76.17 -47.01 25.79 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.264 -0.898 . . . . 0.0 110.039 179.776 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 12' ' ' ASN . . . . . 0.508 ' O ' HD23 ' C' ' 16' ' ' LEU . 96.2 m-20 -67.32 -15.48 63.71 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.286 -0.884 . . . . 0.0 110.407 179.68 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 13' ' ' ALA . . . . . . . . . . . . . . . -101.44 -50.05 3.86 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.13 -0.981 . . . . 0.0 110.252 -179.953 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 14' ' ' ILE . . . . . 0.547 HG22 ' O ' ' C' ' 10' ' ' VAL . 2.5 tp -52.67 -23.67 5.37 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.629 0 O-C-N 121.278 -0.889 . . . . 0.0 110.265 -179.82 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 15' ' ' GLN . . . . . . . . . . . . . 17.7 mt-30 -85.26 -42.2 14.88 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.25 -0.906 . . . . 0.0 110.201 179.917 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 16' ' ' LEU . . . . . 0.508 HD23 ' O ' ' C' ' 12' ' ' ASN . 1.0 OUTLIER -53.22 -22.85 7.34 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.178 -0.951 . . . . 0.0 110.144 -179.989 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' C' C ' 17' ' ' SER . . . . . 0.431 ' C ' ' CG1' ' C' ' 18' ' ' ILE . 0.2 OUTLIER -85.83 53.41 2.77 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.31 -0.869 . . . . 0.0 110.314 -179.994 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' C' C ' 18' ' ' ILE . . . . . 0.605 HD12 ' HB2' ' C' ' 21' ' ' LEU . 2.3 pt 36.51 37.43 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.509 2.485 0 O-C-N 121.714 -0.616 . . . . 0.0 111.29 179.991 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 19' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER 51.25 52.97 13.77 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.215 -0.928 . . . . 0.0 109.024 -179.239 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 20' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 53.49 26.31 5.45 Favored 'General case' 0 N--CA 1.489 1.503 0 N-CA-C 108.354 -0.98 . . . . 0.0 108.354 -177.81 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 21' ' ' LEU . . . . . 0.605 ' HB2' HD12 ' C' ' 18' ' ' ILE . 0.5 OUTLIER 48.06 59.12 4.45 Favored 'General case' 0 N--CA 1.49 1.571 0 CA-C-O 121.943 0.878 . . . . 0.0 109.703 -178.937 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' C' C ' 22' ' ' VAL . . . . . . . . . . . . . 75.4 t . . . . . 0 N--CA 1.489 1.495 0 CA-C-O 117.995 -1.003 . . . . 0.0 110.095 -179.721 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 41.5 m80 . . . . . 0 N--CA 1.493 1.688 0 CA-C-O 121.253 0.549 . . . . 0.0 110.191 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 52.37 44.55 29.75 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.262 -0.898 . . . . 0.0 110.265 -179.918 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -173.07 72.28 0.1 OUTLIER Glycine 0 N--CA 1.49 2.282 0 N-CA-C 109.738 -1.345 . . . . 0.0 109.738 -179.944 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 2.0 t-160 -103.89 120.76 41.68 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.152 -1.205 . . . . 0.0 110.103 179.778 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.407 ' CG1' ' O ' ' A' ' 5' ' ' ILE . 0.9 OUTLIER -118.31 44.89 0.48 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.553 0 O-C-N 121.221 -0.924 . . . . 0.0 110.439 -179.775 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -126.87 -156.97 0.78 Allowed 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.204 -0.935 . . . . 0.0 110.298 -179.951 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . 0.634 ' N ' HD12 ' A' ' 7' ' ' ILE . 4.8 mp -88.28 122.25 69.83 Favored Pre-proline 0 N--CA 1.491 1.61 0 O-C-N 121.242 -0.911 . . . . 0.0 110.025 179.92 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 48.3 Cg_endo -73.92 117.81 5.17 Favored 'Trans proline' 0 C--N 1.313 -1.302 0 O-C-N 123.408 1.215 . . . . 0.0 110.383 -179.892 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 47.0 Cg_endo -73.79 -3.65 14.1 Favored 'Trans proline' 0 C--N 1.312 -1.349 0 O-C-N 123.474 1.25 . . . . 0.0 111.382 179.985 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -63.83 -24.24 68.11 Favored Glycine 0 N--CA 1.49 2.269 0 N-CA-C 109.34 -1.504 . . . . 0.0 109.34 179.679 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.51 ' O ' HD23 ' A' ' 15' ' ' LEU . 7.1 tt -66.23 -26.6 67.45 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.219 -1.165 . . . . 0.0 110.095 179.924 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 63.4 m -74.24 -28.98 61.49 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.293 -0.879 . . . . 0.0 110.055 179.868 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -71.51 -41.32 69.38 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.358 -0.839 . . . . 0.0 110.008 179.864 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 28.1 tp -72.72 -41.76 64.86 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.31 -0.869 . . . . 0.0 110.071 179.902 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.533 HD12 HD21 ' B' ' 15' ' ' LEU . 2.8 mm? -58.03 -50.02 74.85 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.2 -0.937 . . . . 0.0 110.116 179.902 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . 0.496 ' O ' HG23 ' A' ' 20' ' ' VAL . 3.3 mt-30 -55.04 -43.3 73.64 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.207 -0.933 . . . . 0.0 109.698 179.731 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -53.24 -36.69 53.24 Favored Glycine 0 N--CA 1.493 2.486 0 N-CA-C 109.185 -1.566 . . . . 0.0 109.185 179.486 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . 0.627 ' O ' HG23 ' A' ' 22' ' ' VAL . 28.2 t80 -69.91 -54.63 12.54 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.441 -1.034 . . . . 0.0 109.363 179.307 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.765 ' O ' HD12 ' A' ' 23' ' ' LEU . 47.8 m -52.47 -27.65 17.06 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.373 -0.829 . . . . 0.0 109.982 179.373 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.496 HG23 ' O ' ' A' ' 16' ' ' GLN . 43.9 t -71.54 -74.9 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.61 0 O-C-N 121.419 -0.801 . . . . 0.0 109.83 179.812 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.433 ' O ' ' CG ' ' A' ' 25' ' ' GLN . 21.8 pt-20 -48.54 -42.93 34.83 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.378 -0.826 . . . . 0.0 110.77 -179.665 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.673 HG11 HD11 ' A' ' 30' ' ' LEU . 97.1 t -55.2 -39.0 49.24 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.649 0 O-C-N 121.145 -0.972 . . . . 0.0 110.38 -179.815 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.765 HD12 ' O ' ' A' ' 19' ' ' THR . 30.7 mt -88.65 -22.71 23.3 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.211 -0.931 . . . . 0.0 110.295 -179.88 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -81.24 -37.63 28.25 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.189 -0.945 . . . . 0.0 110.264 179.994 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . 0.508 ' NE2' ' CE1' ' A' ' 33' ' ' PHE . 0.0 OUTLIER -105.72 -20.19 13.53 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.18 -0.95 . . . . 0.0 110.34 179.84 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . 0.419 ' N ' ' HG3' ' A' ' 25' ' ' GLN . 0.9 OUTLIER 47.82 83.23 0.22 Allowed Pre-proline 0 N--CA 1.494 1.735 0 O-C-N 121.197 -0.939 . . . . 0.0 110.655 -179.983 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 46.1 Cg_endo -72.91 160.83 45.13 Favored 'Trans proline' 0 C--N 1.311 -1.416 0 O-C-N 123.749 1.394 . . . . 0.0 110.446 179.957 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 43.0 Cg_endo -69.52 -25.39 29.77 Favored 'Trans proline' 0 C--N 1.312 -1.367 0 O-C-N 123.653 1.344 . . . . 0.0 110.256 179.936 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 33.3 m-20 -148.9 114.03 5.49 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.418 -0.801 . . . . 0.0 109.935 179.851 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.673 HD11 HG11 ' A' ' 22' ' ' VAL . 0.1 OUTLIER -57.38 -52.2 66.31 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.33 -0.856 . . . . 0.0 110.11 -179.866 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.413 ' O ' HG23 ' A' ' 35' ' ' VAL . 60.8 t -49.01 -62.14 0.49 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.699 0 O-C-N 121.291 -0.881 . . . . 0.0 110.15 179.742 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -55.91 -36.49 67.74 Favored 'General case' 0 C--N 1.3 -1.565 0 O-C-N 121.548 -0.72 . . . . 0.0 109.658 179.491 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . 0.508 ' CE1' ' NE2' ' A' ' 25' ' ' GLN . 55.5 t80 -66.1 -50.53 63.73 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.269 -0.895 . . . . 0.0 109.537 179.393 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.532 ' HB2' ' OH ' ' A' ' 18' ' ' TYR . . . -56.27 -38.51 71.29 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.397 -0.814 . . . . 0.0 109.798 179.535 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.543 HG13 ' OG1' ' B' ' 39' ' ' THR . 91.2 t -73.03 -34.57 46.05 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.339 0 O-C-N 121.373 -0.829 . . . . 0.0 109.993 179.782 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -80.43 -31.69 37.48 Favored 'General case' 0 C--N 1.303 -1.447 0 O-C-N 121.308 -0.87 . . . . 0.0 109.675 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 78.3 t80 -75.01 -65.3 0.89 Allowed 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.129 -0.982 . . . . 0.0 110.386 -179.859 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 12.9 m-85 -52.9 -49.56 65.69 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.228 -0.92 . . . . 0.0 110.626 -179.523 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . 0.546 ' OG1' HG13 ' B' ' 35' ' ' VAL . 35.9 m -52.88 -37.71 60.81 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 120.989 -1.07 . . . . 0.0 110.037 179.944 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -72.35 -27.25 62.28 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.171 -0.955 . . . . 0.0 110.056 179.646 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 1.1 tt -65.35 -34.0 77.3 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.277 -0.89 . . . . 0.0 110.04 179.892 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.16 -24.15 62.8 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.299 -0.875 . . . . 0.0 109.894 179.72 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -76.7 -56.78 4.3 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.317 -0.864 . . . . 0.0 110.118 179.939 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -58.83 -69.45 0.19 Allowed 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.326 -0.859 . . . . 0.0 110.172 179.813 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -51.48 142.79 13.17 Favored 'General case' 0 C--N 1.303 -1.424 0 O-C-N 121.513 -0.742 . . . . 0.0 110.483 -179.354 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.661 0 CA-C-O 118.015 -0.993 . . . . 0.0 110.259 -179.995 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 1' ' ' HIS . . . . . 0.436 ' O ' ' N ' ' B' ' 3' ' ' GLY . 0.1 OUTLIER . . . . . 0 N--CA 1.491 1.621 0 CA-C-O 121.103 0.477 . . . . 0.0 110.318 . . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 2' ' ' MET . . . . . . . . . . . . . 15.0 mtt 56.71 -85.8 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.557 -0.714 . . . . 0.0 110.605 -179.925 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 3' ' ' GLY . . . . . 0.436 ' N ' ' O ' ' B' ' 1' ' ' HIS . . . 169.76 -160.93 34.18 Favored Glycine 0 N--CA 1.49 2.273 0 N-CA-C 109.505 -1.438 . . . . 0.0 109.505 -179.995 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 4' ' ' HIS . . . . . . . . . . . . . 35.8 p-80 -165.69 149.09 7.88 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.29 -1.123 . . . . 0.0 110.392 -179.991 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 5' ' ' ILE . . . . . 0.531 HG23 ' O ' ' B' ' 5' ' ' ILE . 6.0 tp -118.54 48.91 0.36 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.545 0 O-C-N 121.373 -0.83 . . . . 0.0 110.121 179.902 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 6' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -116.76 -154.96 0.57 Allowed 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.266 -0.896 . . . . 0.0 110.075 -179.997 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 7' ' ' ILE . . . . . . . . . . . . . 47.0 mm -94.4 138.32 22.45 Favored Pre-proline 0 N--CA 1.493 1.676 0 O-C-N 121.192 -0.943 . . . . 0.0 110.276 -179.803 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 49.0 Cg_endo -72.79 129.87 15.0 Favored 'Trans proline' 0 C--N 1.313 -1.34 0 O-C-N 123.541 1.285 . . . . 0.0 110.317 179.921 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 9' ' ' PRO . . . . . . . . . . . . . 49.5 Cg_endo -74.43 153.97 45.11 Favored 'Trans proline' 0 C--N 1.311 -1.397 0 O-C-N 123.497 1.261 . . . . 0.0 110.477 -179.968 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 111.58 -25.05 14.04 Favored Glycine 0 N--CA 1.49 2.292 0 N-CA-C 109.553 -1.419 . . . . 0.0 109.553 179.889 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -69.05 -22.91 64.0 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.224 -1.162 . . . . 0.0 110.214 -179.986 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 91.6 m -78.96 -35.11 43.65 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.159 -0.963 . . . . 0.0 110.281 -179.956 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 28.1 mt-10 -65.88 -44.25 85.88 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.191 -0.943 . . . . 0.0 110.389 -179.928 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -67.89 -32.87 73.65 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.239 -0.913 . . . . 0.0 110.545 -179.803 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . 0.533 HD21 HD12 ' A' ' 15' ' ' LEU . 2.5 mp -77.76 -42.32 34.51 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.192 -0.943 . . . . 0.0 110.559 -179.733 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 16' ' ' GLN . . . . . 0.735 ' O ' HG23 ' B' ' 20' ' ' VAL . 0.9 OUTLIER -53.16 -44.03 67.5 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.035 -1.041 . . . . 0.0 110.011 179.93 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 17' ' ' GLY . . . . . . . . . . . . . . . -62.26 -51.42 56.72 Favored Glycine 0 N--CA 1.489 2.2 0 N-CA-C 109.346 -1.502 . . . . 0.0 109.346 179.902 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 18' ' ' TYR . . . . . 0.564 ' O ' HG23 ' B' ' 22' ' ' VAL . 16.3 t80 -56.12 -33.78 65.46 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.341 -1.093 . . . . 0.0 110.279 179.895 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 62.6 m -71.55 -31.76 67.36 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.26 -0.9 . . . . 0.0 110.354 -179.887 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 20' ' ' VAL . . . . . 0.735 HG23 ' O ' ' B' ' 16' ' ' GLN . 48.6 t -75.14 -17.47 16.07 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.645 0 O-C-N 121.271 -0.893 . . . . 0.0 110.487 -179.885 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 21' ' ' GLU . . . . . 0.449 ' HG3' ' HA ' ' B' ' 18' ' ' TYR . 0.8 OUTLIER -89.15 -50.31 6.23 Favored 'General case' 0 N--CA 1.497 1.92 0 O-C-N 121.137 -0.977 . . . . 0.0 109.281 179.906 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 22' ' ' VAL . . . . . 0.564 HG23 ' O ' ' B' ' 18' ' ' TYR . 23.8 t -60.79 -24.59 32.81 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.515 0 O-C-N 121.776 -0.577 . . . . 0.0 110.323 -179.637 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 23' ' ' LEU . . . . . 0.476 HD23 ' HA ' ' B' ' 23' ' ' LEU . 6.8 mt -90.15 -31.65 16.99 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.214 -0.929 . . . . 0.0 110.492 -179.835 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -87.4 -51.71 5.79 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.189 -0.944 . . . . 0.0 110.591 -179.643 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 25' ' ' GLN . . . . . 0.425 ' O ' ' HG3' ' B' ' 26' ' ' GLN . 14.0 tp60 -85.15 -19.77 31.26 Favored 'General case' 0 N--CA 1.486 1.335 0 O-C-N 121.146 -0.971 . . . . 0.0 110.477 -179.557 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 26' ' ' GLN . . . . . 0.425 ' HG3' ' O ' ' B' ' 25' ' ' GLN . 9.0 pt20 36.26 74.82 0.55 Allowed Pre-proline 0 N--CA 1.507 2.376 0 O-C-N 121.81 -0.556 . . . . 0.0 111.893 -179.92 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 27' ' ' PRO . . . . . . . . . . . . . 44.4 Cg_endo -70.04 166.94 26.26 Favored 'Trans proline' 0 C--N 1.311 -1.429 0 O-C-N 123.532 1.28 . . . . 0.0 110.565 179.887 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 45.4 Cg_endo -71.79 -52.96 0.18 Allowed 'Trans proline' 0 C--N 1.313 -1.317 0 O-C-N 123.611 1.322 . . . . 0.0 110.551 -179.969 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -114.66 122.26 45.92 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.225 -0.922 . . . . 0.0 110.195 -179.899 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 3.8 tp -74.59 -39.44 62.2 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.194 -0.941 . . . . 0.0 110.264 179.957 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 86.2 t -49.73 -66.81 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.711 0 O-C-N 121.169 -0.957 . . . . 0.0 110.097 179.726 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 1.5 t0 -56.28 -38.44 71.19 Favored 'General case' 0 C--N 1.301 -1.536 0 O-C-N 121.626 -0.671 . . . . 0.0 110.101 179.744 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 33' ' ' PHE . . . . . . . . . . . . . 69.5 t80 -62.95 -44.38 96.22 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.215 -0.928 . . . . 0.0 109.845 179.747 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 34' ' ' ALA . . . . . 0.477 ' HB2' ' OH ' ' B' ' 18' ' ' TYR . . . -56.44 -31.93 64.42 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.206 -0.934 . . . . 0.0 109.78 179.65 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 35' ' ' VAL . . . . . 0.546 HG13 ' OG1' ' A' ' 39' ' ' THR . 89.9 t -73.91 -53.57 17.27 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.37 0 O-C-N 121.303 -0.873 . . . . 0.0 110.097 179.8 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -59.55 -24.75 63.97 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.342 -0.849 . . . . 0.0 110.491 -179.779 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 37' ' ' TYR . . . . . 0.432 ' CD2' ' CD1' ' B' ' 18' ' ' TYR . 14.2 t80 -78.66 -69.03 0.59 Allowed 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.191 -0.943 . . . . 0.0 110.54 -179.751 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 38' ' ' PHE . . . . . 0.411 ' HB2' HG22 ' A' ' 35' ' ' VAL . 26.0 m-85 -53.53 -39.24 64.53 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.2 -0.937 . . . . 0.0 110.165 -179.832 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 39' ' ' THR . . . . . 0.543 ' OG1' HG13 ' A' ' 35' ' ' VAL . 55.2 m -57.71 -49.91 74.97 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.145 -0.972 . . . . 0.0 109.901 179.835 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 40' ' ' ARG . . . . . 0.521 ' O ' ' HB2' ' B' ' 44' ' ' ALA . 0.0 OUTLIER -68.0 -24.1 65.08 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.222 -0.924 . . . . 0.0 109.936 179.873 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -69.52 -31.48 69.74 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.352 -0.843 . . . . 0.0 110.128 179.807 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -74.26 -40.73 62.16 Favored 'General case' 0 C--N 1.305 -1.352 0 O-C-N 121.329 -0.857 . . . . 0.0 109.688 179.916 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 43' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 -101.48 14.71 31.13 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.329 -0.857 . . . . 0.0 110.36 179.838 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 44' ' ' ALA . . . . . 0.521 ' HB2' ' O ' ' B' ' 40' ' ' ARG . . . -62.89 -63.36 1.23 Allowed 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.164 -0.96 . . . . 0.0 110.496 -179.982 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 45' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -48.14 -69.11 0.13 Allowed 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.487 -0.758 . . . . 0.0 110.732 -179.164 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 18.9 ttt180 . . . . . 0 N--CA 1.491 1.625 0 CA-C-O 117.964 -1.017 . . . . 0.0 110.204 179.909 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' C' C ' 1' ' ' LEU . . . . . . . . . . . . . 1.3 pp . . . . . 0 N--CA 1.494 1.756 0 CA-C-O 121.375 0.607 . . . . 0.0 110.209 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' C' C ' 2' ' ' LEU . . . . . 0.427 HD21 HD13 ' A' ' 23' ' ' LEU . 0.5 OUTLIER -175.61 -39.01 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.243 -0.911 . . . . 0.0 110.159 -179.946 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' C' C ' 3' ' ' ILE . . . . . . . . . . . . . 1.5 tt -70.09 -18.07 21.44 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.66 0 O-C-N 121.319 -0.863 . . . . 0.0 110.462 -179.878 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 4' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -78.95 -44.13 23.12 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.112 -0.993 . . . . 0.0 110.32 -179.861 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 5' ' ' THR . . . . . 0.509 HG23 ' N ' ' C' ' 6' ' ' ALA . 13.5 t -83.17 -41.83 18.01 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.269 -0.894 . . . . 0.0 110.211 -179.754 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 6' ' ' ALA . . . . . 0.509 ' N ' HG23 ' C' ' 5' ' ' THR . . . -54.58 -45.63 73.61 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.441 -0.787 . . . . 0.0 110.295 -179.998 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 7' ' ' SER . . . . . . . . . . . . . 61.4 p -75.69 -28.42 58.64 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.211 -0.931 . . . . 0.0 110.337 -179.944 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 8' ' ' SER . . . . . . . . . . . . . 12.6 t -79.5 -33.31 42.24 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.309 -0.869 . . . . 0.0 110.363 -179.953 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 9' ' ' LEU . . . . . . . . . . . . . 7.1 tt -66.52 -53.0 39.78 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.191 -0.943 . . . . 0.0 110.361 -179.83 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 10' ' ' VAL . . . . . . . . . . . . . 25.8 m -58.62 -26.15 30.48 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.693 0 O-C-N 121.282 -0.887 . . . . 0.0 110.291 -179.795 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 11' ' ' LYS . . . . . 0.41 ' O ' ' NE2' ' C' ' 15' ' ' GLN . 1.2 ttmm -68.94 -52.39 29.72 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.328 -0.857 . . . . 0.0 110.311 -179.806 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 12' ' ' ASN . . . . . . . . . . . . . 13.8 t30 -64.17 -17.62 63.69 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.195 -0.941 . . . . 0.0 110.513 -179.979 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 13' ' ' ALA . . . . . . . . . . . . . . . -87.14 -54.51 4.28 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.131 -0.98 . . . . 0.0 110.504 -179.836 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 14' ' ' ILE . . . . . 0.551 ' O ' HD12 ' C' ' 18' ' ' ILE . 35.4 mm -53.72 -26.96 14.64 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.653 0 O-C-N 121.227 -0.921 . . . . 0.0 110.311 -179.751 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 15' ' ' GLN . . . . . 0.41 ' NE2' ' O ' ' C' ' 11' ' ' LYS . 0.9 OUTLIER -86.98 -33.77 19.5 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.191 -0.943 . . . . 0.0 110.223 -179.991 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' C' C ' 16' ' ' LEU . . . . . . . . . . . . . 4.1 tp -53.64 -52.71 59.03 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.25 -0.906 . . . . 0.0 110.21 -179.868 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 17' ' ' SER . . . . . . . . . . . . . 8.9 p -59.93 -51.02 71.46 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.276 -0.89 . . . . 0.0 110.112 179.967 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 18' ' ' ILE . . . . . 0.551 HD12 ' O ' ' C' ' 14' ' ' ILE . 79.9 mt -61.12 -34.73 61.5 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.62 0 O-C-N 121.273 -0.892 . . . . 0.0 110.177 -179.97 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 19' ' ' GLU . . . . . . . . . . . . . 46.0 tt0 -68.44 -46.74 69.03 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.255 -0.903 . . . . 0.0 110.242 -179.952 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 20' ' ' GLN . . . . . . . . . . . . . 23.3 tt0 -67.3 -20.71 65.66 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.224 -0.922 . . . . 0.0 110.266 -179.985 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 21' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -62.99 -36.32 83.12 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.256 -0.903 . . . . 0.0 110.224 179.991 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 22' ' ' VAL . . . . . . . . . . . . . 61.3 t . . . . . 0 N--CA 1.491 1.586 0 CA-C-O 118.042 -0.98 . . . . 0.0 110.315 179.984 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 3.9 m80 . . . . . 0 N--CA 1.491 1.623 0 CA-C-O 121.202 0.525 . . . . 0.0 110.233 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -171.75 -174.93 1.44 Allowed 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.183 -0.948 . . . . 0.0 110.421 179.988 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 105.58 98.38 2.55 Favored Glycine 0 N--CA 1.49 2.272 0 N-CA-C 109.501 -1.439 . . . . 0.0 109.501 179.983 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -121.78 -32.9 3.68 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.192 -1.181 . . . . 0.0 110.338 -179.933 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 46.6 mm -120.84 141.91 39.19 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.651 0 O-C-N 121.246 -0.909 . . . . 0.0 110.32 -179.972 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 17.8 pt20 -101.39 -153.48 0.46 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.319 -0.863 . . . . 0.0 109.967 179.835 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 38.8 mm -52.1 117.84 10.95 Favored Pre-proline 0 N--CA 1.492 1.645 0 O-C-N 121.103 -0.998 . . . . 0.0 110.051 179.999 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 44.9 Cg_endo -70.18 118.45 5.69 Favored 'Trans proline' 0 C--N 1.313 -1.303 0 O-C-N 123.492 1.259 . . . . 0.0 110.668 -179.788 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 46.6 Cg_endo -72.7 -164.59 0.19 Allowed 'Trans proline' 0 C--N 1.314 -1.273 0 O-C-N 123.451 1.237 . . . . 0.0 110.442 179.916 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 94.05 -36.01 3.94 Favored Glycine 0 N--CA 1.491 2.325 0 N-CA-C 109.63 -1.388 . . . . 0.0 109.63 179.867 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.466 HD21 HG11 ' B' ' 22' ' ' VAL . 0.1 OUTLIER -66.66 -32.48 73.83 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.218 -1.166 . . . . 0.0 110.242 179.997 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . 0.408 HG23 HG11 ' C' ' 10' ' ' VAL . 65.9 m -57.42 -63.18 1.32 Allowed 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.268 -0.895 . . . . 0.0 110.355 -179.806 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -51.0 -41.15 59.58 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.295 -0.878 . . . . 0.0 110.533 -179.86 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -64.32 -42.79 96.15 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.317 -0.865 . . . . 0.0 110.28 -179.891 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.78 HD22 HD11 ' B' ' 15' ' ' LEU . 59.8 mt -70.24 -47.4 61.53 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.195 -0.941 . . . . 0.0 110.14 -179.934 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . 0.404 ' O ' HG23 ' A' ' 20' ' ' VAL . 0.0 OUTLIER -54.49 -39.91 68.0 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.158 -0.964 . . . . 0.0 109.947 179.882 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . 0.405 ' O ' ' HG3' ' A' ' 21' ' ' GLU . . . -57.04 -49.81 68.93 Favored Glycine 0 N--CA 1.49 2.266 0 N-CA-C 109.202 -1.559 . . . . 0.0 109.202 179.671 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . 0.603 ' O ' HG23 ' A' ' 22' ' ' VAL . 23.7 t80 -58.65 -21.39 53.88 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.358 -1.083 . . . . 0.0 110.109 179.729 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 1.3 m -82.77 -28.57 30.26 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.285 -0.884 . . . . 0.0 110.077 -179.992 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.404 HG23 ' O ' ' A' ' 16' ' ' GLN . 61.6 t -79.92 -18.1 12.6 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.701 0 O-C-N 121.356 -0.84 . . . . 0.0 110.294 179.997 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.405 ' HG3' ' O ' ' A' ' 17' ' ' GLY . 1.0 OUTLIER -90.79 -46.99 7.9 Favored 'General case' 0 N--CA 1.499 1.986 0 O-C-N 121.131 -0.981 . . . . 0.0 109.09 179.939 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.603 HG23 ' O ' ' A' ' 18' ' ' TYR . 86.1 t -59.71 -38.52 76.25 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.512 0 O-C-N 121.669 -0.644 . . . . 0.0 110.029 -179.976 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -75.87 -36.28 59.61 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.347 -0.846 . . . . 0.0 109.959 179.701 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.98 -26.12 53.54 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.288 -0.883 . . . . 0.0 110.233 179.928 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 73.4 mm-40 -97.96 -38.58 9.34 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.257 -0.902 . . . . 0.0 110.409 -179.856 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 1.7 mt-30 53.35 56.54 13.93 Favored Pre-proline 0 N--CA 1.492 1.634 0 O-C-N 121.247 -0.908 . . . . 0.0 110.028 -179.834 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 45.0 Cg_endo -71.09 156.9 58.96 Favored 'Trans proline' 0 C--N 1.312 -1.387 0 O-C-N 123.757 1.399 . . . . 0.0 110.606 -179.798 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 44.6 Cg_endo -70.93 -21.31 28.22 Favored 'Trans proline' 0 C--N 1.312 -1.371 0 O-C-N 123.768 1.404 . . . . 0.0 110.469 179.9 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 4.4 p-10 -139.36 123.61 18.03 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.28 -0.888 . . . . 0.0 110.204 179.987 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 5.3 tp -88.82 -31.04 18.52 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.2 -0.938 . . . . 0.0 110.125 179.851 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.435 HG23 ' H ' ' A' ' 31' ' ' VAL . 42.9 t -50.71 -58.4 1.83 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.769 0 O-C-N 121.27 -0.894 . . . . 0.0 110.124 179.865 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 8.0 t0 -64.23 -42.88 96.36 Favored 'General case' 0 C--N 1.302 -1.487 0 O-C-N 121.509 -0.745 . . . . 0.0 110.12 179.87 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 89.4 t80 -61.57 -40.32 94.31 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.212 -0.93 . . . . 0.0 109.904 179.722 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.467 ' HB2' ' OH ' ' A' ' 18' ' ' TYR . . . -56.72 -37.28 70.74 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.279 -0.888 . . . . 0.0 110.204 179.905 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.467 HG13 ' OG1' ' B' ' 39' ' ' THR . 90.1 t -74.18 -37.79 46.93 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.346 0 O-C-N 121.277 -0.889 . . . . 0.0 110.403 -179.798 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -68.76 -37.95 79.74 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.187 -0.945 . . . . 0.0 110.507 -179.819 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 33.0 t80 -63.99 -56.76 12.74 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.222 -0.924 . . . . 0.0 110.592 -179.691 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 20.0 m-85 -68.15 -48.75 64.52 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.252 -0.905 . . . . 0.0 110.908 -179.391 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . 0.508 ' OG1' HG13 ' B' ' 35' ' ' VAL . 55.5 m -52.17 -46.73 65.61 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.048 -1.033 . . . . 0.0 110.209 -179.786 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 7.1 ttt-85 -64.13 -29.0 70.15 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.199 -0.938 . . . . 0.0 110.018 179.83 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -64.82 -28.27 69.45 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.338 -0.851 . . . . 0.0 110.279 179.982 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.07 -22.02 62.17 Favored 'General case' 0 C--N 1.306 -1.307 0 O-C-N 121.212 -0.93 . . . . 0.0 109.853 179.871 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -106.8 -12.52 15.49 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.228 -0.92 . . . . 0.0 110.549 179.9 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -52.63 -55.01 25.49 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.08 -1.012 . . . . 0.0 110.705 -179.782 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 3.6 tpm_? -47.03 -43.99 20.15 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.585 -0.697 . . . . 0.0 110.836 -178.833 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 28.7 mtt85 . . . . . 0 N--CA 1.49 1.56 0 CA-C-O 117.983 -1.008 . . . . 0.0 110.223 179.848 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 1' ' ' HIS . . . . . . . . . . . . . 1.5 t-160 . . . . . 0 N--CA 1.491 1.59 0 CA-C-O 121.287 0.565 . . . . 0.0 110.192 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 2' ' ' MET . . . . . . . . . . . . . 11.9 mmt -128.92 -57.4 1.17 Allowed 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.348 -0.845 . . . . 0.0 110.045 179.891 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 3' ' ' GLY . . . . . . . . . . . . . . . 127.9 122.11 2.47 Favored Glycine 0 N--CA 1.491 2.357 0 N-CA-C 109.602 -1.399 . . . . 0.0 109.602 179.863 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 4' ' ' HIS . . . . . . . . . . . . . 6.3 t60 -100.31 -25.53 14.21 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.246 -1.15 . . . . 0.0 110.132 179.93 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 5' ' ' ILE . . . . . 0.414 ' H ' HG22 ' B' ' 5' ' ' ILE . 1.2 tt -104.27 147.1 10.8 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.602 0 O-C-N 121.236 -0.915 . . . . 0.0 110.214 179.918 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 6' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -153.68 48.76 0.66 Allowed 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.247 -0.908 . . . . 0.0 110.22 179.958 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 7' ' ' ILE . . . . . 0.502 HG13 HG21 ' C' ' 5' ' ' THR . 47.2 mm -122.04 121.59 27.93 Favored Pre-proline 0 N--CA 1.491 1.612 0 O-C-N 121.215 -0.928 . . . . 0.0 110.147 179.97 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 48.8 Cg_endo -73.33 116.46 4.71 Favored 'Trans proline' 0 C--N 1.313 -1.295 0 O-C-N 123.469 1.247 . . . . 0.0 110.614 -179.808 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 9' ' ' PRO . . . . . . . . . . . . . 48.3 Cg_endo -75.14 -172.91 1.4 Allowed 'Trans proline' 0 C--N 1.312 -1.355 0 O-C-N 123.551 1.29 . . . . 0.0 110.33 179.797 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 94.37 -18.88 56.07 Favored Glycine 0 N--CA 1.491 2.335 0 N-CA-C 109.822 -1.311 . . . . 0.0 109.822 -179.963 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . 0.618 HD23 ' O ' ' B' ' 11' ' ' LEU . 3.3 tt -88.53 -19.32 26.53 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.183 -1.186 . . . . 0.0 110.367 -180.0 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 64.8 m -63.55 -50.55 69.05 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.193 -0.942 . . . . 0.0 110.398 -179.88 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -51.53 -34.52 36.67 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.302 -0.874 . . . . 0.0 110.34 -179.892 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -69.14 -55.69 9.92 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.294 -0.879 . . . . 0.0 110.145 179.983 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . 0.78 HD11 HD22 ' A' ' 15' ' ' LEU . 1.0 OUTLIER -55.35 -41.2 72.19 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.214 -0.929 . . . . 0.0 109.919 179.872 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 1.7 tt0 -59.29 -39.23 82.34 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.233 -0.917 . . . . 0.0 109.734 179.679 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 17' ' ' GLY . . . . . . . . . . . . . . . -62.39 -39.67 98.07 Favored Glycine 0 N--CA 1.489 2.225 0 N-CA-C 109.152 -1.579 . . . . 0.0 109.152 179.621 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 18' ' ' TYR . . . . . 0.607 ' OH ' ' HB2' ' B' ' 34' ' ' ALA . 16.8 t80 -71.56 -43.91 65.5 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.261 -1.14 . . . . 0.0 109.935 179.676 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 10.3 m -53.55 -35.42 60.72 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.346 -0.846 . . . . 0.0 109.919 179.683 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 42.2 t -69.76 -73.62 0.1 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.614 0 O-C-N 121.364 -0.835 . . . . 0.0 109.904 179.769 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 21' ' ' GLU . . . . . . . . . . . . . 7.8 pt-20 -46.75 -42.96 17.66 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.449 -0.782 . . . . 0.0 110.912 -179.752 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 22' ' ' VAL . . . . . 0.51 HG23 ' O ' ' B' ' 18' ' ' TYR . 55.1 t -57.47 -36.25 52.71 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.622 0 O-C-N 121.108 -0.995 . . . . 0.0 109.506 179.445 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 8.2 tp -89.47 -22.32 22.54 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.347 -0.846 . . . . 0.0 109.964 179.612 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -86.85 -61.89 1.63 Allowed 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.268 -0.895 . . . . 0.0 110.139 179.782 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 29.5 mm-40 -58.84 -33.09 70.03 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.313 -0.867 . . . . 0.0 110.271 179.968 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER 49.7 59.92 16.05 Favored Pre-proline 0 N--CA 1.492 1.656 0 O-C-N 121.326 -0.859 . . . . 0.0 110.411 -179.903 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 27' ' ' PRO . . . . . . . . . . . . . 45.3 Cg_endo -71.52 158.52 53.67 Favored 'Trans proline' 0 C--N 1.311 -1.446 0 O-C-N 123.81 1.427 . . . . 0.0 110.523 -179.859 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 44.0 Cg_endo -70.16 -37.9 7.6 Favored 'Trans proline' 0 C--N 1.311 -1.435 0 O-C-N 123.704 1.371 . . . . 0.0 110.113 179.769 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -127.47 119.35 25.9 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.286 -0.884 . . . . 0.0 109.924 179.677 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 30' ' ' LEU . . . . . . . . . . . . . 5.0 tp -73.49 -29.85 62.77 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.249 -0.907 . . . . 0.0 110.299 -179.731 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 42.0 t -52.19 -64.79 0.34 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.664 0 O-C-N 121.177 -0.952 . . . . 0.0 110.052 179.749 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 11.8 t0 -56.7 -42.6 79.41 Favored 'General case' 0 C--N 1.302 -1.458 0 O-C-N 121.444 -0.785 . . . . 0.0 110.171 179.806 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 33' ' ' PHE . . . . . . . . . . . . . 22.9 t80 -60.06 -53.58 56.1 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.163 -0.96 . . . . 0.0 109.783 179.497 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 34' ' ' ALA . . . . . 0.607 ' HB2' ' OH ' ' B' ' 18' ' ' TYR . . . -51.01 -33.31 24.39 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.369 -0.832 . . . . 0.0 110.296 179.679 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 35' ' ' VAL . . . . . 0.508 HG13 ' OG1' ' A' ' 39' ' ' THR . 88.9 t -79.44 -41.54 22.51 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.406 0 O-C-N 121.166 -0.959 . . . . 0.0 110.222 179.946 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -66.51 -39.04 88.47 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.307 -0.871 . . . . 0.0 110.548 -179.783 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 37' ' ' TYR . . . . . . . . . . . . . 61.1 t80 -67.14 -66.72 0.52 Allowed 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.136 -0.978 . . . . 0.0 110.423 -179.691 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 10.6 m-85 -51.26 -48.84 62.08 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.142 -0.974 . . . . 0.0 110.519 -179.586 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 39' ' ' THR . . . . . 0.467 ' OG1' HG13 ' A' ' 35' ' ' VAL . 45.6 m -53.75 -32.44 52.27 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.096 -1.003 . . . . 0.0 109.905 179.961 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -76.14 -30.5 58.18 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.174 -0.954 . . . . 0.0 109.775 179.589 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -61.9 -28.64 69.65 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.318 -0.864 . . . . 0.0 109.823 179.563 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.43 -22.11 65.53 Favored 'General case' 0 C--N 1.304 -1.391 0 O-C-N 121.363 -0.836 . . . . 0.0 109.91 179.793 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 43' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -71.2 -28.37 64.17 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.27 -0.894 . . . . 0.0 110.198 -179.884 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -66.4 -78.64 0.05 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.302 -0.874 . . . . 0.0 110.371 -179.95 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 45' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 51.22 -179.66 0.02 OUTLIER 'General case' 0 C--N 1.304 -1.408 0 O-C-N 121.663 -0.648 . . . . 0.0 110.519 -179.526 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.49 1.572 0 CA-C-O 118.002 -0.999 . . . . 0.0 110.304 -179.977 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 1' ' ' LEU . . . . . . . . . . . . . 3.9 mp . . . . . 0 N--CA 1.492 1.642 0 CA-C-O 121.266 0.555 . . . . 0.0 110.153 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' C' C ' 2' ' ' LEU . . . . . . . . . . . . . 1.1 pp -76.87 -22.88 52.83 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.259 -0.901 . . . . 0.0 110.155 179.967 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 3' ' ' ILE . . . . . . . . . . . . . 5.3 mt -58.28 -58.05 8.17 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.64 0 O-C-N 121.295 -0.878 . . . . 0.0 110.176 179.912 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 4' ' ' GLU . . . . . . . . . . . . . 6.8 tm-20 -53.36 -41.18 65.56 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.204 -0.935 . . . . 0.0 109.968 179.976 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 5' ' ' THR . . . . . 0.502 HG21 HG13 ' B' ' 7' ' ' ILE . 1.3 m -63.32 -34.08 76.91 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.289 -0.882 . . . . 0.0 109.892 179.886 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 6' ' ' ALA . . . . . . . . . . . . . . . -75.77 -32.62 60.02 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.281 -0.887 . . . . 0.0 110.101 179.934 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 7' ' ' SER . . . . . . . . . . . . . 27.8 t -68.6 -34.53 75.93 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.192 -0.943 . . . . 0.0 110.187 179.899 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 8' ' ' SER . . . . . . . . . . . . . 46.7 t -67.94 -32.96 73.77 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.341 -0.85 . . . . 0.0 110.285 179.89 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 9' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -68.35 -36.02 78.62 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.176 -0.952 . . . . 0.0 110.17 179.919 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 10' ' ' VAL . . . . . 0.408 HG11 HG23 ' A' ' 12' ' ' THR . 95.0 t -57.53 -44.25 84.59 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 O-C-N 121.293 -0.879 . . . . 0.0 110.125 -179.978 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.18 -55.38 34.54 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.377 -0.827 . . . . 0.0 110.192 179.951 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 12' ' ' ASN . . . . . . . . . . . . . 1.2 m-80 -60.34 -26.73 66.81 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.289 -0.882 . . . . 0.0 110.384 -179.877 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 13' ' ' ALA . . . . . . . . . . . . . . . -72.51 -46.58 53.99 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.189 -0.944 . . . . 0.0 110.251 -179.861 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 14' ' ' ILE . . . . . 0.4 HD12 HG23 ' C' ' 14' ' ' ILE . 49.8 mm -71.32 -22.42 22.32 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.64 0 O-C-N 121.256 -0.902 . . . . 0.0 110.309 -179.878 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 15' ' ' GLN . . . . . 0.401 ' O ' ' N ' ' C' ' 17' ' ' SER . 12.3 mt-30 -82.81 -46.13 13.45 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.227 -0.921 . . . . 0.0 110.349 179.986 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 16' ' ' LEU . . . . . 0.439 ' HA ' HD23 ' C' ' 16' ' ' LEU . 71.2 mt -69.85 65.17 0.22 Allowed 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.301 -0.874 . . . . 0.0 110.13 179.948 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 17' ' ' SER . . . . . 0.401 ' N ' ' O ' ' C' ' 15' ' ' GLN . 13.5 p -177.16 -70.1 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.281 -0.887 . . . . 0.0 109.914 -179.95 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 18' ' ' ILE . . . . . . . . . . . . . 31.4 pt -69.88 -20.73 23.58 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.593 0 O-C-N 121.314 -0.866 . . . . 0.0 110.187 179.79 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 19' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -98.39 14.94 26.3 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.219 -0.926 . . . . 0.0 110.575 -179.906 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 20' ' ' GLN . . . . . . . . . . . . . 29.8 tt0 -134.35 -56.35 0.85 Allowed 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.09 -1.006 . . . . 0.0 110.128 179.832 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 21' ' ' LEU . . . . . . . . . . . . . 3.0 tp -88.76 47.98 1.57 Allowed 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.23 -0.918 . . . . 0.0 110.134 179.889 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 22' ' ' VAL . . . . . 0.421 HG12 ' H ' ' C' ' 22' ' ' VAL . 7.1 p . . . . . 0 N--CA 1.491 1.606 0 CA-C-O 117.961 -1.019 . . . . 0.0 110.227 -179.862 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.492 1.626 0 CA-C-O 121.24 0.543 . . . . 0.0 110.277 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -61.61 -59.38 5.3 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.234 -0.916 . . . . 0.0 110.051 179.995 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . 150.4 89.21 0.07 OUTLIER Glycine 0 N--CA 1.491 2.322 0 N-CA-C 109.631 -1.388 . . . . 0.0 109.631 179.953 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -135.78 -161.63 1.18 Allowed 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.261 -1.14 . . . . 0.0 110.2 179.997 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.466 ' N ' HD12 ' A' ' 5' ' ' ILE . 4.6 mp -112.18 128.83 68.56 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.574 0 O-C-N 121.291 -0.881 . . . . 0.0 110.198 179.88 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 6.1 pt20 -171.41 175.16 4.23 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.314 -0.866 . . . . 0.0 109.907 -179.962 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . 0.658 ' O ' HD12 ' A' ' 7' ' ' ILE . 2.2 pp -76.7 132.16 72.47 Favored Pre-proline 0 N--CA 1.492 1.669 0 O-C-N 121.141 -0.974 . . . . 0.0 109.925 -179.912 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 49.6 Cg_endo -75.15 138.33 22.55 Favored 'Trans proline' 0 C--N 1.313 -1.336 0 O-C-N 123.5 1.263 . . . . 0.0 110.621 -179.773 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 48.4 Cg_endo -74.51 164.33 34.14 Favored 'Trans proline' 0 C--N 1.312 -1.381 0 O-C-N 123.608 1.32 . . . . 0.0 110.22 179.803 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 99.3 -33.48 6.15 Favored Glycine 0 N--CA 1.49 2.294 0 N-CA-C 109.528 -1.429 . . . . 0.0 109.528 179.989 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 11.6 tp -52.88 -46.39 67.9 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.282 -1.128 . . . . 0.0 110.066 179.869 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 98.2 m -59.19 -47.07 86.68 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.193 -0.942 . . . . 0.0 110.151 179.864 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.6 tm-20 -57.47 -29.23 64.07 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.232 -0.917 . . . . 0.0 110.057 179.846 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.672 HD21 ' CE1' ' A' ' 38' ' ' PHE . 4.0 tt -78.41 -44.56 24.51 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.267 -0.895 . . . . 0.0 110.242 179.924 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.638 HD22 HD11 ' B' ' 15' ' ' LEU . 98.4 mt -70.39 -50.53 37.78 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.288 -0.883 . . . . 0.0 110.271 -179.859 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -53.3 -46.81 69.53 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.164 -0.96 . . . . 0.0 110.052 179.959 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -56.89 -40.35 90.08 Favored Glycine 0 N--CA 1.491 2.301 0 N-CA-C 109.137 -1.585 . . . . 0.0 109.137 179.613 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . 0.605 ' O ' HG23 ' A' ' 22' ' ' VAL . 22.8 t80 -66.64 -44.74 81.16 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.309 -1.113 . . . . 0.0 109.812 179.668 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 52.4 m -57.3 -26.85 61.54 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.366 -0.834 . . . . 0.0 109.902 179.632 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 44.2 t -73.53 -72.27 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.569 0 O-C-N 121.381 -0.824 . . . . 0.0 110.258 179.995 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.443 ' OE2' ' CD1' ' A' ' 37' ' ' TYR . 10.1 pt-20 -46.42 -43.56 16.5 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.39 -0.819 . . . . 0.0 111.144 -179.476 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.605 HG23 ' O ' ' A' ' 18' ' ' TYR . 99.6 t -58.52 -37.34 64.08 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.657 0 O-C-N 120.914 -1.116 . . . . 0.0 110.004 179.955 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.577 HD11 ' CD1' ' B' ' 7' ' ' ILE . 0.4 OUTLIER -78.57 -20.63 50.12 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.362 -0.836 . . . . 0.0 110.298 179.939 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -95.23 -58.33 2.17 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.284 -0.885 . . . . 0.0 110.462 -179.736 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . 0.43 ' O ' ' CG ' ' A' ' 26' ' ' GLN . 7.9 mp0 -63.11 -22.34 66.79 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.218 -0.926 . . . . 0.0 110.531 -179.73 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . 0.43 ' CG ' ' O ' ' A' ' 25' ' ' GLN . 3.4 pt20 36.49 59.24 3.46 Favored Pre-proline 0 N--CA 1.505 2.279 0 O-C-N 122.013 -0.429 . . . . 0.0 111.589 -179.9 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo -69.95 161.22 46.78 Favored 'Trans proline' 0 C--N 1.31 -1.459 0 O-C-N 123.796 1.419 . . . . 0.0 110.763 -179.735 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 43.4 Cg_endo -69.81 -46.34 1.24 Allowed 'Trans proline' 0 C--N 1.311 -1.398 0 O-C-N 123.84 1.442 . . . . 0.0 110.33 179.975 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -120.54 116.45 25.4 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.355 -0.84 . . . . 0.0 110.048 179.86 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 6.7 tp -70.22 -30.8 67.98 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.391 -0.818 . . . . 0.0 110.273 -179.992 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.416 HG23 ' H ' ' A' ' 31' ' ' VAL . 41.5 t -51.3 -64.8 0.31 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.663 0 O-C-N 121.239 -0.913 . . . . 0.0 109.956 179.929 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 1.4 t0 -55.3 -39.36 69.8 Favored 'General case' 0 C--N 1.302 -1.467 0 O-C-N 121.429 -0.794 . . . . 0.0 110.022 179.654 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . 0.401 ' CZ ' ' OE2' ' A' ' 21' ' ' GLU . 66.4 t80 -62.35 -44.69 95.89 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.267 -0.896 . . . . 0.0 109.876 179.63 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.463 ' HB2' ' OH ' ' A' ' 18' ' ' TYR . . . -59.34 -42.9 92.58 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.31 -0.868 . . . . 0.0 110.116 179.887 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.508 HG13 ' OG1' ' B' ' 39' ' ' THR . 71.9 t -73.09 -24.39 20.8 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.382 0 O-C-N 121.209 -0.932 . . . . 0.0 109.977 179.903 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -80.98 -36.64 30.51 Favored 'General case' 0 C--N 1.304 -1.398 0 O-C-N 121.288 -0.883 . . . . 0.0 109.793 -179.911 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . 0.443 ' CD1' ' OE2' ' A' ' 21' ' ' GLU . 61.4 t80 -74.94 -61.28 1.94 Allowed 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.15 -0.969 . . . . 0.0 110.318 -179.826 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . 0.672 ' CE1' HD21 ' A' ' 14' ' ' LEU . 14.9 m-85 -52.15 -51.36 58.47 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.316 -0.865 . . . . 0.0 110.415 -179.925 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . 0.507 ' OG1' HG13 ' B' ' 35' ' ' VAL . 21.2 m -51.91 -43.25 63.32 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.189 -0.944 . . . . 0.0 110.069 179.914 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.73 -30.52 70.03 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.232 -0.918 . . . . 0.0 110.14 179.829 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -57.86 -36.5 72.44 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.235 -0.916 . . . . 0.0 109.966 179.917 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 8.4 mtm180 -50.61 -26.86 5.86 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.321 -0.862 . . . . 0.0 109.933 179.563 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.604 ' O ' ' HB3' ' A' ' 44' ' ' ALA . 1.4 mm-40 -104.16 -61.22 1.47 Allowed 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.501 -0.749 . . . . 0.0 109.855 179.679 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . 0.604 ' HB3' ' O ' ' A' ' 43' ' ' GLU . . . 67.14 -61.63 0.34 Allowed 'General case' 0 N--CA 1.501 2.104 0 O-C-N 121.525 -0.734 . . . . 0.0 110.78 179.816 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.413 ' N ' ' O ' ' A' ' 43' ' ' GLU . 0.0 OUTLIER -52.21 176.1 0.02 OUTLIER 'General case' 0 C--N 1.3 -1.559 0 O-C-N 121.542 -0.724 . . . . 0.0 110.546 -179.058 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 31.1 ttp180 . . . . . 0 N--CA 1.492 1.658 0 CA-C-O 117.992 -1.004 . . . . 0.0 110.164 -179.967 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 1' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.492 1.673 0 CA-C-O 121.312 0.577 . . . . 0.0 110.167 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 2' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 53.59 60.17 3.86 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.197 -0.94 . . . . 0.0 110.111 179.936 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 3' ' ' GLY . . . . . . . . . . . . . . . -106.46 -120.7 4.67 Favored Glycine 0 N--CA 1.49 2.275 0 N-CA-C 109.691 -1.363 . . . . 0.0 109.691 180.0 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 4' ' ' HIS . . . . . . . . . . . . . 1.3 t-160 -126.69 -161.5 1.07 Allowed 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.255 -1.144 . . . . 0.0 110.489 -179.769 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 5' ' ' ILE . . . . . 0.948 HD13 ' N ' ' B' ' 6' ' ' GLN . 0.0 OUTLIER -100.03 146.93 8.07 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.561 0 O-C-N 121.489 -0.757 . . . . 0.0 109.802 179.971 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 6' ' ' GLN . . . . . 0.948 ' N ' HD13 ' B' ' 5' ' ' ILE . 8.4 mt-30 -128.46 155.64 44.47 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.08 -1.013 . . . . 0.0 110.704 -179.483 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 7' ' ' ILE . . . . . 0.577 ' CD1' HD11 ' A' ' 23' ' ' LEU . 33.8 mm -48.37 128.64 13.02 Favored Pre-proline 0 N--CA 1.495 1.794 0 O-C-N 121.268 -0.895 . . . . 0.0 110.581 -179.949 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 48.8 Cg_endo -75.88 117.85 4.85 Favored 'Trans proline' 0 C--N 1.314 -1.26 0 O-C-N 123.469 1.247 . . . . 0.0 110.32 179.811 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 9' ' ' PRO . . . . . . . . . . . . . 46.1 Cg_endo -73.27 153.83 51.18 Favored 'Trans proline' 0 C--N 1.312 -1.36 0 O-C-N 123.535 1.282 . . . . 0.0 110.396 -179.854 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 117.76 -23.38 9.5 Favored Glycine 0 N--CA 1.49 2.282 0 N-CA-C 109.508 -1.437 . . . . 0.0 109.508 -179.863 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . 0.432 HD21 HG11 ' A' ' 22' ' ' VAL . 0.2 OUTLIER -73.5 -46.74 46.11 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.229 -1.16 . . . . 0.0 110.215 -179.961 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 95.6 m -54.78 -30.0 55.72 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.156 -0.965 . . . . 0.0 110.138 -179.955 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 4.4 tt0 -64.59 -48.77 73.71 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.314 -0.866 . . . . 0.0 110.18 179.999 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -68.82 -31.02 69.7 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.3 -0.875 . . . . 0.0 110.23 179.901 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . 0.638 HD11 HD22 ' A' ' 15' ' ' LEU . 2.1 mm? -65.27 -55.38 18.69 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.223 -0.923 . . . . 0.0 110.254 -179.978 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 16' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -53.11 -45.16 68.16 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.26 -0.9 . . . . 0.0 110.177 179.837 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 17' ' ' GLY . . . . . . . . . . . . . . . -56.35 -36.88 71.22 Favored Glycine 0 N--CA 1.49 2.285 0 N-CA-C 109.256 -1.538 . . . . 0.0 109.256 179.733 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 18' ' ' TYR . . . . . . . . . . . . . 38.5 t80 -73.41 -44.88 57.47 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.386 -1.067 . . . . 0.0 110.063 179.811 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 19' ' ' THR . . . . . 0.801 ' O ' HD23 ' B' ' 23' ' ' LEU . 52.2 m -57.28 -23.31 47.55 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.239 -0.913 . . . . 0.0 110.05 179.923 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 20' ' ' VAL . . . . . . . . . . . . . 37.6 t -78.58 -70.34 0.38 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.649 0 O-C-N 121.409 -0.807 . . . . 0.0 110.143 -179.982 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 21' ' ' GLU . . . . . 0.444 ' HG3' HG23 ' B' ' 22' ' ' VAL . 10.2 pt-20 -44.58 -42.81 7.63 Favored 'General case' 0 N--CA 1.497 1.906 0 O-C-N 121.514 -0.741 . . . . 0.0 111.065 -179.507 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 22' ' ' VAL . . . . . 0.444 HG23 ' HG3' ' B' ' 21' ' ' GLU . 84.7 t -66.23 -34.59 71.21 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.551 0 O-C-N 121.051 -1.031 . . . . 0.0 109.64 179.556 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 23' ' ' LEU . . . . . 0.801 HD23 ' O ' ' B' ' 19' ' ' THR . 1.8 mm? -75.47 -28.72 59.36 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.342 -0.849 . . . . 0.0 109.923 179.802 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -90.58 -65.2 1.04 Allowed 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.377 -0.827 . . . . 0.0 110.187 -179.876 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 25' ' ' GLN . . . . . 0.446 ' CG ' ' O ' ' B' ' 25' ' ' GLN . 1.9 tt0 -85.29 56.56 4.0 Favored 'General case' 0 C--N 1.305 -1.35 0 O-C-N 121.114 -0.991 . . . . 0.0 109.845 179.911 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 10.1 mt-30 -38.29 98.8 0.17 Allowed Pre-proline 0 N--CA 1.499 1.986 0 O-C-N 121.896 -0.503 . . . . 0.0 111.56 -179.717 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 27' ' ' PRO . . . . . . . . . . . . . 47.3 Cg_endo -74.26 160.05 42.86 Favored 'Trans proline' 0 C--N 1.311 -1.421 0 O-C-N 123.909 1.478 . . . . 0.0 110.41 -179.909 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 44.4 Cg_endo -71.39 -28.16 18.41 Favored 'Trans proline' 0 C--N 1.312 -1.363 0 O-C-N 123.677 1.356 . . . . 0.0 109.967 179.691 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -146.59 112.38 5.67 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.392 -0.818 . . . . 0.0 109.926 179.695 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 30' ' ' LEU . . . . . 0.471 HD23 HD13 ' A' ' 14' ' ' LEU . 1.7 tp -57.09 -33.74 67.61 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.226 -0.921 . . . . 0.0 109.882 -179.994 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 47.5 t -53.55 -55.9 11.13 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.653 0 O-C-N 121.353 -0.842 . . . . 0.0 109.898 179.59 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -65.21 -40.35 94.03 Favored 'General case' 0 C--N 1.301 -1.506 0 O-C-N 121.58 -0.7 . . . . 0.0 110.191 -179.93 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 33' ' ' PHE . . . . . 0.443 ' CE2' HG22 ' B' ' 22' ' ' VAL . 79.3 t80 -63.83 -43.29 96.64 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.214 -0.928 . . . . 0.0 109.757 179.642 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -59.01 -38.69 79.8 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.31 -0.868 . . . . 0.0 110.109 179.846 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 35' ' ' VAL . . . . . 0.507 HG13 ' OG1' ' A' ' 39' ' ' THR . 70.7 t -79.84 -25.57 12.1 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.358 0 O-C-N 121.245 -0.909 . . . . 0.0 109.901 179.791 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -81.88 -36.83 27.76 Favored 'General case' 0 C--N 1.304 -1.391 0 O-C-N 121.297 -0.877 . . . . 0.0 110.112 -179.791 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 37' ' ' TYR . . . . . 0.429 ' CZ ' ' OE1' ' B' ' 21' ' ' GLU . 87.5 t80 -76.1 -59.52 2.73 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.043 -1.036 . . . . 0.0 110.629 -179.658 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 38' ' ' PHE . . . . . 0.457 ' HB3' ' CG2' ' A' ' 35' ' ' VAL . 4.3 m-85 -55.48 -46.38 76.87 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.232 -0.917 . . . . 0.0 110.655 -179.554 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 39' ' ' THR . . . . . 0.508 ' OG1' HG13 ' A' ' 35' ' ' VAL . 8.7 m -53.23 -48.73 67.94 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 120.939 -1.101 . . . . 0.0 109.975 179.993 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -55.74 -42.46 75.43 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.222 -0.924 . . . . 0.0 110.255 179.989 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 1.6 mt -54.56 -40.96 69.25 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.206 -0.934 . . . . 0.0 109.913 179.75 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.16 -25.46 67.77 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.233 -0.917 . . . . 0.0 109.907 179.79 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 43' ' ' GLU . . . . . . . . . . . . . 6.9 mm-40 -94.78 -28.1 15.44 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.364 -0.835 . . . . 0.0 110.103 179.798 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -75.82 -66.69 0.75 Allowed 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.367 -0.833 . . . . 0.0 110.317 179.929 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 45' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -50.83 157.48 0.8 Allowed 'General case' 0 N--CA 1.487 1.401 0 O-C-N 121.529 -0.732 . . . . 0.0 110.546 -179.222 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 5.4 mmm180 . . . . . 0 N--CA 1.492 1.633 0 CA-C-O 117.934 -1.032 . . . . 0.0 110.186 -179.912 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' C' C ' 1' ' ' LEU . . . . . 0.41 ' O ' ' N ' ' C' ' 3' ' ' ILE . 5.5 mt . . . . . 0 N--CA 1.491 1.597 0 CA-C-O 121.106 0.479 . . . . 0.0 110.199 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 2' ' ' LEU . . . . . 0.487 ' HG ' HD13 ' A' ' 23' ' ' LEU . 0.6 OUTLIER 67.28 -63.44 0.29 Allowed 'General case' 0 N--CA 1.501 2.111 0 O-C-N 121.44 -0.788 . . . . 0.0 110.419 -179.958 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' C' C ' 3' ' ' ILE . . . . . 0.41 ' N ' ' O ' ' C' ' 1' ' ' LEU . 49.3 mm -66.3 -53.93 31.57 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.636 0 O-C-N 121.078 -1.014 . . . . 0.0 110.254 -179.895 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 4' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -51.77 -38.03 53.85 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.248 -0.908 . . . . 0.0 110.327 -179.981 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 5' ' ' THR . . . . . . . . . . . . . 93.1 m -72.62 -48.42 39.75 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.387 -0.821 . . . . 0.0 110.364 -179.921 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 6' ' ' ALA . . . . . 0.433 ' O ' HG12 ' C' ' 10' ' ' VAL . . . -56.35 -25.65 49.99 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.254 -0.903 . . . . 0.0 110.477 -179.781 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 7' ' ' SER . . . . . . . . . . . . . 63.1 m -83.79 -39.12 20.41 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.124 -0.985 . . . . 0.0 110.267 -179.897 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 8' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -75.39 -37.43 60.52 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.18 -0.95 . . . . 0.0 110.107 179.923 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 9' ' ' LEU . . . . . . . . . . . . . 2.6 tp -66.34 -56.68 9.96 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.246 -0.909 . . . . 0.0 110.065 179.85 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 10' ' ' VAL . . . . . 0.561 HG23 HG13 ' C' ' 14' ' ' ILE . 10.9 p -51.64 -28.38 8.9 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.597 0 O-C-N 121.309 -0.869 . . . . 0.0 110.405 179.966 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 11' ' ' LYS . . . . . . . . . . . . . 8.9 mttm -67.98 -49.0 64.25 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.266 -0.897 . . . . 0.0 110.269 179.969 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 12' ' ' ASN . . . . . . . . . . . . . 28.4 m-20 -93.65 -0.31 56.16 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.269 -0.895 . . . . 0.0 110.761 179.985 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 13' ' ' ALA . . . . . . . . . . . . . . . -107.51 -14.87 14.74 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 120.957 -1.089 . . . . 0.0 110.485 179.989 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 14' ' ' ILE . . . . . 0.561 HG13 HG23 ' C' ' 10' ' ' VAL . 47.9 mm -119.76 -35.84 1.58 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.689 0 O-C-N 121.105 -0.997 . . . . 0.0 110.222 -179.852 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 15' ' ' GLN . . . . . 0.549 ' HA ' HG22 ' C' ' 18' ' ' ILE . 7.6 mt-30 -106.53 30.11 6.31 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.226 -0.921 . . . . 0.0 110.222 -179.979 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 16' ' ' LEU . . . . . 0.452 HD23 ' H ' ' C' ' 16' ' ' LEU . 0.6 OUTLIER -71.59 -18.54 62.22 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.293 -0.88 . . . . 0.0 110.556 -179.903 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' C' C ' 17' ' ' SER . . . . . . . . . . . . . 2.4 t -112.82 -57.11 2.33 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.122 -0.987 . . . . 0.0 110.365 -179.91 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 18' ' ' ILE . . . . . 0.549 HG22 ' HA ' ' C' ' 15' ' ' GLN . 0.6 OUTLIER -54.33 -31.64 22.79 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.597 0 O-C-N 121.259 -0.9 . . . . 0.0 110.212 179.994 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' C' C ' 19' ' ' GLU . . . . . . . . . . . . . 20.2 tt0 -114.65 55.84 0.74 Allowed 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.147 -0.971 . . . . 0.0 110.182 179.992 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 20' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -169.07 -39.21 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.217 -0.927 . . . . 0.0 110.273 179.864 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 21' ' ' LEU . . . . . . . . . . . . . 25.9 mt -93.91 29.68 2.04 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.232 -0.917 . . . . 0.0 110.169 179.989 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 22' ' ' VAL . . . . . . . . . . . . . 88.1 t . . . . . 0 N--CA 1.492 1.626 0 CA-C-O 118.078 -0.963 . . . . 0.0 110.179 -179.96 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.655 0 CA-C-O 121.279 0.561 . . . . 0.0 110.134 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 1.4 mmm -104.58 79.53 1.57 Allowed 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.222 -0.924 . . . . 0.0 110.312 179.939 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -113.3 -141.51 8.0 Favored Glycine 0 N--CA 1.49 2.264 0 N-CA-C 109.463 -1.455 . . . . 0.0 109.463 179.887 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 32.0 p-80 -127.45 154.77 44.67 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.181 -1.187 . . . . 0.0 110.277 179.946 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.417 HG23 ' O ' ' A' ' 5' ' ' ILE . 1.4 tt -116.47 133.58 62.61 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.634 0 O-C-N 121.203 -0.936 . . . . 0.0 110.283 -179.87 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . 0.613 ' C ' HD12 ' A' ' 7' ' ' ILE . 1.5 mt-30 -143.46 173.06 11.96 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.166 -0.959 . . . . 0.0 110.461 -179.908 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . 0.635 ' N ' HD12 ' A' ' 7' ' ' ILE . 4.9 mp -130.18 122.36 20.1 Favored Pre-proline 0 N--CA 1.493 1.693 0 O-C-N 121.209 -0.932 . . . . 0.0 110.191 -179.978 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 48.6 Cg_endo -75.23 120.11 5.86 Favored 'Trans proline' 0 C--N 1.314 -1.281 0 O-C-N 123.472 1.248 . . . . 0.0 110.44 179.881 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 48.1 Cg_endo -77.42 0.75 9.47 Favored 'Trans proline' 0 C--N 1.314 -1.256 0 O-C-N 123.408 1.215 . . . . 0.0 111.565 -179.99 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -65.65 -19.0 66.66 Favored Glycine 0 N--CA 1.491 2.314 0 N-CA-C 109.807 -1.317 . . . . 0.0 109.807 179.994 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.46 HD11 HD13 ' B' ' 30' ' ' LEU . 1.7 mp -84.36 -24.36 29.74 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.152 -1.205 . . . . 0.0 110.492 -179.739 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 71.5 m -54.8 -57.14 12.77 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.153 -0.967 . . . . 0.0 110.589 -179.754 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -56.94 -48.71 77.65 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.276 -0.89 . . . . 0.0 110.631 -179.593 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.617 HD22 ' CD2' ' B' ' 30' ' ' LEU . 3.5 tp -50.75 -58.13 6.66 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.277 -0.889 . . . . 0.0 110.692 -179.489 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 2.4 mp -56.36 -49.41 74.49 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.199 -0.938 . . . . 0.0 110.389 -179.752 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . 0.65 ' OE1' HG21 ' C' ' 10' ' ' VAL . 0.9 OUTLIER -50.41 -49.15 55.44 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.185 -0.947 . . . . 0.0 110.324 179.981 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -55.25 -38.84 69.24 Favored Glycine 0 N--CA 1.491 2.333 0 N-CA-C 109.055 -1.618 . . . . 0.0 109.055 179.658 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . 0.763 ' O ' HG23 ' A' ' 22' ' ' VAL . 24.7 t80 -67.42 -50.65 58.53 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.407 -1.055 . . . . 0.0 109.708 179.492 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 70.9 m -57.01 -32.83 66.54 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.282 -0.886 . . . . 0.0 109.807 179.621 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.571 HG23 ' O ' ' A' ' 16' ' ' GLN . 44.8 t -63.46 -73.76 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.49 1.545 0 O-C-N 121.357 -0.839 . . . . 0.0 110.22 179.959 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.414 ' OE1' ' CE1' ' A' ' 37' ' ' TYR . 10.3 pt-20 -45.06 -43.26 9.3 Favored 'General case' 0 N--CA 1.498 1.931 0 O-C-N 121.461 -0.774 . . . . 0.0 111.035 -179.575 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.763 HG23 ' O ' ' A' ' 18' ' ' TYR . 94.6 t -51.92 -53.84 15.99 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.713 0 O-C-N 121.1 -1.0 . . . . 0.0 110.144 179.888 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.462 HD21 HG13 ' B' ' 7' ' ' ILE . 0.9 OUTLIER -56.81 -35.27 68.57 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.271 -0.893 . . . . 0.0 110.115 179.874 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 1.4 mmt180 -77.34 -62.9 1.5 Allowed 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.31 -0.869 . . . . 0.0 110.331 -179.925 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 34.9 mm-40 -57.84 -39.34 77.45 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.218 -0.926 . . . . 0.0 110.26 -179.955 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 51.79 56.93 16.34 Favored Pre-proline 0 N--CA 1.492 1.661 0 O-C-N 121.235 -0.916 . . . . 0.0 110.102 -179.794 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 43.8 Cg_endo -70.06 161.06 47.39 Favored 'Trans proline' 0 C--N 1.311 -1.403 0 O-C-N 123.735 1.387 . . . . 0.0 110.51 -179.996 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 45.4 Cg_endo -71.5 -34.04 10.0 Favored 'Trans proline' 0 C--N 1.311 -1.401 0 O-C-N 123.694 1.365 . . . . 0.0 110.23 -179.976 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -130.12 119.45 23.04 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.325 -0.859 . . . . 0.0 110.264 -179.847 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 5.3 tp -75.28 -35.57 61.29 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.342 -0.848 . . . . 0.0 109.816 179.802 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.611 HG12 ' HD2' ' B' ' 42' ' ' ARG . 44.9 t -51.55 -59.18 1.46 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.695 0 O-C-N 121.279 -0.888 . . . . 0.0 109.855 179.564 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 6.0 t0 -58.55 -40.1 82.08 Favored 'General case' 0 C--N 1.301 -1.529 0 O-C-N 121.683 -0.636 . . . . 0.0 109.932 179.753 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 42.4 t80 -62.05 -48.78 78.7 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.157 -0.965 . . . . 0.0 109.511 179.448 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.627 ' HB2' ' OH ' ' A' ' 18' ' ' TYR . . . -52.97 -38.2 61.94 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.389 -0.819 . . . . 0.0 110.121 179.716 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.546 HG13 ' OG1' ' B' ' 39' ' ' THR . 97.1 t -70.06 -35.73 65.24 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.367 0 O-C-N 121.25 -0.906 . . . . 0.0 110.174 -179.958 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -83.14 -20.17 35.28 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.294 -0.879 . . . . 0.0 110.444 -179.989 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . 0.414 ' CE1' ' OE1' ' A' ' 21' ' ' GLU . 33.7 t80 -73.31 -62.21 1.55 Allowed 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.205 -0.935 . . . . 0.0 110.565 -179.665 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . 0.45 ' CE1' HD21 ' A' ' 14' ' ' LEU . 29.3 m-85 -67.18 -45.21 77.63 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.204 -0.935 . . . . 0.0 110.644 -179.571 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . 0.542 ' OG1' HG13 ' B' ' 35' ' ' VAL . 42.7 m -52.53 -39.28 61.21 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.156 -0.965 . . . . 0.0 110.252 -179.939 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 3.6 mtp85 -74.37 -34.59 63.41 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.204 -0.935 . . . . 0.0 110.008 179.773 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 10.5 tp -65.97 -19.95 66.04 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.38 -0.825 . . . . 0.0 110.396 -179.939 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -82.69 -21.91 34.73 Favored 'General case' 0 C--N 1.305 -1.367 0 O-C-N 121.139 -0.976 . . . . 0.0 109.915 179.977 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 12.2 mt-10 -104.21 -4.99 22.35 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.194 -0.941 . . . . 0.0 110.816 -179.983 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -108.7 -75.93 0.62 Allowed 'General case' 0 N--CA 1.492 1.652 0 O-C-N 120.933 -1.104 . . . . 0.0 110.318 179.93 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -56.08 158.07 4.2 Favored 'General case' 0 C--N 1.304 -1.405 0 O-C-N 121.515 -0.74 . . . . 0.0 110.237 -179.308 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.576 0 CA-C-O 118.028 -0.987 . . . . 0.0 110.265 -179.976 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 1' ' ' HIS . . . . . . . . . . . . . 51.3 m80 . . . . . 0 N--CA 1.491 1.621 0 CA-C-O 121.273 0.559 . . . . 0.0 110.147 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 2' ' ' MET . . . . . . . . . . . . . 2.9 tpt -102.66 113.97 27.82 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.354 -0.841 . . . . 0.0 110.109 -179.965 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 3' ' ' GLY . . . . . . . . . . . . . . . -169.94 53.57 0.2 Allowed Glycine 0 N--CA 1.49 2.271 0 N-CA-C 109.458 -1.457 . . . . 0.0 109.458 -179.935 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 4' ' ' HIS . . . . . 0.464 ' N ' HD12 ' B' ' 5' ' ' ILE . 0.1 OUTLIER -103.67 53.79 0.75 Allowed 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.263 -1.14 . . . . 0.0 110.39 -179.851 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 5' ' ' ILE . . . . . 0.635 ' N ' HD12 ' B' ' 5' ' ' ILE . 5.3 mp -110.42 -11.89 11.41 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.61 0 O-C-N 121.163 -0.961 . . . . 0.0 110.711 179.837 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 6' ' ' GLN . . . . . 0.714 ' C ' HD12 ' B' ' 7' ' ' ILE . 0.0 OUTLIER 179.65 33.12 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.347 -0.846 . . . . 0.0 110.492 179.363 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 7' ' ' ILE . . . . . 0.714 HD12 ' C ' ' B' ' 6' ' ' GLN . 4.3 mp -145.39 100.37 4.45 Favored Pre-proline 0 N--CA 1.493 1.689 0 O-C-N 121.216 -0.928 . . . . 0.0 110.43 -179.905 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 45.0 Cg_endo -72.43 139.34 31.48 Favored 'Trans proline' 0 C--N 1.312 -1.347 0 O-C-N 123.604 1.318 . . . . 0.0 110.628 179.885 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 9' ' ' PRO . . . . . . . . . . . . . 47.9 Cg_endo -73.72 156.82 48.68 Favored 'Trans proline' 0 C--N 1.312 -1.369 0 O-C-N 123.654 1.344 . . . . 0.0 110.248 179.675 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 135.25 -31.27 2.71 Favored Glycine 0 N--CA 1.49 2.28 0 N-CA-C 109.606 -1.398 . . . . 0.0 109.606 179.884 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 1.8 mp -78.32 -22.96 47.32 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.276 -1.132 . . . . 0.0 110.151 179.941 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 89.3 m -54.4 -42.15 70.08 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.378 -0.826 . . . . 0.0 110.302 179.985 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -79.4 -36.09 39.68 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.282 -0.886 . . . . 0.0 110.274 179.976 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 2.8 tp -65.2 -49.95 67.78 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.235 -0.916 . . . . 0.0 110.151 -179.994 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 6.0 mp -62.78 -50.29 71.62 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.319 -0.863 . . . . 0.0 110.391 -179.971 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 16' ' ' GLN . . . . . 0.713 ' O ' HG23 ' B' ' 20' ' ' VAL . 1.1 mt-30 -52.04 -40.5 61.18 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.153 -0.967 . . . . 0.0 110.139 179.972 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 17' ' ' GLY . . . . . . . . . . . . . . . -57.6 -51.67 56.51 Favored Glycine 0 N--CA 1.491 2.301 0 N-CA-C 109.169 -1.572 . . . . 0.0 109.169 179.649 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 18' ' ' TYR . . . . . 0.904 ' OH ' ' HB2' ' B' ' 34' ' ' ALA . 12.0 t80 -54.04 -38.99 65.8 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.369 -1.077 . . . . 0.0 110.19 179.891 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 51.9 m -71.03 -32.94 69.84 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.391 -0.818 . . . . 0.0 110.307 -179.862 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 20' ' ' VAL . . . . . 0.713 HG23 ' O ' ' B' ' 16' ' ' GLN . 90.3 t -70.1 -17.38 20.91 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.625 0 O-C-N 121.216 -0.927 . . . . 0.0 110.473 -179.892 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 21' ' ' GLU . . . . . 0.472 ' OE1' ' CD1' ' B' ' 37' ' ' TYR . 0.7 OUTLIER -92.23 -57.79 2.59 Favored 'General case' 0 N--CA 1.497 1.905 0 O-C-N 121.09 -1.006 . . . . 0.0 109.439 -179.927 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 22' ' ' VAL . . . . . . . . . . . . . 96.5 t -49.85 -26.34 2.76 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.528 0 O-C-N 121.565 -0.71 . . . . 0.0 110.476 -179.952 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 1.2 mt -84.78 -47.34 10.49 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.214 -0.929 . . . . 0.0 110.076 179.722 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.47 -66.6 0.64 Allowed 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.205 -0.934 . . . . 0.0 110.178 179.82 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 25' ' ' GLN . . . . . 0.429 ' O ' ' CG ' ' B' ' 25' ' ' GLN . 0.2 OUTLIER -91.68 59.69 3.8 Favored 'General case' 0 C--N 1.306 -1.292 0 O-C-N 121.039 -1.038 . . . . 0.0 109.917 179.903 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 21.2 mt-30 -38.42 98.63 0.17 Allowed Pre-proline 0 N--CA 1.5 2.056 0 O-C-N 122.042 -0.411 . . . . 0.0 111.676 -179.646 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 27' ' ' PRO . . . . . 0.515 ' HG3' ' CD2' ' B' ' 33' ' ' PHE . 49.4 Cg_endo -77.42 163.66 29.57 Favored 'Trans proline' 0 C--N 1.311 -1.422 0 O-C-N 123.821 1.432 . . . . 0.0 110.55 -179.986 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 45.1 Cg_endo -71.84 -52.65 0.19 Allowed 'Trans proline' 0 C--N 1.313 -1.34 0 O-C-N 123.679 1.357 . . . . 0.0 110.745 -179.946 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 58.0 m-20 -117.53 116.83 27.89 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.12 -0.988 . . . . 0.0 110.31 -179.826 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 30' ' ' LEU . . . . . 0.617 ' CD2' HD22 ' A' ' 14' ' ' LEU . 0.5 OUTLIER -60.5 -45.49 93.59 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.28 -0.888 . . . . 0.0 110.169 179.991 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 31' ' ' VAL . . . . . 0.504 ' O ' HG23 ' B' ' 35' ' ' VAL . 43.5 t -50.6 -63.05 0.44 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.761 0 O-C-N 121.233 -0.917 . . . . 0.0 109.964 179.737 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 4.8 t0 -57.92 -33.37 68.72 Favored 'General case' 0 C--N 1.303 -1.43 0 O-C-N 121.477 -0.764 . . . . 0.0 109.855 179.711 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 33' ' ' PHE . . . . . 0.515 ' CD2' ' HG3' ' B' ' 27' ' ' PRO . 32.7 t80 -67.24 -51.32 54.56 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.316 -0.865 . . . . 0.0 109.477 179.38 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 34' ' ' ALA . . . . . 0.904 ' HB2' ' OH ' ' B' ' 18' ' ' TYR . . . -54.05 -32.14 53.67 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.399 -0.813 . . . . 0.0 109.961 179.698 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 35' ' ' VAL . . . . . 0.542 HG13 ' OG1' ' A' ' 39' ' ' THR . 87.5 t -71.8 -38.19 64.69 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.355 0 O-C-N 121.277 -0.889 . . . . 0.0 110.117 -179.981 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -73.45 -34.36 65.36 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.182 -0.949 . . . . 0.0 110.23 179.922 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 37' ' ' TYR . . . . . 0.472 ' CD1' ' OE1' ' B' ' 21' ' ' GLU . 19.1 t80 -70.57 -66.62 0.58 Allowed 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.24 -0.913 . . . . 0.0 110.328 -179.945 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 24.8 m-85 -51.36 -53.49 35.78 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.24 -0.912 . . . . 0.0 110.428 -179.877 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 39' ' ' THR . . . . . 0.546 ' OG1' HG13 ' A' ' 35' ' ' VAL . 51.6 m -51.27 -30.88 19.25 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.152 -0.968 . . . . 0.0 110.006 179.79 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -82.83 -28.19 30.33 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.306 -0.871 . . . . 0.0 109.799 179.642 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -54.09 -43.87 70.71 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.4 -0.813 . . . . 0.0 110.094 179.817 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 42' ' ' ARG . . . . . 0.611 ' HD2' HG12 ' A' ' 31' ' ' VAL . 0.0 OUTLIER -51.9 -30.3 23.62 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.27 -0.894 . . . . 0.0 110.645 -179.733 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 43' ' ' GLU . . . . . . . . . . . . . 18.4 mm-40 -99.21 -14.53 19.26 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.126 -0.984 . . . . 0.0 110.803 -179.738 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -59.27 -77.49 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.084 -1.01 . . . . 0.0 110.524 -179.864 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 45' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.32 -31.3 32.55 Favored 'General case' 0 C--N 1.303 -1.426 0 O-C-N 121.523 -0.735 . . . . 0.0 110.547 -179.185 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 4.0 tmt_? . . . . . 0 N--CA 1.491 1.6 0 CA-C-O 117.968 -1.015 . . . . 0.0 110.313 -179.887 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' C' C ' 1' ' ' LEU . . . . . 0.445 ' O ' HG22 ' C' ' 3' ' ' ILE . 1.2 mp . . . . . 0 N--CA 1.491 1.605 0 CA-C-O 121.084 0.469 . . . . 0.0 110.285 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 2' ' ' LEU . . . . . 0.434 HD21 HD22 ' A' ' 23' ' ' LEU . 0.5 OUTLIER 64.05 -73.47 0.05 Allowed 'General case' 0 N--CA 1.499 2.013 0 O-C-N 121.465 -0.772 . . . . 0.0 110.528 -179.939 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' C' C ' 3' ' ' ILE . . . . . 0.445 HG22 ' O ' ' C' ' 1' ' ' LEU . 15.1 tt -55.03 -22.97 12.05 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.68 0 O-C-N 121.235 -0.916 . . . . 0.0 110.684 -179.78 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 4' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -86.34 -0.23 55.42 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.121 -0.987 . . . . 0.0 110.841 -179.769 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 5' ' ' THR . . . . . . . . . . . . . 86.2 m -125.01 -34.84 2.73 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.043 -1.036 . . . . 0.0 110.369 -179.913 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 6' ' ' ALA . . . . . . . . . . . . . . . -72.28 -38.06 68.88 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.154 -0.966 . . . . 0.0 110.383 -179.811 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 7' ' ' SER . . . . . . . . . . . . . 16.2 m -62.42 -45.84 91.28 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.216 -0.927 . . . . 0.0 110.479 -179.794 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 8' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -72.63 -25.2 61.21 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.2 -0.938 . . . . 0.0 110.37 -179.742 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 9' ' ' LEU . . . . . . . . . . . . . 1.7 tp -61.88 -51.21 69.13 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.296 -0.878 . . . . 0.0 110.194 179.978 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 10' ' ' VAL . . . . . 0.65 HG21 ' OE1' ' A' ' 16' ' ' GLN . 88.5 t -54.31 -47.97 68.3 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.645 0 O-C-N 121.232 -0.918 . . . . 0.0 110.162 179.881 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 11' ' ' LYS . . . . . 0.446 ' HA ' HG22 ' C' ' 14' ' ' ILE . 0.0 OUTLIER -52.98 -46.14 68.13 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.309 -0.869 . . . . 0.0 110.328 179.996 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' C' C ' 12' ' ' ASN . . . . . . . . . . . . . 48.6 t-20 -73.5 -18.01 61.15 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.221 -0.924 . . . . 0.0 110.424 -179.86 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 13' ' ' ALA . . . . . . . . . . . . . . . -105.03 5.0 32.21 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.118 -0.989 . . . . 0.0 110.8 -179.981 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 14' ' ' ILE . . . . . 0.446 HG22 ' HA ' ' C' ' 11' ' ' LYS . 9.7 tp -120.32 -16.54 6.82 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.605 0 O-C-N 120.937 -1.102 . . . . 0.0 110.73 -179.688 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 15' ' ' GLN . . . . . 0.404 ' O ' ' CB ' ' C' ' 19' ' ' GLU . 3.5 mt-30 -92.87 -39.8 10.98 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.007 -1.058 . . . . 0.0 110.189 -179.894 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 16' ' ' LEU . . . . . 0.459 ' O ' ' N ' ' C' ' 18' ' ' ILE . 4.3 mp -56.69 -169.9 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.283 -0.886 . . . . 0.0 109.909 179.761 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 17' ' ' SER . . . . . 0.429 ' HB3' ' O ' ' C' ' 16' ' ' LEU . 36.4 t 57.67 -82.34 0.02 OUTLIER 'General case' 0 N--CA 1.497 1.906 0 O-C-N 121.595 -0.69 . . . . 0.0 110.633 -179.912 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 18' ' ' ILE . . . . . 0.459 ' N ' ' O ' ' C' ' 16' ' ' LEU . 29.5 pt -60.98 -33.82 57.33 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.628 0 O-C-N 120.904 -1.123 . . . . 0.0 109.914 179.978 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 19' ' ' GLU . . . . . 0.424 ' N ' HG13 ' C' ' 18' ' ' ILE . 3.3 tt0 -105.33 19.41 20.63 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.237 -0.915 . . . . 0.0 110.08 179.727 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 20' ' ' GLN . . . . . . . . . . . . . 15.3 tt0 -121.3 -39.27 2.69 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.211 -0.931 . . . . 0.0 109.988 179.982 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 21' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -93.85 -29.98 15.04 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.244 -0.91 . . . . 0.0 110.126 179.92 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 22' ' ' VAL . . . . . . . . . . . . . 65.1 t . . . . . 0 N--CA 1.491 1.618 0 CA-C-O 117.954 -1.022 . . . . 0.0 110.137 179.973 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 26.1 m80 . . . . . 0 N--CA 1.492 1.645 0 CA-C-O 121.159 0.504 . . . . 0.0 110.148 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 4.7 ptp -103.87 43.81 1.06 Allowed 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.229 -0.919 . . . . 0.0 110.21 179.963 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -156.78 103.48 0.24 Allowed Glycine 0 N--CA 1.49 2.278 0 N-CA-C 109.286 -1.525 . . . . 0.0 109.286 179.999 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . 0.637 ' C ' HD12 ' A' ' 5' ' ' ILE . 2.9 t60 -114.87 170.19 8.52 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.117 -1.225 . . . . 0.0 110.596 -179.668 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.691 ' N ' HD12 ' A' ' 5' ' ' ILE . 5.2 mp -134.39 172.05 16.83 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.66 0 O-C-N 121.431 -0.793 . . . . 0.0 109.748 179.994 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . 0.517 ' N ' HG22 ' A' ' 5' ' ' ILE . 3.1 tt0 -99.06 31.54 2.99 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.028 -1.045 . . . . 0.0 110.226 -179.707 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . 0.481 HD12 HG22 ' A' ' 5' ' ' ILE . 3.3 mp -135.65 103.52 10.16 Favored Pre-proline 0 N--CA 1.49 1.57 0 O-C-N 121.357 -0.839 . . . . 0.0 109.75 179.584 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 45.4 Cg_endo -71.29 133.4 22.71 Favored 'Trans proline' 0 C--N 1.312 -1.351 0 O-C-N 123.71 1.374 . . . . 0.0 110.548 -179.798 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 47.9 Cg_endo -74.15 174.17 12.89 Favored 'Trans proline' 0 C--N 1.313 -1.314 0 O-C-N 123.582 1.306 . . . . 0.0 110.511 -179.969 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 94.74 -22.13 39.5 Favored Glycine 0 N--CA 1.491 2.321 0 N-CA-C 109.729 -1.348 . . . . 0.0 109.729 179.955 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -70.37 -29.68 66.41 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.2 -1.176 . . . . 0.0 110.352 -179.898 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . . . . . . . . . 21.9 m -62.14 -60.65 3.28 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.229 -0.919 . . . . 0.0 110.317 -179.885 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.425 ' HG3' ' N ' ' A' ' 14' ' ' LEU . 4.5 pt-20 -52.24 -25.22 8.75 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.278 -0.889 . . . . 0.0 110.391 -179.857 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.66 HD13 HD23 ' B' ' 30' ' ' LEU . 9.0 mt -79.48 -50.1 11.27 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.235 -0.916 . . . . 0.0 110.508 -179.889 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.532 ' CD1' HD22 ' B' ' 15' ' ' LEU . 3.9 mm? -70.75 -50.0 40.72 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.212 -0.93 . . . . 0.0 110.269 -179.853 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . 0.728 ' HG2' ' HB1' ' C' ' 6' ' ' ALA . 1.2 tt0 -57.42 -42.49 82.44 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.274 -0.891 . . . . 0.0 109.949 179.929 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -59.04 -41.49 96.49 Favored Glycine 0 N--CA 1.492 2.371 0 N-CA-C 109.592 -1.403 . . . . 0.0 109.592 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . 0.59 ' O ' HG23 ' A' ' 22' ' ' VAL . 60.4 t80 -68.99 -43.74 74.26 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.159 -1.201 . . . . 0.0 109.959 179.868 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 86.0 m -58.69 -28.27 65.6 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.361 -0.837 . . . . 0.0 110.136 179.883 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 25.4 t -75.4 -70.89 0.28 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.653 0 O-C-N 121.265 -0.897 . . . . 0.0 110.031 179.961 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -47.08 -45.59 21.97 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.341 -0.849 . . . . 0.0 111.032 -179.433 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.59 HG23 ' O ' ' A' ' 18' ' ' TYR . 81.8 t -54.8 -57.63 6.17 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.586 0 O-C-N 120.912 -1.118 . . . . 0.0 110.13 179.96 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.577 HD22 ' CG2' ' B' ' 7' ' ' ILE . 8.4 mt -68.07 -15.15 63.47 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.369 -0.832 . . . . 0.0 110.686 -179.799 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 5.5 tpt180 -80.37 -58.85 2.94 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.088 -1.008 . . . . 0.0 110.47 -179.832 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . . . . . . . . . 5.9 pt20 -81.65 -22.18 37.71 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.241 -0.912 . . . . 0.0 110.443 -179.738 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER 53.22 75.65 0.61 Allowed Pre-proline 0 N--CA 1.491 1.582 0 O-C-N 121.165 -0.959 . . . . 0.0 110.162 -179.837 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . . . . . . . . . 45.0 Cg_endo -71.95 156.86 55.78 Favored 'Trans proline' 0 C--N 1.312 -1.369 0 O-C-N 123.563 1.296 . . . . 0.0 110.415 -179.899 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 43.2 Cg_endo -69.74 -24.36 29.87 Favored 'Trans proline' 0 C--N 1.311 -1.43 0 O-C-N 123.712 1.375 . . . . 0.0 110.043 179.693 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -143.44 117.71 9.59 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.353 -0.842 . . . . 0.0 109.902 179.585 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.41 ' CD1' ' OH ' ' A' ' 18' ' ' TYR . 17.4 tp -72.67 -39.11 67.34 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.269 -0.894 . . . . 0.0 110.307 -179.851 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.583 HG12 ' HG2' ' B' ' 42' ' ' ARG . 45.0 t -49.74 -61.71 0.57 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.767 0 O-C-N 121.242 -0.911 . . . . 0.0 110.22 179.933 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . 0.408 ' OD2' ' NH2' ' B' ' 42' ' ' ARG . 7.1 t0 -58.07 -34.73 70.45 Favored 'General case' 0 C--N 1.302 -1.459 0 O-C-N 121.454 -0.779 . . . . 0.0 110.206 -179.906 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . 0.519 ' CE2' HG22 ' A' ' 22' ' ' VAL . 68.6 t80 -66.64 -44.19 82.64 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.173 -0.954 . . . . 0.0 109.557 179.533 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -56.62 -40.53 75.53 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.429 -0.794 . . . . 0.0 110.257 179.685 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.541 HG13 ' OG1' ' B' ' 39' ' ' THR . 90.5 t -75.7 -26.67 18.17 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.423 0 O-C-N 121.232 -0.917 . . . . 0.0 110.164 -179.999 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . 0.428 ' OE1' ' CA ' ' A' ' 36' ' ' GLU . 1.5 tp10 -81.73 -41.94 20.54 Favored 'General case' 0 C--N 1.303 -1.452 0 O-C-N 121.336 -0.853 . . . . 0.0 109.759 -179.88 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 88.4 t80 -69.39 -59.35 3.05 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.211 -0.931 . . . . 0.0 110.356 -179.836 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . 0.403 ' HB3' ' CG2' ' B' ' 35' ' ' VAL . 6.1 m-85 -54.1 -52.42 61.07 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.231 -0.918 . . . . 0.0 110.451 -179.789 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . 0.51 ' OG1' HG13 ' B' ' 35' ' ' VAL . 24.3 m -52.82 -27.51 18.55 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.135 -0.978 . . . . 0.0 109.988 179.973 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.97 -26.53 60.53 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.21 -0.931 . . . . 0.0 109.986 179.758 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -77.67 -34.75 52.88 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.232 -0.917 . . . . 0.0 110.064 179.82 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -55.7 -28.99 58.61 Favored 'General case' 0 C--N 1.306 -1.297 0 O-C-N 121.226 -0.921 . . . . 0.0 109.271 179.484 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.612 ' O ' ' HB3' ' A' ' 44' ' ' ALA . 0.6 OUTLIER -99.32 -59.56 1.7 Allowed 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.522 -0.736 . . . . 0.0 109.638 179.417 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . 0.612 ' HB3' ' O ' ' A' ' 43' ' ' GLU . . . 66.11 -70.32 0.1 Allowed 'General case' 0 N--CA 1.497 1.88 0 CA-C-O 121.734 0.778 . . . . 0.0 110.275 179.822 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.436 ' N ' ' O ' ' A' ' 43' ' ' GLU . 0.0 OUTLIER 41.14 90.62 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.736 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.364 -179.709 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 2.3 mtt180 . . . . . 0 N--CA 1.491 1.611 0 CA-C-O 117.971 -1.014 . . . . 0.0 110.215 -179.964 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 1' ' ' HIS . . . . . . . . . . . . . 93.4 m-70 . . . . . 0 N--CA 1.49 1.561 0 CA-C-O 121.2 0.524 . . . . 0.0 110.226 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 2' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -91.83 -177.73 4.83 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.302 -0.874 . . . . 0.0 110.168 179.996 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 3' ' ' GLY . . . . . . . . . . . . . . . -148.26 -95.82 0.16 Allowed Glycine 0 N--CA 1.49 2.281 0 N-CA-C 109.575 -1.41 . . . . 0.0 109.575 -179.973 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 4' ' ' HIS . . . . . 0.419 ' CD2' ' C ' ' B' ' 4' ' ' HIS . 3.5 p-80 -114.27 173.94 6.2 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.148 -1.207 . . . . 0.0 110.319 -179.983 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 5' ' ' ILE . . . . . . . . . . . . . 44.1 mm -121.31 129.81 75.25 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.667 0 O-C-N 121.35 -0.844 . . . . 0.0 109.859 179.83 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 6' ' ' GLN . . . . . . . . . . . . . 10.9 mt-30 -146.9 131.88 18.17 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.112 -0.993 . . . . 0.0 110.516 -179.796 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 7' ' ' ILE . . . . . 0.577 ' CG2' HD22 ' A' ' 23' ' ' LEU . 1.1 mp -73.44 -60.92 1.54 Allowed Pre-proline 0 N--CA 1.491 1.617 0 O-C-N 121.397 -0.815 . . . . 0.0 110.603 -179.952 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 8' ' ' PRO . . . . . 0.501 ' HD3' ' HB ' ' B' ' 7' ' ' ILE . 44.1 Cg_endo -70.28 111.93 3.04 Favored 'Trans proline' 0 C--N 1.305 -1.756 0 O-C-N 123.573 1.302 . . . . 0.0 110.662 179.747 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 9' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_endo -86.27 123.38 2.26 Favored 'Trans proline' 0 C--N 1.313 -1.322 0 O-C-N 123.597 1.314 . . . . 0.0 111.246 -179.619 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 73.74 2.27 60.49 Favored Glycine 0 N--CA 1.492 2.411 0 C-N-CA 120.262 -0.97 . . . . 0.0 110.887 179.055 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . 0.47 ' CB ' ' HB2' ' B' ' 8' ' ' PRO . 0.1 OUTLIER -90.38 -28.86 18.4 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 120.728 -1.454 . . . . 0.0 110.44 -179.935 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 82.0 m -58.13 -39.87 79.83 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.139 -0.976 . . . . 0.0 110.202 179.891 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -60.64 -40.07 90.6 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.351 -0.843 . . . . 0.0 110.106 179.969 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 14' ' ' LEU . . . . . 0.441 ' HA ' HD13 ' B' ' 14' ' ' LEU . 0.5 OUTLIER -60.19 -42.15 94.44 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.254 -0.903 . . . . 0.0 110.252 -179.975 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . 0.532 HD22 ' CD1' ' A' ' 15' ' ' LEU . 65.1 mt -74.64 -44.21 51.6 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.241 -0.912 . . . . 0.0 109.963 179.956 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 16' ' ' GLN . . . . . 0.563 ' O ' HG23 ' B' ' 20' ' ' VAL . 0.9 OUTLIER -54.09 -37.7 64.54 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.308 -0.87 . . . . 0.0 109.956 179.837 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 17' ' ' GLY . . . . . . . . . . . . . . . -67.99 -49.64 46.34 Favored Glycine 0 N--CA 1.49 2.264 0 N-CA-C 109.397 -1.481 . . . . 0.0 109.397 179.862 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 18' ' ' TYR . . . . . 0.44 ' HA ' ' HG3' ' B' ' 21' ' ' GLU . 18.4 t80 -60.02 -34.89 73.98 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.345 -1.091 . . . . 0.0 110.181 179.895 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 95.4 m -63.87 -33.64 76.14 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.18 -0.95 . . . . 0.0 110.525 -179.912 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 20' ' ' VAL . . . . . 0.563 HG23 ' O ' ' B' ' 16' ' ' GLN . 59.4 t -75.46 -22.68 16.53 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.751 0 O-C-N 121.147 -0.971 . . . . 0.0 110.29 -179.811 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 21' ' ' GLU . . . . . 0.44 ' HG3' ' HA ' ' B' ' 18' ' ' TYR . 0.6 OUTLIER -88.92 -52.89 4.86 Favored 'General case' 0 N--CA 1.497 1.915 0 O-C-N 121.153 -0.967 . . . . 0.0 108.702 179.685 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 22' ' ' VAL . . . . . 0.436 HG13 HD13 ' B' ' 30' ' ' LEU . 57.0 t -50.38 -31.8 8.98 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.5 0 O-C-N 121.665 -0.647 . . . . 0.0 110.07 179.498 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -86.34 -39.26 16.64 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.275 -0.891 . . . . 0.0 110.057 179.758 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 1.8 tpt180 -75.86 -52.23 10.8 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.278 -0.889 . . . . 0.0 110.271 -179.95 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 25' ' ' GLN . . . . . . . . . . . . . 1.9 mm100 -64.04 -40.58 96.61 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.247 -0.908 . . . . 0.0 110.28 -179.961 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 26' ' ' GLN . . . . . 0.401 ' N ' ' CD ' ' B' ' 27' ' ' PRO . 0.2 OUTLIER 51.83 55.71 15.55 Favored Pre-proline 0 N--CA 1.491 1.624 0 O-C-N 121.278 -0.888 . . . . 0.0 110.026 -179.856 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 27' ' ' PRO . . . . . 0.401 ' CD ' ' N ' ' B' ' 26' ' ' GLN . 43.3 Cg_endo -69.6 158.97 55.28 Favored 'Trans proline' 0 C--N 1.313 -1.336 0 O-C-N 123.789 1.415 . . . . 0.0 110.687 -179.629 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_endo -70.0 -22.35 31.11 Favored 'Trans proline' 0 C--N 1.311 -1.406 0 O-C-N 123.724 1.381 . . . . 0.0 110.182 179.811 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 10.4 m-20 -140.2 115.56 9.95 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.369 -0.832 . . . . 0.0 110.123 179.709 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 30' ' ' LEU . . . . . 0.66 HD23 HD13 ' A' ' 14' ' ' LEU . 7.0 tp -72.2 -32.95 67.25 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.297 -0.877 . . . . 0.0 110.008 179.886 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 31' ' ' VAL . . . . . 0.406 ' H ' HG23 ' B' ' 31' ' ' VAL . 33.2 t -57.05 -65.3 0.42 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.715 0 O-C-N 121.316 -0.865 . . . . 0.0 109.879 179.656 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -56.25 -31.74 63.85 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.477 -0.764 . . . . 0.0 109.984 179.868 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 33' ' ' PHE . . . . . . . . . . . . . 47.8 t80 -68.88 -45.48 70.88 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.305 -0.872 . . . . 0.0 109.691 179.462 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -58.49 -37.1 74.84 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.495 -0.753 . . . . 0.0 110.124 179.772 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 35' ' ' VAL . . . . . 0.51 HG13 ' OG1' ' A' ' 39' ' ' THR . 98.3 t -73.2 -46.7 49.7 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.399 0 O-C-N 121.161 -0.962 . . . . 0.0 110.311 179.975 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 4.1 mm-40 -60.14 -44.37 94.99 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.165 -0.959 . . . . 0.0 110.416 -179.85 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 37' ' ' TYR . . . . . . . . . . . . . 28.1 t80 -64.45 -67.94 0.39 Allowed 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.209 -0.932 . . . . 0.0 110.606 -179.72 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 13.1 m-85 -51.12 -48.78 61.69 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.279 -0.888 . . . . 0.0 110.776 -179.552 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 39' ' ' THR . . . . . 0.541 ' OG1' HG13 ' A' ' 35' ' ' VAL . 35.7 m -52.35 -32.86 40.34 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 120.959 -1.088 . . . . 0.0 110.002 -179.816 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -68.59 -41.65 79.33 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.266 -0.896 . . . . 0.0 109.848 179.651 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -55.39 -28.31 53.2 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.261 -0.9 . . . . 0.0 109.818 179.658 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 42' ' ' ARG . . . . . 0.583 ' HG2' HG12 ' A' ' 31' ' ' VAL . 7.2 mmm180 -78.63 -19.85 51.71 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.276 -0.89 . . . . 0.0 110.297 179.843 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 43' ' ' GLU . . . . . . . . . . . . . 7.3 mm-40 -115.31 12.57 16.44 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.136 -0.978 . . . . 0.0 110.649 -179.95 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -82.12 -71.28 0.49 Allowed 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.092 -1.005 . . . . 0.0 110.372 179.928 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 45' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -49.15 134.7 17.46 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.52 -0.738 . . . . 0.0 110.892 -179.192 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 57.3 ttt180 . . . . . 0 N--CA 1.493 1.68 0 CA-C-O 118.053 -0.975 . . . . 0.0 110.429 179.751 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' C' C ' 1' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.614 0 CA-C-O 121.269 0.557 . . . . 0.0 110.226 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 2' ' ' LEU . . . . . 0.464 HD21 HG21 ' B' ' 7' ' ' ILE . 0.3 OUTLIER -100.47 -21.81 15.23 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.171 -0.955 . . . . 0.0 110.276 -179.849 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' C' C ' 3' ' ' ILE . . . . . . . . . . . . . 97.0 mt -63.67 -38.53 82.53 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.629 0 O-C-N 121.19 -0.944 . . . . 0.0 110.3 -179.946 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 4' ' ' GLU . . . . . . . . . . . . . 6.5 mt-10 -66.38 -36.9 84.03 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.229 -0.919 . . . . 0.0 110.397 -179.873 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 5' ' ' THR . . . . . . . . . . . . . 99.0 m -76.46 -56.05 4.98 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.207 -0.933 . . . . 0.0 110.24 -179.956 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 6' ' ' ALA . . . . . 0.728 ' HB1' ' HG2' ' A' ' 16' ' ' GLN . . . -54.42 -35.25 62.71 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.284 -0.885 . . . . 0.0 110.187 -179.983 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 7' ' ' SER . . . . . . . . . . . . . 84.0 p -69.78 -30.25 67.76 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.28 -0.887 . . . . 0.0 110.18 -179.992 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 8' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -96.68 -21.08 17.82 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.29 -0.882 . . . . 0.0 110.215 179.97 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 9' ' ' LEU . . . . . . . . . . . . . 9.3 tt -69.56 -47.47 63.53 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.32 -0.862 . . . . 0.0 110.179 -179.938 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 10' ' ' VAL . . . . . 0.52 HG23 ' N ' ' C' ' 11' ' ' LYS . 33.6 m -57.63 -40.61 76.18 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.66 0 O-C-N 121.184 -0.948 . . . . 0.0 110.038 179.996 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 11' ' ' LYS . . . . . 0.52 ' N ' HG23 ' C' ' 10' ' ' VAL . 18.4 mttt -59.46 -38.61 81.23 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.299 -0.875 . . . . 0.0 110.038 179.817 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 12' ' ' ASN . . . . . . . . . . . . . 8.0 m-20 -69.5 -23.13 63.58 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.31 -0.869 . . . . 0.0 110.053 179.861 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 13' ' ' ALA . . . . . . . . . . . . . . . -82.01 -22.95 36.23 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.257 -0.902 . . . . 0.0 110.374 -179.944 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 14' ' ' ILE . . . . . . . . . . . . . 66.8 mt -88.51 -53.49 9.53 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.593 0 O-C-N 121.217 -0.927 . . . . 0.0 110.476 -179.831 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 15' ' ' GLN . . . . . . . . . . . . . 2.9 pp0? -57.11 -24.93 57.57 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.09 -1.007 . . . . 0.0 110.205 -179.933 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 16' ' ' LEU . . . . . . . . . . . . . 22.1 tp -73.39 -15.62 61.36 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.346 -0.846 . . . . 0.0 110.473 -179.949 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 17' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -73.9 -57.98 3.61 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.077 -1.014 . . . . 0.0 110.273 -179.934 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 18' ' ' ILE . . . . . . . . . . . . . 44.3 pt -66.85 -21.19 28.08 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.596 0 O-C-N 121.253 -0.904 . . . . 0.0 110.283 -179.987 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 19' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -82.72 -20.99 34.96 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.217 -0.927 . . . . 0.0 110.16 179.948 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 20' ' ' GLN . . . . . . . . . . . . . 16.1 tt0 -86.04 -32.11 21.62 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.276 -0.89 . . . . 0.0 110.321 180.0 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 21' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -90.51 -36.13 14.68 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.204 -0.935 . . . . 0.0 110.309 179.994 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 22' ' ' VAL . . . . . . . . . . . . . 98.2 t . . . . . 0 N--CA 1.49 1.569 0 CA-C-O 118.026 -0.988 . . . . 0.0 110.257 -179.82 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' HIS . . . . . . . . . . . . . 10.1 m-70 . . . . . 0 N--CA 1.492 1.65 0 CA-C-O 121.135 0.493 . . . . 0.0 110.208 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -125.83 -41.69 1.95 Allowed 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.343 -0.848 . . . . 0.0 110.167 179.936 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -92.76 108.48 3.66 Favored Glycine 0 N--CA 1.49 2.296 0 N-CA-C 109.532 -1.427 . . . . 0.0 109.532 179.98 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -112.28 27.33 9.74 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.271 -1.134 . . . . 0.0 110.201 -180.0 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -117.39 45.67 0.43 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.561 0 O-C-N 121.147 -0.971 . . . . 0.0 110.335 -179.865 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 1.4 mm100 -148.41 135.01 19.76 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.178 -0.951 . . . . 0.0 110.195 179.921 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . 0.696 ' O ' HD12 ' A' ' 7' ' ' ILE . 2.4 pp -75.71 138.91 70.05 Favored Pre-proline 0 N--CA 1.491 1.612 0 O-C-N 121.253 -0.905 . . . . 0.0 110.215 -179.998 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 49.2 Cg_endo -74.06 140.06 27.77 Favored 'Trans proline' 0 C--N 1.313 -1.31 0 O-C-N 123.552 1.29 . . . . 0.0 110.539 -179.968 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 48.9 Cg_endo -75.48 165.77 29.95 Favored 'Trans proline' 0 C--N 1.312 -1.353 0 O-C-N 123.578 1.304 . . . . 0.0 110.439 179.863 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 104.13 -32.99 6.93 Favored Glycine 0 N--CA 1.491 2.338 0 N-CA-C 109.748 -1.341 . . . . 0.0 109.748 179.787 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 6.8 tp -53.58 -55.58 24.48 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.131 -1.217 . . . . 0.0 110.211 -179.932 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . 0.748 HG23 HG21 ' C' ' 10' ' ' VAL . 57.0 m -53.53 -56.33 17.92 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.259 -0.901 . . . . 0.0 110.411 -179.851 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -53.75 -41.09 66.75 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.302 -0.874 . . . . 0.0 110.498 -179.698 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -75.19 -27.67 59.73 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.179 -0.951 . . . . 0.0 110.419 -179.761 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 5.3 mp -86.44 -55.38 3.92 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.1 -1.0 . . . . 0.0 110.307 -179.967 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . 0.721 ' O ' HG23 ' A' ' 20' ' ' VAL . 1.6 mt-30 -51.48 -37.73 50.43 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.14 -0.975 . . . . 0.0 109.877 179.694 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . 0.421 ' O ' ' CG ' ' A' ' 21' ' ' GLU . . . -69.18 -55.5 10.35 Favored Glycine 0 N--CA 1.489 2.232 0 N-CA-C 108.988 -1.645 . . . . 0.0 108.988 179.45 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . 0.497 ' O ' HG23 ' A' ' 22' ' ' VAL . 21.5 t80 -50.48 -32.12 17.18 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.349 -1.089 . . . . 0.0 110.088 179.673 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.477 HG21 ' HA ' ' C' ' 6' ' ' ALA . 94.4 m -76.25 -32.45 58.87 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.465 -0.772 . . . . 0.0 110.053 179.936 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.721 HG23 ' O ' ' A' ' 16' ' ' GLN . 95.1 t -78.5 -18.78 13.4 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.62 0 O-C-N 121.296 -0.877 . . . . 0.0 110.673 -179.858 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.44 ' HG3' ' HA ' ' A' ' 18' ' ' TYR . 1.3 mt-10 -84.87 -57.99 2.88 Favored 'General case' 0 N--CA 1.498 1.933 0 O-C-N 121.008 -1.057 . . . . 0.0 109.036 179.91 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.497 HG23 ' O ' ' A' ' 18' ' ' TYR . 39.8 t -51.65 -34.25 15.92 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.477 0 O-C-N 121.643 -0.661 . . . . 0.0 109.94 179.821 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.466 ' HB3' HD21 ' C' ' 2' ' ' LEU . 2.4 mp -76.53 -37.94 55.9 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.389 -0.82 . . . . 0.0 109.774 179.51 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . 0.405 ' HG3' ' O ' ' A' ' 20' ' ' VAL . 0.4 OUTLIER -66.36 -24.67 66.54 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.37 -0.831 . . . . 0.0 110.002 179.874 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . 0.405 ' O ' ' C ' ' A' ' 26' ' ' GLN . 0.8 OUTLIER -143.81 59.45 1.37 Allowed 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.265 -0.897 . . . . 0.0 110.212 -179.991 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . 0.405 ' C ' ' O ' ' A' ' 25' ' ' GLN . 6.2 pt20 -34.72 95.56 0.09 OUTLIER Pre-proline 0 N--CA 1.505 2.28 0 CA-C-O 120.959 0.409 . . . . 0.0 111.741 -179.75 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' PRO . . . . . 0.401 ' HD3' ' O ' ' A' ' 25' ' ' GLN . 46.7 Cg_endo -73.72 161.01 42.77 Favored 'Trans proline' 0 C--N 1.312 -1.348 0 O-C-N 123.876 1.461 . . . . 0.0 110.515 -179.614 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . . . . . . . . . 43.5 Cg_endo -70.18 -29.54 21.73 Favored 'Trans proline' 0 C--N 1.31 -1.451 0 O-C-N 123.689 1.363 . . . . 0.0 110.224 179.79 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -142.83 118.46 10.42 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.207 -0.933 . . . . 0.0 110.086 179.712 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.574 ' CD2' HD13 ' B' ' 14' ' ' LEU . 4.9 tp -76.79 -24.58 52.86 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.264 -0.897 . . . . 0.0 109.937 179.934 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.421 HG23 ' H ' ' A' ' 31' ' ' VAL . 43.7 t -52.83 -62.96 0.53 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.61 0 O-C-N 121.313 -0.867 . . . . 0.0 110.05 179.791 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -60.82 -43.03 98.78 Favored 'General case' 0 C--N 1.302 -1.457 0 O-C-N 121.504 -0.748 . . . . 0.0 110.02 179.826 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' PHE . . . . . 0.421 ' CE2' HG22 ' A' ' 22' ' ' VAL . 90.7 t80 -59.79 -43.71 94.27 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.128 -0.983 . . . . 0.0 109.678 179.502 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' ALA . . . . . 0.579 ' HB1' ' CD2' ' B' ' 38' ' ' PHE . . . -54.68 -43.99 72.96 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.311 -0.868 . . . . 0.0 109.735 179.626 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.55 HG13 ' OG1' ' B' ' 39' ' ' THR . 54.5 t -71.77 -49.28 46.58 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.335 0 O-C-N 121.309 -0.87 . . . . 0.0 109.94 179.741 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -62.04 -27.65 69.03 Favored 'General case' 0 N--CA 1.487 1.38 0 O-C-N 121.276 -0.89 . . . . 0.0 109.812 179.829 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . . . . . . . . . 73.7 t80 -72.67 -72.04 0.26 Allowed 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.215 -0.928 . . . . 0.0 110.414 -179.734 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . 0.431 ' CD2' ' HB1' ' B' ' 34' ' ' ALA . 27.3 m-85 -54.63 -47.79 73.04 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.209 -0.932 . . . . 0.0 110.446 -179.796 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' THR . . . . . 0.509 ' OG1' HG13 ' B' ' 35' ' ' VAL . 99.1 m -52.39 -34.19 46.94 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.102 -0.999 . . . . 0.0 109.94 179.84 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 1.9 tpt85 -75.92 -23.05 55.46 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.312 -0.867 . . . . 0.0 109.902 179.645 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.446 ' HA ' HD22 ' A' ' 41' ' ' LEU . 0.2 OUTLIER -65.54 -40.7 93.21 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.253 -0.904 . . . . 0.0 110.189 179.967 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.78 -22.29 34.81 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.321 -0.862 . . . . 0.0 110.431 -179.847 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 -83.25 -31.87 26.74 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.252 -0.905 . . . . 0.0 110.457 -179.725 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -83.0 -77.66 0.24 Allowed 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.213 -0.929 . . . . 0.0 110.764 -179.782 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -61.57 102.17 0.23 Allowed 'General case' 0 C--N 1.304 -1.372 0 O-C-N 121.429 -0.794 . . . . 0.0 110.289 -179.056 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 2.5 mtp85 . . . . . 0 N--CA 1.492 1.664 0 CA-C-O 118.098 -0.953 . . . . 0.0 110.247 -179.921 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 1' ' ' HIS . . . . . . . . . . . . . 39.9 m80 . . . . . 0 N--CA 1.491 1.599 0 CA-C-O 121.313 0.578 . . . . 0.0 110.101 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 2' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -54.94 -56.27 21.53 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.253 -0.904 . . . . 0.0 110.255 -179.967 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 3' ' ' GLY . . . . . . . . . . . . . . . 176.36 161.48 25.46 Favored Glycine 0 N--CA 1.49 2.265 0 N-CA-C 109.705 -1.358 . . . . 0.0 109.705 -179.969 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 4' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -122.68 96.04 4.87 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.314 -1.109 . . . . 0.0 110.189 179.905 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 5' ' ' ILE . . . . . 0.647 HG23 ' O ' ' B' ' 5' ' ' ILE . 1.9 tt -128.44 61.43 0.3 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.592 0 O-C-N 121.245 -0.91 . . . . 0.0 110.359 -179.888 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 6' ' ' GLN . . . . . . . . . . . . . 31.4 mt-30 -124.51 83.86 2.21 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.284 -0.885 . . . . 0.0 110.246 -179.996 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 7' ' ' ILE . . . . . . . . . . . . . 50.4 mm -107.57 97.74 21.13 Favored Pre-proline 0 N--CA 1.492 1.67 0 O-C-N 121.247 -0.908 . . . . 0.0 110.139 179.868 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 8' ' ' PRO . . . . . . . . . . . . . 46.5 Cg_endo -72.57 116.8 4.85 Favored 'Trans proline' 0 C--N 1.312 -1.365 0 O-C-N 123.715 1.376 . . . . 0.0 110.626 -179.96 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 9' ' ' PRO . . . . . . . . . . . . . 45.9 Cg_endo -72.93 -176.61 2.45 Favored 'Trans proline' 0 C--N 1.313 -1.339 0 O-C-N 123.592 1.311 . . . . 0.0 110.386 179.986 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . 118.51 -26.97 7.46 Favored Glycine 0 N--CA 1.491 2.337 0 N-CA-C 109.573 -1.411 . . . . 0.0 109.573 179.969 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . 0.43 ' HG ' HD23 ' B' ' 15' ' ' LEU . 4.5 tt -73.64 -24.07 59.96 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.279 -1.13 . . . . 0.0 110.314 -179.921 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 12' ' ' THR . . . . . . . . . . . . . 23.4 m -57.94 -58.75 7.03 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.227 -0.921 . . . . 0.0 110.119 -179.989 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 4.5 mt-10 -53.9 -44.7 70.74 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.415 -0.803 . . . . 0.0 110.195 -179.975 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 14' ' ' LEU . . . . . 0.574 HD13 ' CD2' ' A' ' 30' ' ' LEU . 6.5 mt -55.71 -57.94 9.92 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.209 -0.932 . . . . 0.0 110.124 179.967 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 15' ' ' LEU . . . . . 0.51 ' HA ' HD13 ' B' ' 15' ' ' LEU . 3.6 mm? -60.86 -37.94 83.86 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.315 -0.866 . . . . 0.0 110.122 179.92 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 16' ' ' GLN . . . . . 0.472 ' O ' HG23 ' B' ' 20' ' ' VAL . 2.3 tt0 -51.94 -52.01 53.09 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.241 -0.912 . . . . 0.0 110.314 179.899 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 17' ' ' GLY . . . . . 0.409 ' O ' ' HG3' ' B' ' 21' ' ' GLU . . . -56.14 -51.53 55.21 Favored Glycine 0 N--CA 1.49 2.249 0 N-CA-C 109.142 -1.583 . . . . 0.0 109.142 179.665 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 18' ' ' TYR . . . . . 0.673 ' OH ' ' HB2' ' B' ' 34' ' ' ALA . 14.8 t80 -53.98 -40.16 66.67 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.332 -1.099 . . . . 0.0 110.083 179.684 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 54.1 m -62.75 -41.4 99.19 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.435 -0.79 . . . . 0.0 110.386 -179.844 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 20' ' ' VAL . . . . . 0.568 HG22 ' CD2' ' C' ' 16' ' ' LEU . 48.9 t -65.42 -18.81 24.54 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.66 0 O-C-N 121.148 -0.97 . . . . 0.0 110.378 -179.938 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 21' ' ' GLU . . . . . 0.468 ' HG3' ' HA ' ' B' ' 18' ' ' TYR . 1.4 mt-10 -93.32 -49.84 5.75 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.126 -0.984 . . . . 0.0 109.051 179.793 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 22' ' ' VAL . . . . . 0.604 ' CG1' HD11 ' B' ' 30' ' ' LEU . 85.7 t -58.92 -28.4 38.15 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.461 0 O-C-N 121.719 -0.613 . . . . 0.0 110.02 179.962 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 8.5 tp -85.18 -43.47 13.79 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.26 -0.9 . . . . 0.0 109.891 179.583 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -78.34 -64.16 1.23 Allowed 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.36 -0.838 . . . . 0.0 110.1 179.874 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 25' ' ' GLN . . . . . 0.404 ' HB3' ' HD3' ' B' ' 27' ' ' PRO . 0.0 OUTLIER -55.06 -37.88 67.3 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.323 -0.86 . . . . 0.0 110.127 179.824 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 2.0 tt0 52.16 60.54 13.31 Favored Pre-proline 0 N--CA 1.491 1.61 0 O-C-N 121.246 -0.908 . . . . 0.0 110.306 -179.947 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 27' ' ' PRO . . . . . 0.404 ' HD3' ' HB3' ' B' ' 25' ' ' GLN . 45.2 Cg_endo -71.35 151.5 60.01 Favored 'Trans proline' 0 C--N 1.313 -1.341 0 O-C-N 123.586 1.308 . . . . 0.0 110.505 -179.973 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 45.2 Cg_endo -70.62 -33.25 13.62 Favored 'Trans proline' 0 C--N 1.311 -1.421 0 O-C-N 123.637 1.335 . . . . 0.0 110.392 179.873 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 29' ' ' ASP . . . . . 0.403 ' O ' ' HB2' ' B' ' 33' ' ' PHE . 2.1 m-20 -118.35 117.13 28.24 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.304 -0.873 . . . . 0.0 110.207 -179.998 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 30' ' ' LEU . . . . . 0.604 HD11 ' CG1' ' B' ' 22' ' ' VAL . 0.1 OUTLIER -82.3 -46.49 13.58 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.296 -0.877 . . . . 0.0 110.013 179.9 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 31' ' ' VAL . . . . . 0.58 ' O ' HG23 ' B' ' 35' ' ' VAL . 40.7 t -53.62 -51.83 39.39 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.695 0 O-C-N 121.384 -0.823 . . . . 0.0 109.608 179.569 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 32' ' ' ASP . . . . . . . . . . . . . 7.9 t0 -67.95 -35.78 78.98 Favored 'General case' 0 C--N 1.303 -1.45 0 O-C-N 121.648 -0.657 . . . . 0.0 109.782 179.812 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 33' ' ' PHE . . . . . 0.403 ' HB2' ' O ' ' B' ' 29' ' ' ASP . 44.0 t80 -67.03 -44.69 79.58 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.23 -0.919 . . . . 0.0 109.396 179.359 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 34' ' ' ALA . . . . . 0.673 ' HB2' ' OH ' ' B' ' 18' ' ' TYR . . . -57.49 -36.89 72.07 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.363 -0.835 . . . . 0.0 109.777 179.604 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 35' ' ' VAL . . . . . 0.58 HG23 ' O ' ' B' ' 31' ' ' VAL . 99.4 t -69.5 -43.91 80.28 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.301 0 O-C-N 121.298 -0.876 . . . . 0.0 110.018 179.79 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -67.28 -30.47 70.35 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.244 -0.91 . . . . 0.0 110.046 179.755 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 37' ' ' TYR . . . . . 0.468 ' CE1' ' OE1' ' B' ' 21' ' ' GLU . 82.9 t80 -73.67 -63.39 1.21 Allowed 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.349 -0.844 . . . . 0.0 110.185 179.977 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 38' ' ' PHE . . . . . 0.579 ' CD2' ' HB1' ' A' ' 34' ' ' ALA . 9.3 m-85 -57.04 -48.7 77.9 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.259 -0.901 . . . . 0.0 110.413 -179.976 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 39' ' ' THR . . . . . 0.55 ' OG1' HG13 ' A' ' 35' ' ' VAL . 57.4 m -53.93 -36.63 62.98 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.139 -0.976 . . . . 0.0 110.013 179.848 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 40' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.36 -25.85 61.68 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.292 -0.88 . . . . 0.0 109.923 179.706 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 4.7 mt -72.79 -28.87 62.85 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.254 -0.904 . . . . 0.0 110.025 179.879 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 42' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -76.5 -23.46 53.73 Favored 'General case' 0 C--N 1.306 -1.284 0 O-C-N 121.302 -0.874 . . . . 0.0 109.717 179.882 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 43' ' ' GLU . . . . . . . . . . . . . 26.3 mt-10 -82.71 -30.88 28.81 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.297 -0.877 . . . . 0.0 110.188 179.907 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 44' ' ' ALA . . . . . . . . . . . . . . . -82.96 -74.78 0.34 Allowed 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.343 -0.848 . . . . 0.0 110.373 179.971 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 45' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -50.77 164.05 0.16 Allowed 'General case' 0 N--CA 1.488 1.444 0 O-C-N 121.588 -0.695 . . . . 0.0 110.466 -179.262 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 46' ' ' ARG . . . . . . . . . . . . . 16.1 ttt180 . . . . . 0 N--CA 1.492 1.645 0 CA-C-O 118.048 -0.977 . . . . 0.0 110.173 179.987 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' C' C ' 1' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.492 1.659 0 CA-C-O 121.147 0.498 . . . . 0.0 110.23 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 2' ' ' LEU . . . . . 0.466 HD21 ' HB3' ' A' ' 23' ' ' LEU . 5.5 mp 53.99 21.02 2.67 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.389 -0.819 . . . . 0.0 110.585 179.964 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 3' ' ' ILE . . . . . . . . . . . . . 19.3 tt -88.27 -18.87 7.92 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.636 0 O-C-N 121.165 -0.96 . . . . 0.0 110.295 179.894 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 4' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -98.35 -9.22 25.68 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.179 -0.951 . . . . 0.0 110.785 -179.892 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 5' ' ' THR . . . . . 0.528 HG22 ' CD1' ' C' ' 9' ' ' LEU . 65.9 m -113.29 -54.12 2.64 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 120.983 -1.073 . . . . 0.0 110.511 -179.807 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 6' ' ' ALA . . . . . 0.477 ' HA ' HG21 ' A' ' 19' ' ' THR . . . -61.76 -56.95 14.14 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.124 -0.985 . . . . 0.0 110.316 -179.785 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 7' ' ' SER . . . . . 0.4 ' O ' ' HB2' ' C' ' 11' ' ' LYS . 47.4 m -65.4 -25.2 67.44 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.224 -0.923 . . . . 0.0 110.339 -179.857 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 8' ' ' SER . . . . . . . . . . . . . 1.1 t -82.87 -39.49 21.54 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.206 -0.934 . . . . 0.0 110.403 -179.916 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 9' ' ' LEU . . . . . 0.528 ' CD1' HG22 ' C' ' 5' ' ' THR . 29.7 mt -61.06 -55.39 33.17 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.207 -0.933 . . . . 0.0 110.399 -179.891 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 10' ' ' VAL . . . . . 0.748 HG21 HG23 ' A' ' 12' ' ' THR . 12.3 p -58.17 -38.97 71.19 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.601 0 O-C-N 121.163 -0.961 . . . . 0.0 110.213 -179.941 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 11' ' ' LYS . . . . . 0.515 ' N ' HG13 ' C' ' 10' ' ' VAL . 5.2 tttm -54.76 -57.79 10.13 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.239 -0.913 . . . . 0.0 110.211 -179.927 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 12' ' ' ASN . . . . . . . . . . . . . 2.8 m-20 -67.29 -23.67 65.68 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.161 -0.962 . . . . 0.0 110.064 179.917 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 13' ' ' ALA . . . . . . . . . . . . . . . -68.18 -43.05 79.01 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.283 -0.886 . . . . 0.0 110.109 179.965 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 14' ' ' ILE . . . . . . . . . . . . . 45.5 mm -69.99 -26.79 30.7 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.601 0 O-C-N 121.215 -0.928 . . . . 0.0 109.911 179.795 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 15' ' ' GLN . . . . . . . . . . . . . 32.8 mt-30 -57.69 -24.19 55.54 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.254 -0.904 . . . . 0.0 109.976 179.729 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 16' ' ' LEU . . . . . 0.568 ' CD2' HG22 ' B' ' 20' ' ' VAL . 0.0 OUTLIER -56.55 -21.26 25.2 Favored 'General case' 0 N--CA 1.489 1.502 0 O-C-N 121.187 -0.946 . . . . 0.0 109.553 179.293 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' C' C ' 17' ' ' SER . . . . . 0.454 ' O ' ' CG1' ' C' ' 18' ' ' ILE . 2.8 m -82.2 54.09 2.44 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.291 -0.88 . . . . 0.0 109.907 179.477 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 18' ' ' ILE . . . . . 0.456 ' O ' ' N ' ' C' ' 20' ' ' GLN . 18.4 pt 41.36 27.28 0.1 OUTLIER 'Isoleucine or valine' 0 N--CA 1.498 1.941 0 O-C-N 121.911 -0.493 . . . . 0.0 111.731 -179.801 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 19' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER 61.81 -71.08 0.04 OUTLIER 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.408 -0.808 . . . . 0.0 111.571 178.942 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 20' ' ' GLN . . . . . 0.456 ' N ' ' O ' ' C' ' 18' ' ' ILE . 3.4 mt-30 -49.56 -27.35 4.35 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.315 -0.866 . . . . 0.0 110.921 -179.115 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 21' ' ' LEU . . . . . 0.455 ' HB2' ' CG1' ' C' ' 18' ' ' ILE . 0.3 OUTLIER -89.65 53.84 2.7 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.048 -1.032 . . . . 0.0 110.138 179.997 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' C' C ' 22' ' ' VAL . . . . . 0.61 ' O ' HG22 ' C' ' 22' ' ' VAL . 7.6 p . . . . . 0 N--CA 1.492 1.636 0 CA-C-O 117.96 -1.019 . . . . 0.0 110.179 179.942 . . . . . . . . 1 1 . 1 stop_ save_