data_1mnt_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 1mnt _Structure_validation_residue.Date_analyzed 2016-10-06 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 2.5 p30 . . . . . 0 CA--C 1.567 1.606 0 CA-C-O 118.756 -0.64 . . . . 0.0 112.074 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 5.7 Cg_exo -87.89 148.55 7.04 Favored 'Trans proline' 0 CA--C 1.549 1.247 0 C-N-CA 122.486 2.124 . . . . 0.0 114.676 -170.704 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 37.8 m80 -73.57 141.3 46.66 Favored 'General case' 0 CA--C 1.561 1.394 0 CA-C-N 113.384 -1.734 . . . . 0.0 113.355 173.555 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 24.3 p90 -125.93 163.81 22.15 Favored 'General case' 0 CA--C 1.559 1.317 0 O-C-N 120.035 -1.666 . . . . 0.0 111.2 115.807 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 1.1 p-10 -73.98 91.08 2.0 Favored 'General case' 0 CA--C 1.567 1.604 0 O-C-N 120.106 -1.621 . . . . 0.0 110.398 159.525 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 4.1 t80 -66.99 168.07 10.62 Favored 'General case' 0 CA--C 1.559 1.325 0 CA-C-O 124.049 1.88 . . . . 0.0 110.489 154.274 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 9.6 tpt180 163.28 109.03 0.0 OUTLIER 'General case' 0 N--CA 1.488 1.443 0 O-C-N 119.724 -1.86 . . . . 0.0 106.211 -120.173 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 13.6 mtm -144.73 123.21 6.75 Favored Pre-proline 0 CA--C 1.562 1.438 0 CA-C-N 114.08 -1.418 . . . . 0.0 108.881 -157.228 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_exo -43.66 147.92 0.99 Allowed 'Trans proline' 0 CA--C 1.562 1.9 0 C-N-CA 122.613 2.209 . . . . 0.0 115.952 159.657 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 1.3 tpt -48.99 -40.79 32.02 Favored 'General case' 0 N--CA 1.494 1.749 0 N-CA-C 117.195 2.294 . . . . 0.0 117.195 -166.942 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 1.1 pm0 -56.77 -49.42 75.34 Favored 'General case' 0 CA--C 1.562 1.406 0 N-CA-C 117.774 2.509 . . . . 0.0 117.774 167.092 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -62.33 -45.54 98.53 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.27 0 CA-C-N 122.721 2.51 . . . . 0.0 113.116 173.891 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -78.15 -23.91 47.55 Favored 'General case' 0 CA--C 1.552 1.055 0 N-CA-C 116.51 2.041 . . . . 0.0 116.51 176.532 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 51.0 mt-10 -68.67 -38.52 80.44 Favored 'General case' 0 CA--C 1.559 1.296 0 CA-C-N 121.579 1.99 . . . . 0.0 114.33 154.089 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . 0.608 11.5 pttt -81.39 -35.09 31.19 Favored 'General case' 0 N--CA 1.497 1.907 0 CA-C-N 124.487 3.312 . . . . 0.0 117.142 177.68 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . 0.293 12.6 tp -63.92 -39.13 93.46 Favored 'General case' 0 CA--C 1.567 1.606 0 O-C-N 120.193 -1.567 . . . . 0.0 114.83 159.735 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 20.0 ttpt -89.08 -20.78 23.91 Favored 'General case' 0 CA--C 1.568 1.656 0 CA-C-O 115.167 -2.349 . . . . 0.0 117.027 175.887 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -102.83 6.5 39.25 Favored 'General case' 0 N--CA 1.529 3.493 0 N-CA-C 119.987 3.329 . . . . 0.0 119.987 164.358 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . 0.509 ' O ' ' N ' ' A' ' 24' ' ' GLU . 2.2 tpp180 -72.71 -140.46 0.01 OUTLIER 'General case' 0 C--N 1.308 -1.205 0 CA-C-O 115.218 -2.325 . . . . 0.0 111.798 106.984 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . 0.66 . . 39.12 -48.32 0.0 OUTLIER 'General case' 0 CA--C 1.593 2.605 1 CA-C-N 127.101 4.5 . . . . 0.0 120.085 -163.865 . . . . . . . . 3 2 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . 0.509 ' N ' ' O ' ' A' ' 22' ' ' ARG . 2.5 tt0 . . . . . 0 N--CA 1.496 1.857 1 O-C-N 115.878 -4.264 . . . . 0.0 119.987 121.481 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . 0.398 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.401 0 N-CA-C 105.864 -1.902 . . . . 0.0 105.864 . . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 32.6 t -102.0 112.55 25.23 Favored 'General case' 0 N--CA 1.488 1.458 0 CA-C-O 115.107 -2.378 . . . . 0.0 106.307 -118.733 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 21.1 mtp -37.45 -41.2 0.42 Allowed 'General case' 0 N--CA 1.506 2.366 0 N-CA-C 120.165 3.394 . . . . 0.0 120.165 -145.811 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 14.5 t-20 -42.1 -51.75 4.49 Favored 'General case' 0 CA--C 1.597 2.771 0 O-C-N 116.867 -3.646 . . . . 0.0 116.142 159.224 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . 0.37 24.4 t -46.12 -65.63 0.52 Allowed 'General case' 0 N--CA 1.5 2.042 0 N-CA-C 119.738 3.236 . . . . 0.0 119.738 144.598 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -71.14 -54.54 10.71 Favored 'General case' 0 N--CA 1.512 2.664 0 N-CA-C 119.269 3.063 . . . . 0.0 119.269 -176.789 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -37.46 -52.84 1.16 Allowed 'General case' 0 CA--C 1.55 0.96 0 CA-C-O 115.586 -2.149 . . . . 0.0 108.814 162.855 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 12.9 mt -61.96 -51.32 68.57 Favored 'General case' 0 C--N 1.369 1.444 0 CA-C-N 123.036 2.653 . . . . 0.0 115.098 177.091 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . 0.326 0.0 OUTLIER -67.04 -36.67 82.58 Favored 'General case' 0 CA--C 1.575 1.922 0 CA-C-O 116.081 -1.914 . . . . 0.0 115.022 -178.979 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 8.7 tt -61.97 -44.67 99.24 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.254 0 CA-C-N 124.133 3.151 . . . . 0.0 115.533 154.049 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 2.7 t -65.25 -48.23 84.27 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.117 0 CA-C-N 123.351 2.796 . . . . 0.0 112.782 -172.66 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 30.4 mt-30 -48.71 -47.76 40.9 Favored 'General case' 0 CA--C 1.567 1.631 0 C-N-CA 125.571 1.549 . . . . 0.0 114.226 155.685 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . 0.458 2.1 m-20 -52.83 -34.96 56.46 Favored 'General case' 0 CA--C 1.578 2.035 0 N-CA-C 118.68 2.844 . . . . 0.0 118.68 157.475 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.55 0.965 0 N-CA-C 113.606 0.965 . . . . 0.0 113.606 -161.909 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo . . . . . 0 CA--C 1.555 1.543 0 N-CA-C 116.891 1.843 . . . . 0.0 116.891 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' B' B ' 6' ' ' HIS . . . . . . . . . . . . . 71.9 m80 -77.14 136.67 38.61 Favored 'General case' 0 CA--C 1.577 2.0 0 CA-C-N 113.615 -1.63 . . . . 0.0 111.859 164.222 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 7' ' ' PHE . . . . . . . . . . . . . 1.2 p90 -136.28 158.1 45.22 Favored 'General case' 0 CA--C 1.57 1.746 0 O-C-N 119.869 -1.769 . . . . 0.0 111.87 150.036 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 8' ' ' ASN . . . . . . . . . . . . . 80.8 m-20 -69.35 103.87 2.11 Favored 'General case' 0 CA--C 1.571 1.773 0 O-C-N 120.374 -1.454 . . . . 0.0 113.033 174.622 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 9' ' ' PHE . . . . . . . . . . . . . 6.8 t80 -120.65 104.81 10.22 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 124.31 1.044 . . . . 0.0 108.318 160.334 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 10' ' ' ARG . . . . . . . . . . . . 0.438 0.1 OUTLIER 91.75 86.9 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.737 1 O-C-N 113.503 -5.748 . . . . 0.0 111.2 -9.779 . . . . . . . . 4 3 . 1 . 001 nuclear orig core ' B' B ' 11' ' ' MET . . . . . . . . . . . . . 16.4 mtm -155.93 126.7 3.5 Favored Pre-proline 0 CA--C 1.572 1.808 0 CA-C-O 116.894 -1.527 . . . . 0.0 110.241 -154.777 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 12' ' ' PRO . . . . . . . . . . . . . 87.0 Cg_exo -42.55 147.55 0.56 Allowed 'Trans proline' 0 C--N 1.373 1.828 0 C-N-CA 123.788 2.992 . . . . 0.0 117.751 168.941 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 13' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -44.33 -53.17 6.99 Favored 'General case' 0 N--CA 1.493 1.723 0 N-CA-C 118.105 2.632 . . . . 0.0 118.105 -162.851 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -62.1 -39.26 91.89 Favored 'General case' 0 CA--C 1.561 1.375 0 N-CA-C 116.793 2.145 . . . . 0.0 116.793 173.034 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -59.98 -52.25 63.34 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.181 0 CA-C-N 123.509 2.868 . . . . 0.0 111.604 170.423 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -72.14 -30.04 64.64 Favored 'General case' 0 CA--C 1.553 1.07 0 N-CA-C 116.364 1.987 . . . . 0.0 116.364 179.152 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 17' ' ' GLU . . . . . . . . . . . . . 38.3 mt-10 -61.54 -49.25 77.45 Favored 'General case' 0 N--CA 1.492 1.674 0 CA-C-N 122.4 2.364 . . . . 0.0 114.086 155.333 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . 0.255 51.0 mtmt -58.48 -49.54 76.98 Favored 'General case' 0 N--CA 1.489 1.492 0 CA-C-N 122.055 2.207 . . . . 0.0 115.748 174.026 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 19' ' ' LEU . . . . . . . . . . . . 0.266 0.5 OUTLIER -66.21 -35.82 81.44 Favored 'General case' 0 CA--C 1.571 1.761 0 C-N-CA 125.574 1.55 . . . . 0.0 114.766 174.218 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 20' ' ' LYS . . . . . . . . . . . . . 15.9 ttpt -87.33 -31.2 20.3 Favored 'General case' 0 CA--C 1.564 1.492 0 N-CA-C 114.502 1.297 . . . . 0.0 114.502 178.201 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 13.8 m-85 -59.05 -72.29 0.1 Allowed 'General case' 0 N--CA 1.487 1.409 0 CA-C-O 114.855 -2.498 . . . . 0.0 110.956 155.014 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . 0.299 13.2 ttt85 -23.83 -50.28 0.02 OUTLIER 'General case' 0 CA--C 1.59 2.496 0 CA-C-N 125.098 3.59 . . . . 0.0 117.043 166.514 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 23' ' ' ALA . . . . . . . . . . . . 0.272 . . -53.78 -76.23 0.03 OUTLIER 'General case' 0 CA--C 1.587 2.383 0 N-CA-C 119.332 3.086 . . . . 0.0 119.332 154.849 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 51.1 mm-40 -71.11 -39.29 72.16 Favored 'General case' 0 CA--C 1.578 2.027 0 N-CA-C 119.229 3.048 . . . . 0.0 119.229 -178.351 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 25' ' ' ALA . . . . . . . . . . . . . . . -40.72 -49.87 3.08 Favored 'General case' 0 CA--C 1.578 2.053 0 N-CA-C 117.304 2.335 . . . . 0.0 117.304 154.938 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 26' ' ' ASN . . . . . . . . . . . . 0.303 0.0 OUTLIER -117.3 -36.71 3.68 Favored 'General case' 0 CA--C 1.578 2.028 0 N-CA-C 115.454 1.65 . . . . 0.0 115.454 -156.386 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 27' ' ' GLY . . . . . . . . . . . . . . . 131.64 31.75 0.5 Allowed Glycine 0 N--CA 1.496 2.674 0 N-CA-C 119.041 2.377 . . . . 0.0 119.041 172.825 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 28' ' ' ARG . . . . . . . . . . . . 0.343 3.2 mtm-85 -131.09 164.19 25.99 Favored 'General case' 0 CA--C 1.585 2.299 0 N-CA-C 103.647 -2.723 . . . . 0.0 103.647 168.177 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 29' ' ' SER . . . . . . . . . . . . . 89.9 p -127.41 107.59 10.09 Favored 'General case' 0 N--CA 1.511 2.623 1 O-C-N 116.064 -4.148 . . . . 0.0 108.2 -168.053 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 30' ' ' MET . . . . . . . . . . . . . 24.2 mtp -42.88 -42.81 3.81 Favored 'General case' 0 N--CA 1.498 1.972 0 N-CA-C 119.476 3.139 . . . . 0.0 119.476 -133.339 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 31' ' ' ASN . . . . . . . . . . . . 0.274 0.1 OUTLIER -49.28 -43.1 42.83 Favored 'General case' 0 CA--C 1.593 2.608 0 O-C-N 116.712 -3.742 . . . . 0.0 114.966 165.383 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 32' ' ' SER . . . . . . . . . . . . 0.29 27.2 t -50.47 -73.38 0.04 OUTLIER 'General case' 0 N--CA 1.501 2.124 0 N-CA-C 117.54 2.422 . . . . 0.0 117.54 141.927 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 5.2 tm-20 -65.05 -49.0 71.8 Favored 'General case' 0 N--CA 1.506 2.346 0 N-CA-C 119.598 3.184 . . . . 0.0 119.598 -171.274 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -41.51 -57.01 2.36 Favored 'General case' 0 CA--C 1.556 1.198 0 CA-C-O 115.495 -2.193 . . . . 0.0 108.628 158.926 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 35' ' ' LEU . . . . . . . . . . . . . 11.9 mt -60.93 -48.34 82.29 Favored 'General case' 0 N--CA 1.491 1.596 0 CA-C-N 124.44 3.291 . . . . 0.0 116.392 179.058 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 36' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -68.46 -34.56 76.16 Favored 'General case' 0 N--CA 1.478 0.964 0 CA-C-O 116.748 -1.596 . . . . 0.0 114.023 178.726 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 37' ' ' ILE . . . . . . . . . . . . . 2.0 tp -70.84 -27.94 32.12 Favored 'Isoleucine or valine' 0 CA--C 1.567 1.602 0 CA-C-O 115.836 -2.031 . . . . 0.0 115.363 163.191 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 38' ' ' VAL . . . . . . . . . . . . . 2.6 t -86.38 -52.96 11.26 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.194 0 C-N-CA 127.812 2.445 . . . . 0.0 110.917 -174.55 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 33.9 mt-30 -52.96 -37.67 61.36 Favored 'General case' 0 CA--C 1.562 1.427 0 CA-C-O 117.922 -1.037 . . . . 0.0 112.901 156.401 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 40' ' ' ASP . . . . . . . . . . . . 0.322 54.0 t0 -55.78 -54.63 42.13 Favored 'General case' 0 N--CA 1.49 1.548 0 N-CA-C 117.567 2.432 . . . . 0.0 117.567 154.516 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 41' ' ' ALA . . . . . . . . . . . . 0.315 . . -64.17 -40.43 96.11 Favored 'General case' 0 CA--C 1.558 1.253 0 N-CA-C 116.215 1.932 . . . . 0.0 116.215 -167.747 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 2.6 pp . . . . . 0 N--CA 1.49 1.549 0 N-CA-C 118.176 2.658 . . . . 0.0 118.176 171.65 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 1.8 p30 . . . . . 0 CA--C 1.567 1.601 0 CA-C-O 118.594 -0.717 . . . . 0.0 112.178 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_exo -97.31 136.84 0.43 Allowed 'Trans proline' 0 CA--C 1.552 1.411 0 CA-C-N 122.296 1.856 . . . . 0.0 113.256 -161.995 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 75.2 m80 -81.1 122.01 26.81 Favored 'General case' 0 CA--C 1.573 1.841 0 CA-C-N 114.263 -1.335 . . . . 0.0 110.571 174.539 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 1.5 p90 -125.56 157.82 36.14 Favored 'General case' 0 CA--C 1.567 1.631 0 O-C-N 119.984 -1.698 . . . . 0.0 112.184 159.408 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 83.9 m-20 -68.96 103.45 1.83 Allowed 'General case' 0 CA--C 1.57 1.723 0 O-C-N 120.893 -1.129 . . . . 0.0 112.613 176.034 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 5.6 t80 -124.47 104.95 9.03 Favored 'General case' 0 CA--C 1.537 0.48 0 N-CA-C 107.328 -1.36 . . . . 0.0 107.328 162.337 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . 0.478 0.1 OUTLIER 93.93 85.55 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.781 1 O-C-N 113.686 -5.634 . . . . 0.0 110.843 -12.54 . . . . . . . . 4 3 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 15.7 mtt -157.14 134.33 6.74 Favored Pre-proline 0 CA--C 1.57 1.738 0 CA-C-O 117.777 -1.106 . . . . 0.0 111.813 -154.715 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 67.8 Cg_exo -49.4 156.35 2.76 Favored 'Trans proline' 0 CA--C 1.564 2.022 0 C-N-CA 123.106 2.537 . . . . 0.0 118.277 167.191 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 9.0 tpp -62.7 -41.65 99.24 Favored 'General case' 0 N--CA 1.488 1.443 0 N-CA-C 116.793 2.146 . . . . 0.0 116.793 -161.579 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 -61.23 -38.72 87.64 Favored 'General case' 0 CA--C 1.565 1.54 0 N-CA-C 115.991 1.848 . . . . 0.0 115.991 165.635 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 1.5 t -58.46 -43.85 87.64 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.077 0 CA-C-N 122.267 2.303 . . . . 0.0 114.983 175.943 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . 0.535 0.1 OUTLIER -117.73 22.25 12.44 Favored 'General case' 0 N--CA 1.483 1.205 0 N-CA-C 119.35 3.093 . . . . 0.0 119.35 171.922 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -66.75 -45.62 77.99 Favored 'General case' 0 CA--C 1.565 1.537 0 O-C-N 118.54 -2.6 . . . . 0.0 113.278 121.201 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . 0.256 46.2 mtmt -63.8 -52.6 59.54 Favored 'General case' 0 N--CA 1.489 1.494 0 CA-C-N 122.535 2.425 . . . . 0.0 116.079 177.454 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 11.7 tp -68.36 -35.55 77.9 Favored 'General case' 0 CA--C 1.564 1.494 0 C-N-CA 124.945 1.298 . . . . 0.0 113.556 173.078 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 2.3 ttpt -87.02 -24.02 24.79 Favored 'General case' 0 CA--C 1.572 1.813 0 CA-C-N 121.309 1.868 . . . . 0.0 114.31 178.667 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 13.9 m-85 -65.34 -68.87 0.33 Allowed 'General case' 0 N--CA 1.488 1.456 0 CA-C-O 114.365 -2.731 . . . . 0.0 111.15 154.887 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . 0.291 24.4 ttt180 -25.46 -48.53 0.02 OUTLIER 'General case' 0 CA--C 1.591 2.528 0 CA-C-N 125.363 3.71 . . . . 0.0 115.94 165.521 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -57.58 -76.56 0.04 OUTLIER 'General case' 0 CA--C 1.589 2.476 0 N-CA-C 117.523 2.416 . . . . 0.0 117.523 157.446 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 36.7 mt-10 . . . . . 0 N--CA 1.507 2.378 0 N-CA-C 118.512 2.782 . . . . 0.0 118.512 178.201 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 37.5 mtm-85 . . . . . 0 CA--C 1.572 1.797 0 N-CA-C 106.546 -1.649 . . . . 0.0 106.546 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 33.5 m -122.77 113.34 19.05 Favored 'General case' 0 N--CA 1.503 2.206 0 O-C-N 118.457 -2.652 . . . . 0.0 104.835 -176.478 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 24.4 mtp -44.54 -41.27 6.31 Favored 'General case' 0 N--CA 1.501 2.105 0 N-CA-C 119.486 3.143 . . . . 0.0 119.486 -143.408 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -48.0 -41.53 25.63 Favored 'General case' 0 CA--C 1.595 2.682 0 CA-C-N 124.794 3.452 . . . . 0.0 115.071 165.226 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . 0.291 67.3 m -55.31 -61.34 2.4 Favored 'General case' 0 N--CA 1.503 2.201 0 N-CA-C 120.686 3.587 . . . . 0.0 120.686 145.98 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 11.5 tp10 -62.78 -60.56 3.33 Favored 'General case' 0 N--CA 1.523 3.217 0 CA-C-N 125.096 3.589 . . . . 0.0 115.731 178.709 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -41.16 -55.29 2.68 Favored 'General case' 0 CA--C 1.546 0.816 0 CA-C-O 115.587 -2.149 . . . . 0.0 108.214 170.473 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 15.9 mt -61.66 -51.19 69.46 Favored 'General case' 0 C--N 1.37 1.489 0 CA-C-N 123.074 2.67 . . . . 0.0 114.412 176.528 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -54.49 -42.28 70.56 Favored 'General case' 0 CA--C 1.567 1.632 0 N-CA-C 115.675 1.732 . . . . 0.0 115.675 175.68 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 5.3 tp -72.92 -29.16 28.46 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.958 0 CA-C-N 122.301 2.319 . . . . 0.0 116.636 166.484 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 8.1 t -80.01 -50.11 18.15 Favored 'Isoleucine or valine' 0 CA--C 1.58 2.118 0 C-N-CA 126.683 1.993 . . . . 0.0 110.042 -178.238 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 26.0 mt-30 -48.09 -40.96 24.96 Favored 'General case' 0 N--CA 1.488 1.429 0 N-CA-C 114.476 1.287 . . . . 0.0 114.476 153.836 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . 0.335 79.2 m-20 -50.5 -62.73 1.42 Allowed 'General case' 0 N--CA 1.491 1.595 0 CA-C-N 120.415 1.461 . . . . 0.0 114.142 154.029 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . 0.285 . . . . . . . 0 CA--C 1.562 1.409 0 N-CA-C 119.184 3.031 . . . . 0.0 119.184 -171.326 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 4.8 Cg_exo . . . . . 0 CA--C 1.553 1.461 0 CA-C-O 122.889 1.12 . . . . 0.0 113.123 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' B' B ' 6' ' ' HIS . . . . . . . . . . . . . 76.3 m80 -76.7 141.14 41.02 Favored 'General case' 0 CA--C 1.56 1.347 0 CA-C-N 113.517 -1.674 . . . . 0.0 113.184 -178.157 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 7' ' ' PHE . . . . . . . . . . . . 0.266 27.7 p90 -121.29 167.54 12.62 Favored 'General case' 0 CA--C 1.564 1.497 0 O-C-N 119.838 -1.789 . . . . 0.0 110.285 116.972 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 8' ' ' ASN . . . . . . . . . . . . . 16.7 m120 -84.39 94.01 8.4 Favored 'General case' 0 N--CA 1.486 1.354 0 O-C-N 119.479 -2.013 . . . . 0.0 108.062 164.211 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 9' ' ' PHE . . . . . 0.517 ' CD2' ' SD ' ' B' ' 11' ' ' MET . 5.7 t80 -68.41 162.73 24.79 Favored 'General case' 0 CA--C 1.557 1.229 0 CA-C-O 124.486 2.089 . . . . 0.0 110.824 158.957 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 10' ' ' ARG . . . . . . . . . . . . . 28.1 tpt85 177.08 97.93 0.01 OUTLIER 'General case' 0 N--CA 1.486 1.374 0 CA-C-N 113.385 -1.734 . . . . 0.0 106.713 -126.463 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 11' ' ' MET . . . . . 0.517 ' SD ' ' CD2' ' B' ' 9' ' ' PHE . 0.7 OUTLIER -122.64 120.51 27.81 Favored Pre-proline 0 CA--C 1.563 1.47 0 CA-C-O 117.049 -1.453 . . . . 0.0 110.864 -161.269 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 12' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_exo -44.91 149.78 1.08 Allowed 'Trans proline' 0 CA--C 1.566 2.123 0 CA-C-N 123.702 2.358 . . . . 0.0 116.051 159.942 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 13' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -54.14 -41.96 68.98 Favored 'General case' 0 N--CA 1.498 1.964 0 N-CA-C 117.374 2.361 . . . . 0.0 117.374 -157.501 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 9.1 pt-20 -63.46 -39.26 93.99 Favored 'General case' 0 CA--C 1.564 1.508 0 N-CA-C 116.54 2.052 . . . . 0.0 116.54 168.747 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -61.16 -46.38 96.75 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.091 0 CA-C-N 123.04 2.655 . . . . 0.0 113.421 172.259 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 2.1 ttt180 -74.7 -39.99 61.62 Favored 'General case' 0 C--O 1.218 -0.592 0 CA-C-O 116.353 -1.784 . . . . 0.0 115.027 174.419 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 17' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -58.91 -38.13 78.21 Favored 'General case' 0 CA--C 1.566 1.585 0 CA-C-N 123.386 2.812 . . . . 0.0 114.371 163.604 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . 0.309 50.5 mtmt -67.93 -50.04 58.37 Favored 'General case' 0 CA--C 1.566 1.591 0 CA-C-N 121.6 2.0 . . . . 0.0 115.227 170.347 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 19' ' ' LEU . . . . . . . . . . . . 0.322 13.3 tp -67.82 -37.77 82.39 Favored 'General case' 0 CA--C 1.574 1.872 0 CA-C-N 121.024 1.738 . . . . 0.0 114.336 174.458 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 20' ' ' LYS . . . . . . . . . . . . . 29.2 ttpt -88.5 -27.02 21.74 Favored 'General case' 0 CA--C 1.566 1.595 0 O-C-N 120.466 -1.396 . . . . 0.0 113.996 -179.988 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 19.9 m-30 -62.59 -70.5 0.2 Allowed 'General case' 0 N--CA 1.493 1.684 0 CA-C-O 113.607 -3.092 . . . . 0.0 110.27 155.326 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . 0.288 53.5 ttt180 -20.5 -53.07 0.01 OUTLIER 'General case' 0 CA--C 1.593 2.624 0 CA-C-N 125.751 3.887 . . . . 0.0 116.882 165.016 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -54.22 -75.74 0.03 OUTLIER 'General case' 0 CA--C 1.589 2.475 0 N-CA-C 119.06 2.985 . . . . 0.0 119.06 157.091 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 -68.95 -39.13 79.69 Favored 'General case' 0 N--CA 1.502 2.137 0 N-CA-C 118.897 2.925 . . . . 0.0 118.897 -179.55 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 25' ' ' ALA . . . . . . . . . . . . . . . -38.97 -48.96 1.66 Allowed 'General case' 0 CA--C 1.581 2.137 0 N-CA-C 116.92 2.193 . . . . 0.0 116.92 156.08 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 26' ' ' ASN . . . . . . . . . . . . 0.299 0.0 OUTLIER -112.19 -47.8 3.08 Favored 'General case' 0 CA--C 1.578 2.047 0 N-CA-C 115.066 1.506 . . . . 0.0 115.066 -163.036 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 27' ' ' GLY . . . . . . . . . . . . . . . 148.66 44.65 0.03 OUTLIER Glycine 0 N--CA 1.5 2.926 0 N-CA-C 118.189 2.036 . . . . 0.0 118.189 176.472 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 28' ' ' ARG . . . . . . . . . . . . 0.334 1.1 ptt180 -156.92 153.44 28.12 Favored 'General case' 0 N--CA 1.495 1.797 0 N-CA-C 105.586 -2.005 . . . . 0.0 105.586 -173.115 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 29' ' ' SER . . . . . . . . . . . . . 75.1 p -119.77 110.5 16.86 Favored 'General case' 0 N--CA 1.502 2.126 0 O-C-N 118.312 -2.743 . . . . 0.0 105.638 -168.547 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 30' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -39.85 -43.96 1.55 Allowed 'General case' 0 N--CA 1.493 1.703 0 N-CA-C 120.651 3.574 . . . . 0.0 120.651 -143.557 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 31' ' ' ASN . . . . . . . . . . . . . 12.1 t-20 -44.4 -45.77 9.13 Favored 'General case' 0 CA--C 1.594 2.639 0 CA-C-N 124.029 3.104 . . . . 0.0 114.699 164.42 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 32' ' ' SER . . . . . . . . . . . . 0.326 30.9 t -50.61 -68.54 0.16 Allowed 'General case' 0 N--CA 1.5 2.044 0 N-CA-C 119.591 3.182 . . . . 0.0 119.591 144.561 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 10.5 tm-20 -60.93 -58.44 8.41 Favored 'General case' 0 N--CA 1.515 2.793 0 N-CA-C 118.508 2.781 . . . . 0.0 118.508 -177.186 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -39.91 -54.16 2.22 Favored 'General case' 0 CA--C 1.563 1.448 0 CA-C-O 116.46 -1.733 . . . . 0.0 107.305 166.2 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 35' ' ' LEU . . . . . . . . . . . . . 9.3 mt -63.26 -61.79 2.12 Favored 'General case' 0 C--N 1.371 1.53 0 CA-C-N 123.563 2.892 . . . . 0.0 115.977 -174.627 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 36' ' ' GLN . . . . . . . . . . . . 0.489 0.0 OUTLIER -60.76 -25.08 66.23 Favored 'General case' 0 CA--C 1.571 1.757 0 N-CA-C 115.352 1.612 . . . . 0.0 115.352 177.917 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 37' ' ' ILE . . . . . . . . . . . . . 1.9 tp -77.62 -32.57 18.34 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.788 0 CA-C-N 121.788 2.085 . . . . 0.0 116.24 163.833 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 38' ' ' VAL . . . . . . . . . . . . . 4.3 t -74.38 -50.38 27.45 Favored 'Isoleucine or valine' 0 CA--C 1.572 1.79 0 C-N-CA 127.942 2.497 . . . . 0.0 110.94 178.494 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 30.2 mt-30 -40.1 -49.23 2.57 Favored 'General case' 0 CA--C 1.567 1.601 0 N-CA-C 114.97 1.47 . . . . 0.0 114.97 149.798 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 40' ' ' ASP . . . . . . . . . . . . 0.339 1.5 t0 -57.45 -38.63 74.77 Favored 'General case' 0 CA--C 1.572 1.815 0 N-CA-C 118.241 2.682 . . . . 0.0 118.241 160.903 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -72.99 -34.63 66.54 Favored 'General case' 0 CA--C 1.564 1.515 0 N-CA-C 116.914 2.19 . . . . 0.0 116.914 -176.83 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 12.8 mt . . . . . 0 CA--C 1.56 1.334 0 C-N-CA 126.086 1.754 . . . . 0.0 113.185 176.776 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 21.7 p-10 . . . . . 0 CA--C 1.572 1.823 0 CA-C-O 118.72 -0.657 . . . . 0.0 111.241 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 23.6 Cg_exo -84.03 154.75 13.0 Favored 'Trans proline' 0 CA--C 1.557 1.633 0 CA-C-N 122.4 1.893 . . . . 0.0 116.374 -159.661 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 77.1 m80 -86.37 137.08 32.85 Favored 'General case' 0 CA--C 1.561 1.386 0 CA-C-N 114.04 -1.436 . . . . 0.0 113.568 -175.138 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 1.6 p90 -139.28 140.45 37.65 Favored 'General case' 0 N--CA 1.485 1.293 0 O-C-N 120.751 -1.218 . . . . 0.0 108.409 137.583 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 39.9 m-20 -73.92 100.86 3.63 Favored 'General case' 0 CA--C 1.563 1.458 0 O-C-N 120.434 -1.416 . . . . 0.0 111.469 -178.424 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 5.3 t80 -79.65 77.0 6.28 Favored 'General case' 0 CA--C 1.576 1.953 0 CA-C-O 127.683 3.611 . . . . 0.0 111.216 169.593 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . 0.283 28.8 ptt180 -47.04 138.65 6.43 Favored 'General case' 0 N--CA 1.478 0.936 0 CA-C-N 109.577 -3.465 . . . . 0.0 118.011 130.238 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 9.1 mtt -147.75 138.07 12.7 Favored Pre-proline 0 CA--C 1.572 1.791 0 CA-C-N 112.928 -1.942 . . . . 0.0 110.204 -176.326 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 87.1 Cg_exo -41.46 142.61 1.08 Allowed 'Trans proline' 0 C--N 1.375 1.944 0 C-N-CA 123.627 2.885 . . . . 0.0 116.497 167.588 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 1.7 tpt -44.3 -38.03 3.64 Favored 'General case' 0 CA--C 1.569 1.711 0 N-CA-C 119.675 3.213 . . . . 0.0 119.675 -167.001 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -61.96 -47.13 86.25 Favored 'General case' 0 N--CA 1.486 1.342 0 N-CA-C 117.548 2.425 . . . . 0.0 117.548 167.734 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -67.37 -42.44 87.43 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.911 0 CA-C-N 122.949 2.613 . . . . 0.0 112.509 173.262 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . 0.318 0.0 OUTLIER -79.15 -29.24 42.95 Favored 'General case' 0 N--CA 1.486 1.329 0 CA-C-N 123.078 2.672 . . . . 0.0 116.313 176.083 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -67.42 -44.76 77.98 Favored 'General case' 0 N--CA 1.49 1.533 0 CA-C-N 123.38 2.809 . . . . 0.0 113.254 156.926 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . 0.552 8.8 pttt -74.02 -31.73 63.05 Favored 'General case' 0 N--CA 1.484 1.25 0 N-CA-C 116.643 2.09 . . . . 0.0 116.643 179.366 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . 0.294 0.9 OUTLIER -69.07 -43.79 73.87 Favored 'General case' 0 N--CA 1.492 1.634 0 CA-C-N 122.764 2.529 . . . . 0.0 113.624 162.004 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 1.5 ttpt -77.38 -38.92 49.01 Favored 'General case' 0 CA--C 1.562 1.428 0 N-CA-C 115.158 1.54 . . . . 0.0 115.158 -177.919 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 29.4 m-85 -55.86 -77.71 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.573 0 CA-C-O 113.408 -3.187 . . . . 0.0 110.832 154.557 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . 0.331 0.0 OUTLIER -28.72 -48.73 0.06 Allowed 'General case' 0 CA--C 1.589 2.463 1 CA-C-N 126.117 4.053 . . . . 0.0 117.113 176.053 . . . . . . . . 4 3 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -47.54 -77.65 0.02 OUTLIER 'General case' 0 CA--C 1.586 2.334 0 N-CA-C 120.54 3.533 . . . . 0.0 120.54 152.254 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 54.2 mm-40 . . . . . 0 N--CA 1.499 2.005 0 N-CA-C 118.603 2.816 . . . . 0.0 118.603 179.188 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . 0.288 18.3 mtm-85 . . . . . 0 N--CA 1.5 2.034 0 N-CA-C 102.688 -3.079 . . . . 0.0 102.688 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 23.2 t -115.92 112.71 22.27 Favored 'General case' 0 N--CA 1.509 2.492 0 O-C-N 116.617 -3.802 . . . . 0.0 108.818 -164.8 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 25.6 mtp -42.62 -45.29 4.56 Favored 'General case' 0 N--CA 1.501 2.077 0 N-CA-C 119.474 3.139 . . . . 0.0 119.474 -134.707 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 18.7 t-20 -47.15 -43.56 21.08 Favored 'General case' 0 CA--C 1.6 2.888 1 O-C-N 115.928 -4.233 . . . . 0.0 114.816 165.088 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . 0.291 13.6 t -53.18 -72.24 0.06 Allowed 'General case' 0 N--CA 1.502 2.161 0 N-CA-C 117.306 2.336 . . . . 0.0 117.306 143.384 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 4.5 tm-20 -68.41 -45.62 72.13 Favored 'General case' 0 N--CA 1.504 2.256 0 CA-C-N 124.471 3.305 . . . . 0.0 119.338 -171.994 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -41.43 -55.99 2.64 Favored 'General case' 0 CA--C 1.557 1.245 0 CA-C-O 114.866 -2.492 . . . . 0.0 108.39 156.762 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 11.8 mt -62.21 -45.94 91.11 Favored 'General case' 0 N--CA 1.493 1.706 0 CA-C-N 125.7 3.864 . . . . 0.0 116.762 177.493 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -70.97 -40.88 71.69 Favored 'General case' 0 N--CA 1.483 1.184 0 CA-C-O 116.705 -1.617 . . . . 0.0 113.48 178.955 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 1.3 tt -61.67 -31.7 51.58 Favored 'Isoleucine or valine' 0 C--O 1.199 -1.593 0 CA-C-O 114.329 -2.748 . . . . 0.0 115.178 160.474 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 2.6 t -84.38 -51.84 13.4 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.096 0 CA-C-N 123.698 2.954 . . . . 0.0 110.884 -173.57 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 33.9 mt-30 -48.76 -41.57 32.76 Favored 'General case' 0 CA--C 1.568 1.643 0 C-N-CA 124.208 1.003 . . . . 0.0 113.656 155.014 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . 0.352 17.4 t0 -50.31 -57.91 6.83 Favored 'General case' 0 N--CA 1.49 1.526 0 N-CA-C 116.916 2.191 . . . . 0.0 116.916 153.981 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.551 0.995 0 N-CA-C 116.733 2.124 . . . . 0.0 116.733 -157.496 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 90.0 Cg_endo . . . . . 0 CA--C 1.557 1.636 0 N-CA-C 115.945 1.479 . . . . 0.0 115.945 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' B' B ' 6' ' ' HIS . . . . . . . . . . . . . 54.9 m80 -75.19 154.21 37.75 Favored 'General case' 0 CA--C 1.557 1.231 0 CA-C-N 113.8 -1.546 . . . . 0.0 114.597 174.656 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 7' ' ' PHE . . . . . . . . . . . . . 17.8 p90 -131.19 162.66 29.45 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 120.197 -1.564 . . . . 0.0 112.395 120.026 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 8' ' ' ASN . . . . . . . . . . . . . 6.1 p-10 -61.73 92.47 0.04 OUTLIER 'General case' 0 CA--C 1.567 1.628 0 N-CA-C 114.422 1.267 . . . . 0.0 114.422 165.403 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 9' ' ' PHE . . . . . . . . . . . . 0.263 0.8 OUTLIER -79.53 164.77 23.62 Favored 'General case' 0 CA--C 1.563 1.476 0 CA-C-O 125.543 2.592 . . . . 0.0 109.511 153.905 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 10' ' ' ARG . . . . . 0.407 ' N ' ' SD ' ' B' ' 11' ' ' MET . 0.0 OUTLIER 162.63 103.33 0.0 OUTLIER 'General case' 0 C--N 1.308 -1.231 0 CA-C-N 111.819 -2.446 . . . . 0.0 104.658 -123.846 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 11' ' ' MET . . . . . 0.407 ' SD ' ' N ' ' B' ' 10' ' ' ARG . 0.2 OUTLIER -139.96 128.75 13.37 Favored Pre-proline 0 CA--C 1.567 1.631 0 CA-C-O 117.669 -1.158 . . . . 0.0 110.88 -158.883 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 12' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -59.46 153.42 54.52 Favored 'Trans proline' 0 CA--C 1.562 1.905 0 CA-C-N 123.779 2.385 . . . . 0.0 114.116 169.445 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 13' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -57.84 -36.55 72.44 Favored 'General case' 0 N--CA 1.495 1.821 0 N-CA-C 117.026 2.232 . . . . 0.0 117.026 -155.03 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -60.13 -44.23 95.07 Favored 'General case' 0 CA--C 1.563 1.458 0 N-CA-C 117.146 2.276 . . . . 0.0 117.146 165.705 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -63.06 -46.33 96.46 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.131 0 CA-C-N 123.57 2.896 . . . . 0.0 112.612 172.921 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 16' ' ' ARG . . . . . . . . . . . . 0.255 0.0 OUTLIER -76.63 -27.87 55.87 Favored 'General case' 0 N--CA 1.479 1.009 0 N-CA-C 116.261 1.949 . . . . 0.0 116.261 177.297 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 17' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -67.44 -44.46 78.65 Favored 'General case' 0 N--CA 1.49 1.573 0 CA-C-N 122.833 2.56 . . . . 0.0 113.699 156.925 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 55.4 mtmt -58.5 -54.89 41.9 Favored 'General case' 0 N--CA 1.49 1.561 0 CA-C-N 122.378 2.354 . . . . 0.0 114.93 171.316 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 19' ' ' LEU . . . . . . . . . . . . . 12.9 tp -63.57 -35.63 81.13 Favored 'General case' 0 CA--C 1.562 1.44 0 N-CA-C 115.124 1.527 . . . . 0.0 115.124 176.453 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 20' ' ' LYS . . . . . . . . . . . . . 11.8 ttpt -87.82 -23.0 24.17 Favored 'General case' 0 CA--C 1.572 1.803 0 N-CA-C 114.314 1.228 . . . . 0.0 114.314 176.185 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 11.2 m-85 -64.53 -71.71 0.17 Allowed 'General case' 0 N--CA 1.491 1.62 0 CA-C-O 115.167 -2.349 . . . . 0.0 110.635 154.678 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . 0.369 0.0 OUTLIER -18.58 -52.28 0.01 OUTLIER 'General case' 0 CA--C 1.597 2.754 0 CA-C-N 124.616 3.371 . . . . 0.0 115.106 159.794 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 23' ' ' ALA . . . . . . . . . . . . 0.331 . . -55.67 -77.96 0.02 OUTLIER 'General case' 0 CA--C 1.586 2.338 0 N-CA-C 120.202 3.408 . . . . 0.0 120.202 154.182 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 12.6 mm-40 -68.93 -36.59 78.16 Favored 'General case' 0 N--CA 1.502 2.16 0 N-CA-C 119.323 3.083 . . . . 0.0 119.323 -178.719 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 25' ' ' ALA . . . . . . . . . . . . . . . -42.79 -49.82 5.69 Favored 'General case' 0 CA--C 1.58 2.127 0 N-CA-C 116.496 2.036 . . . . 0.0 116.496 154.413 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 26' ' ' ASN . . . . . . . . . . . . . 6.8 m-20 -82.23 -54.61 5.11 Favored 'General case' 0 CA--C 1.572 1.789 0 N-CA-C 114.275 1.213 . . . . 0.0 114.275 179.131 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 27' ' ' GLY . . . . . . . . . . . . . . . 116.67 23.94 3.86 Favored Glycine 0 N--CA 1.498 2.793 0 N-CA-C 117.835 1.894 . . . . 0.0 117.835 -152.661 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 28' ' ' ARG . . . . . . . . . . . . 0.291 81.7 mtm180 -119.09 155.61 31.22 Favored 'General case' 0 CA--C 1.58 2.106 0 N-CA-C 103.738 -2.69 . . . . 0.0 103.738 170.927 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 29' ' ' SER . . . . . . . . . . . . . 87.5 p -122.98 108.13 12.59 Favored 'General case' 0 N--CA 1.507 2.387 0 O-C-N 116.852 -3.655 . . . . 0.0 107.576 -166.47 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 30' ' ' MET . . . . . . . . . . . . . 23.4 mtp -40.6 -45.93 2.43 Favored 'General case' 0 N--CA 1.5 2.033 0 N-CA-C 119.15 3.019 . . . . 0.0 119.15 -137.592 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 31' ' ' ASN . . . . . . . . . . . . 0.286 0.1 OUTLIER -48.56 -43.65 35.85 Favored 'General case' 0 CA--C 1.601 2.926 0 CA-C-N 125.178 3.626 . . . . 0.0 114.707 167.08 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 32' ' ' SER . . . . . . . . . . . . 0.296 70.0 m -53.04 -63.19 1.23 Allowed 'General case' 0 N--CA 1.508 2.473 0 N-CA-C 119.902 3.297 . . . . 0.0 119.902 145.527 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 8.5 tm-20 -70.28 -54.76 11.31 Favored 'General case' 0 N--CA 1.504 2.234 0 CA-C-N 123.668 2.94 . . . . 0.0 118.901 -178.707 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -36.39 -52.23 0.83 Allowed 'General case' 0 CA--C 1.554 1.111 0 CA-C-O 115.829 -2.034 . . . . 0.0 108.74 161.119 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 35' ' ' LEU . . . . . . . . . . . . . 19.7 mt -62.67 -47.64 82.78 Favored 'General case' 0 C--N 1.369 1.416 0 CA-C-N 123.689 2.949 . . . . 0.0 116.351 174.075 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 36' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -69.07 -31.42 70.16 Favored 'General case' 0 N--CA 1.49 1.557 0 N-CA-C 116.305 1.965 . . . . 0.0 116.305 179.491 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 37' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -73.38 -34.53 43.56 Favored 'Isoleucine or valine' 0 C--O 1.2 -1.519 0 CA-C-O 114.978 -2.439 . . . . 0.0 113.908 159.526 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 38' ' ' VAL . . . . . . . . . . . . . 2.6 t -76.05 -49.31 26.02 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.314 0 CA-C-N 123.969 3.077 . . . . 0.0 112.448 -176.639 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 31.5 mt-30 -55.06 -38.76 68.44 Favored 'General case' 0 CA--C 1.57 1.749 0 CA-C-O 117.631 -1.176 . . . . 0.0 112.908 156.43 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 40' ' ' ASP . . . . . . . . . . . . 0.42 7.1 t0 -52.41 -45.32 65.85 Favored 'General case' 0 N--CA 1.504 2.255 0 N-CA-C 116.737 2.125 . . . . 0.0 116.737 154.485 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 41' ' ' ALA . . . . . . . . . . . . 0.296 . . -84.16 -53.78 5.28 Favored 'General case' 0 CA--C 1.553 1.068 0 N-CA-C 115.807 1.78 . . . . 0.0 115.807 -161.136 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . 0.316 1.5 pp . . . . . 0 N--CA 1.494 1.754 0 N-CA-C 117.286 2.328 . . . . 0.0 117.286 160.951 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 7.4 p-10 . . . . . 0 CA--C 1.57 1.737 0 N-CA-C 112.478 0.547 . . . . 0.0 112.478 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 4.4 Cg_exo -99.07 154.01 0.63 Allowed 'Trans proline' 0 C--N 1.362 1.281 0 CA-C-N 121.936 1.727 . . . . 0.0 113.889 -157.743 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 61.7 m80 -72.34 138.42 47.3 Favored 'General case' 0 CA--C 1.562 1.413 0 CA-C-N 113.546 -1.661 . . . . 0.0 113.633 177.356 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . 0.268 35.5 p90 -116.43 170.97 8.15 Favored 'General case' 0 CA--C 1.565 1.549 0 O-C-N 120.065 -1.647 . . . . 0.0 110.438 113.902 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 93.1 m-20 -89.13 94.53 9.97 Favored 'General case' 0 N--CA 1.485 1.319 0 O-C-N 119.764 -1.835 . . . . 0.0 107.556 162.364 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 8.9 t80 -66.9 162.83 20.92 Favored 'General case' 0 CA--C 1.556 1.202 0 CA-C-O 124.344 2.021 . . . . 0.0 111.345 160.904 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 38.3 tpt85 170.96 103.35 0.01 OUTLIER 'General case' 0 N--CA 1.486 1.346 0 O-C-N 119.785 -1.822 . . . . 0.0 106.881 -119.19 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 11.6 mtm -138.85 122.9 11.3 Favored Pre-proline 0 CA--C 1.561 1.375 0 CA-C-O 117.296 -1.335 . . . . 0.0 110.872 -153.763 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 75.1 Cg_exo -43.0 143.11 1.96 Allowed 'Trans proline' 0 CA--C 1.562 1.923 0 C-N-CA 122.952 2.435 . . . . 0.0 116.013 163.32 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 9.5 tpp -55.34 -28.68 55.35 Favored 'General case' 0 N--CA 1.491 1.609 0 N-CA-C 119.533 3.16 . . . . 0.0 119.533 -163.987 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . 0.268 9.2 pt-20 -62.7 -48.63 78.43 Favored 'General case' 0 CA--C 1.566 1.586 0 N-CA-C 116.411 2.004 . . . . 0.0 116.411 160.959 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -60.13 -44.19 94.61 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.288 0 CA-C-N 123.114 2.688 . . . . 0.0 113.438 174.345 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -80.84 -21.28 40.9 Favored 'General case' 0 CA--C 1.556 1.181 0 N-CA-C 116.63 2.085 . . . . 0.0 116.63 175.759 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 38.9 mt-10 -67.34 -47.61 69.97 Favored 'General case' 0 N--CA 1.49 1.555 0 CA-C-N 123.183 2.719 . . . . 0.0 113.766 151.946 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 46.7 mtmt -57.6 -57.04 14.44 Favored 'General case' 0 N--CA 1.485 1.307 0 CA-C-N 121.609 2.004 . . . . 0.0 114.353 174.157 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . 0.267 12.0 tp -64.18 -40.0 95.18 Favored 'General case' 0 CA--C 1.563 1.445 0 C-N-CA 124.812 1.245 . . . . 0.0 113.499 176.081 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 10.6 ttpt -80.26 -25.12 39.65 Favored 'General case' 0 CA--C 1.569 1.705 0 CA-C-N 120.537 1.517 . . . . 0.0 114.947 176.201 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 18.7 m-30 -70.43 -71.48 0.24 Allowed 'General case' 0 N--CA 1.488 1.468 0 CA-C-O 114.074 -2.869 . . . . 0.0 110.764 162.23 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . 0.261 7.3 tpt180 -14.09 -56.26 0.0 OUTLIER 'General case' 0 CA--C 1.595 2.683 0 CA-C-N 125.92 3.964 . . . . 0.0 116.042 159.515 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -55.77 -79.42 0.02 OUTLIER 'General case' 0 CA--C 1.586 2.329 0 N-CA-C 118.421 2.748 . . . . 0.0 118.421 157.921 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 66.5 mm-40 . . . . . 0 CA--C 1.574 1.904 0 N-CA-C 119.34 3.089 . . . . 0.0 119.34 -175.437 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 84.4 mtm180 . . . . . 0 CA--C 1.576 1.961 0 N-CA-C 104.748 -2.315 . . . . 0.0 104.748 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 9.4 t -137.76 115.15 11.1 Favored 'General case' 0 N--CA 1.503 2.219 0 O-C-N 117.157 -3.465 . . . . 0.0 107.071 -171.766 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 19.9 mtp -53.05 -40.7 64.17 Favored 'General case' 0 N--CA 1.491 1.62 0 N-CA-C 118.224 2.676 . . . . 0.0 118.224 -126.724 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 13.0 t-20 -45.58 -43.58 12.24 Favored 'General case' 0 CA--C 1.598 2.793 0 CA-C-N 125.505 3.775 . . . . 0.0 114.857 165.151 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . 0.416 89.1 p -56.95 -58.29 8.79 Favored 'General case' 0 N--CA 1.503 2.214 0 N-CA-C 120.348 3.462 . . . . 0.0 120.348 149.555 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 10.5 tm-20 -64.82 -61.14 2.36 Favored 'General case' 0 N--CA 1.507 2.389 0 CA-C-N 123.127 2.694 . . . . 0.0 117.761 176.804 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -38.23 -53.44 1.45 Allowed 'General case' 0 CA--C 1.545 0.77 0 CA-C-O 115.748 -2.072 . . . . 0.0 108.126 169.019 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 11.9 mt -63.99 -56.29 16.17 Favored 'General case' 0 C--N 1.367 1.343 0 CA-C-N 123.03 2.65 . . . . 0.0 115.171 178.848 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . 0.276 0.0 OUTLIER -58.56 -31.1 67.68 Favored 'General case' 0 CA--C 1.57 1.727 0 CA-C-O 116.612 -1.661 . . . . 0.0 114.626 176.874 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 2.8 tp -79.28 -31.7 14.58 Favored 'Isoleucine or valine' 0 CA--C 1.567 1.62 0 CA-C-N 122.318 2.327 . . . . 0.0 116.414 164.393 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 3.1 t -77.19 -48.72 24.29 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.911 0 CA-C-N 122.285 2.311 . . . . 0.0 110.934 178.821 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 29.6 mt-30 -51.36 -46.21 62.66 Favored 'General case' 0 CA--C 1.551 0.987 0 CA-C-O 116.198 -1.858 . . . . 0.0 113.005 155.824 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . 0.297 42.0 t0 -44.51 -55.24 5.26 Favored 'General case' 0 N--CA 1.502 2.157 0 CA-C-N 121.763 2.074 . . . . 0.0 113.644 158.497 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . 0.283 . . . . . . . 0 CA--C 1.544 0.721 0 N-CA-C 119.324 3.083 . . . . 0.0 119.324 -161.678 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 4.5 Cg_exo . . . . . 0 CA--C 1.557 1.669 0 N-CA-C 114.011 0.735 . . . . 0.0 114.011 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' B' B ' 6' ' ' HIS . . . . . . . . . . . . . 77.5 m80 -85.82 135.28 33.78 Favored 'General case' 0 CA--C 1.579 2.059 0 CA-C-N 114.959 -1.019 . . . . 0.0 112.117 174.647 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 7' ' ' PHE . . . . . . . . . . . . . 3.0 p90 -135.94 161.7 34.9 Favored 'General case' 0 CA--C 1.571 1.778 0 O-C-N 119.896 -1.752 . . . . 0.0 112.345 151.058 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 8' ' ' ASN . . . . . . . . . . . . . 7.8 p-10 -62.32 102.75 0.33 Allowed 'General case' 0 CA--C 1.575 1.909 0 N-CA-C 116.001 1.852 . . . . 0.0 116.001 171.782 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 9' ' ' PHE . . . . . . . . . . . . . 4.9 t80 -126.81 105.99 9.04 Favored 'General case' 0 CA--C 1.538 0.516 0 N-CA-C 107.661 -1.237 . . . . 0.0 107.661 159.662 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 10' ' ' ARG . . . . . . . . . . . . 0.469 0.0 OUTLIER 92.79 87.45 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.566 1 O-C-N 114.162 -5.337 . . . . 0.0 109.339 -11.415 . . . . . . . . 4 3 . 1 . 004 nuclear orig core ' B' B ' 11' ' ' MET . . . . . . . . . . . . . 8.4 mtm -148.87 126.29 5.6 Favored Pre-proline 0 CA--C 1.566 1.565 0 CA-C-O 117.045 -1.455 . . . . 0.0 110.371 -160.261 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 12' ' ' PRO . . . . . . . . . . . . . 76.9 Cg_exo -42.55 140.47 2.68 Favored 'Trans proline' 0 C--N 1.371 1.72 0 C-N-CA 123.242 2.628 . . . . 0.0 116.261 161.944 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 13' ' ' MET . . . . . . . . . . . . . 23.4 tpp -54.76 -29.19 53.29 Favored 'General case' 0 N--CA 1.495 1.78 0 N-CA-C 119.006 2.965 . . . . 0.0 119.006 -163.886 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -61.95 -48.25 81.22 Favored 'General case' 0 N--CA 1.492 1.672 0 N-CA-C 117.008 2.225 . . . . 0.0 117.008 163.972 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -58.92 -50.58 79.08 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.138 0 CA-C-N 121.163 1.801 . . . . 0.0 113.001 172.123 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -73.83 -26.09 60.41 Favored 'General case' 0 CA--C 1.545 0.759 0 N-CA-C 116.7 2.111 . . . . 0.0 116.7 175.826 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 17' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -64.13 -48.2 76.98 Favored 'General case' 0 N--CA 1.49 1.565 0 CA-C-N 123.908 3.049 . . . . 0.0 112.959 156.883 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . 0.615 23.5 pttt -67.26 -40.28 86.19 Favored 'General case' 0 N--CA 1.488 1.442 0 N-CA-C 117.415 2.376 . . . . 0.0 117.415 178.963 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 19' ' ' LEU . . . . . . . . . . . . . 12.5 tp -69.75 -35.88 75.33 Favored 'General case' 0 CA--C 1.565 1.52 0 N-CA-C 115.081 1.512 . . . . 0.0 115.081 168.234 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 20' ' ' LYS . . . . . . . . . . . . . 14.3 ttpt -86.57 -30.74 21.64 Favored 'General case' 0 CA--C 1.567 1.627 0 N-CA-C 114.721 1.378 . . . . 0.0 114.721 178.814 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 24.5 m-85 -59.66 -68.56 0.27 Allowed 'General case' 0 N--CA 1.492 1.629 0 CA-C-O 114.188 -2.815 . . . . 0.0 111.514 155.23 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . 0.306 13.9 ttm-85 -25.68 -47.79 0.02 OUTLIER 'General case' 0 CA--C 1.597 2.788 0 CA-C-N 125.583 3.811 . . . . 0.0 116.979 163.411 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -61.36 -61.78 2.3 Favored 'General case' 0 CA--C 1.581 2.148 0 N-CA-C 119.936 3.31 . . . . 0.0 119.936 160.668 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 49.4 mt-10 -68.04 -51.34 47.96 Favored 'General case' 0 N--CA 1.502 2.128 0 N-CA-C 116.743 2.127 . . . . 0.0 116.743 175.041 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 25' ' ' ALA . . . . . . . . . . . . . . . -40.92 -46.57 2.81 Favored 'General case' 0 CA--C 1.586 2.357 0 N-CA-C 117.455 2.391 . . . . 0.0 117.455 162.953 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 26' ' ' ASN . . . . . . . . . . . . . 77.8 m-20 -86.07 -42.23 14.11 Favored 'General case' 0 N--CA 1.503 2.224 0 N-CA-C 117.168 2.284 . . . . 0.0 117.168 170.896 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 27' ' ' GLY . . . . . . . . . . . . . . . 99.53 57.0 0.95 Allowed Glycine 0 N--CA 1.493 2.455 0 N-CA-C 116.174 1.23 . . . . 0.0 116.174 -159.878 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 28' ' ' ARG . . . . . . . . . . . . . 10.7 ptt-85 -156.33 100.48 1.99 Allowed 'General case' 0 N--CA 1.493 1.688 0 N-CA-C 106.683 -1.599 . . . . 0.0 106.683 176.936 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 29' ' ' SER . . . . . . . . . . . . . 31.6 t -79.92 133.38 36.21 Favored 'General case' 0 N--CA 1.5 2.026 0 O-C-N 119.259 -2.151 . . . . 0.0 108.381 -156.322 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 30' ' ' MET . . . . . . . . . . . . . 25.1 mtp -47.21 -41.01 17.47 Favored 'General case' 0 N--CA 1.501 2.111 0 N-CA-C 119.089 2.996 . . . . 0.0 119.089 -143.371 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 31' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -47.91 -40.72 22.68 Favored 'General case' 0 CA--C 1.593 2.609 0 CA-C-N 125.318 3.69 . . . . 0.0 115.392 166.006 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 32' ' ' SER . . . . . . . . . . . . 0.37 37.4 t -54.25 -72.51 0.06 Allowed 'General case' 0 CA--C 1.576 1.946 0 N-CA-C 118.255 2.687 . . . . 0.0 118.255 145.57 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -57.3 -57.2 13.68 Favored 'General case' 0 N--CA 1.522 3.165 0 CA-C-N 125.382 3.719 . . . . 0.0 116.926 -177.693 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -40.59 -55.77 2.25 Favored 'General case' 0 CA--C 1.547 0.833 0 CA-C-O 115.698 -2.096 . . . . 0.0 108.382 169.054 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 35' ' ' LEU . . . . . . . . . . . . . 12.8 mt -59.78 -45.83 91.09 Favored 'General case' 0 C--N 1.367 1.365 0 CA-C-N 122.922 2.601 . . . . 0.0 116.135 175.575 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 36' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -56.12 -56.57 19.29 Favored 'General case' 0 CA--C 1.547 0.834 0 CA-C-O 117.534 -1.222 . . . . 0.0 113.276 175.27 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 37' ' ' ILE . . . . . . . . . . . . . 2.9 tp -63.8 -25.14 37.52 Favored 'Isoleucine or valine' 0 CA--C 1.563 1.461 0 CA-C-O 115.006 -2.426 . . . . 0.0 117.379 169.517 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 38' ' ' VAL . . . . . . . . . . . . . 3.5 t -83.29 -49.56 16.49 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.069 0 C-N-CA 127.311 2.244 . . . . 0.0 111.335 -177.018 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 26.6 mt-30 -49.66 -45.98 49.23 Favored 'General case' 0 CA--C 1.565 1.54 0 CA-C-O 118.286 -0.864 . . . . 0.0 112.214 154.614 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 40' ' ' ASP . . . . . . . . . . . . 0.343 0.2 OUTLIER -53.25 -41.28 65.31 Favored 'General case' 0 N--CA 1.492 1.636 0 N-CA-C 119.029 2.974 . . . . 0.0 119.029 157.759 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -68.3 -47.37 67.78 Favored 'General case' 0 N--CA 1.486 1.35 0 N-CA-C 114.715 1.376 . . . . 0.0 114.715 -165.646 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 1.4 pp . . . . . 0 CA--C 1.567 1.63 0 N-CA-C 117.794 2.516 . . . . 0.0 117.794 171.708 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 2.1 p30 . . . . . 0 CA--C 1.568 1.64 0 N-CA-C 112.969 0.729 . . . . 0.0 112.969 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 6.0 Cg_exo -100.2 155.35 0.5 Allowed 'Trans proline' 0 CA--C 1.553 1.472 0 C-N-CA 121.974 1.783 . . . . 0.0 113.835 -159.382 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 77.5 m80 -76.37 138.31 40.34 Favored 'General case' 0 CA--C 1.56 1.361 0 CA-C-N 113.664 -1.607 . . . . 0.0 113.479 -178.093 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . 0.274 36.2 p90 -116.03 164.56 14.26 Favored 'General case' 0 CA--C 1.561 1.381 0 CA-C-O 123.927 1.822 . . . . 0.0 110.244 117.003 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 26.6 p-10 -82.1 89.34 6.45 Favored 'General case' 0 CA--C 1.564 1.515 0 O-C-N 119.72 -1.863 . . . . 0.0 109.385 161.803 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 9.0 t80 -66.39 167.93 9.75 Favored 'General case' 0 CA--C 1.557 1.24 0 CA-C-O 123.96 1.838 . . . . 0.0 110.334 159.243 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 38.8 tpt85 159.85 110.03 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.482 0 O-C-N 119.411 -2.056 . . . . 0.0 106.128 -116.23 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 2.2 mpt? -119.26 -168.66 0.13 Allowed Pre-proline 0 CA--C 1.576 1.949 0 C-N-CA 120.0 -0.68 . . . . 0.0 112.711 -168.048 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -98.11 161.57 0.81 Allowed 'Trans proline' 0 CA--C 1.566 2.09 0 CA-C-O 123.393 1.331 . . . . 0.0 114.119 133.098 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 22.3 tpp -58.86 -33.81 70.89 Favored 'General case' 0 N--CA 1.497 1.911 0 N-CA-C 117.432 2.382 . . . . 0.0 117.432 -162.235 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . 0.25 9.1 pt-20 -62.26 -42.35 99.25 Favored 'General case' 0 N--CA 1.49 1.551 0 N-CA-C 116.39 1.996 . . . . 0.0 116.39 166.043 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -61.0 -48.84 87.26 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.211 0 CA-C-N 122.566 2.439 . . . . 0.0 112.872 173.358 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 4.8 ttt180 -71.7 -33.76 69.05 Favored 'General case' 0 CA--C 1.547 0.85 0 CA-C-O 116.153 -1.88 . . . . 0.0 115.635 174.185 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -59.44 -42.92 93.02 Favored 'General case' 0 N--CA 1.492 1.628 0 CA-C-N 123.986 3.085 . . . . 0.0 114.671 159.997 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . 0.271 39.9 mtmt -63.95 -49.57 72.05 Favored 'General case' 0 CA--C 1.566 1.582 0 CA-C-N 120.724 1.602 . . . . 0.0 115.142 172.054 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . 0.303 13.3 tp -67.35 -38.84 85.47 Favored 'General case' 0 CA--C 1.57 1.745 0 C-N-CA 125.824 1.65 . . . . 0.0 114.616 173.173 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 31.9 ttpt -88.0 -25.97 22.86 Favored 'General case' 0 CA--C 1.561 1.403 0 CA-C-O 117.261 -1.352 . . . . 0.0 113.663 -179.743 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 19.1 m-85 -64.04 -74.48 0.1 Allowed 'General case' 0 N--CA 1.489 1.492 0 CA-C-O 112.211 -3.756 . . . . 0.0 109.822 154.104 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . 0.275 6.0 tpp180 -14.31 -60.17 0.01 OUTLIER 'General case' 0 CA--C 1.589 2.468 1 CA-C-N 126.402 4.183 . . . . 0.0 115.473 165.754 . . . . . . . . 3 2 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -50.38 -78.95 0.02 OUTLIER 'General case' 0 CA--C 1.584 2.257 0 N-CA-C 120.375 3.472 . . . . 0.0 120.375 156.592 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 30.4 mt-10 . . . . . 0 N--CA 1.503 2.201 0 N-CA-C 118.969 2.951 . . . . 0.0 118.969 -179.277 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 75.8 mtm180 . . . . . 0 N--CA 1.497 1.907 0 N-CA-C 105.608 -1.997 . . . . 0.0 105.608 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 35.3 t -121.64 106.01 10.95 Favored 'General case' 0 N--CA 1.502 2.143 0 O-C-N 118.14 -2.85 . . . . 0.0 106.477 -168.346 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -38.85 -44.89 1.09 Allowed 'General case' 0 N--CA 1.494 1.729 0 N-CA-C 120.785 3.624 . . . . 0.0 120.785 -140.156 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 6.5 t-20 -45.96 -47.05 16.57 Favored 'General case' 0 CA--C 1.599 2.854 0 O-C-N 117.459 -3.276 . . . . 0.0 114.3 165.552 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . 0.332 31.2 t -47.35 -73.43 0.04 OUTLIER 'General case' 0 N--CA 1.504 2.245 0 N-CA-C 118.069 2.618 . . . . 0.0 118.069 142.929 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 8.4 tm-20 -64.17 -55.23 23.24 Favored 'General case' 0 N--CA 1.501 2.103 0 N-CA-C 119.347 3.092 . . . . 0.0 119.347 -172.913 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -36.88 -52.8 0.94 Allowed 'General case' 0 CA--C 1.554 1.116 0 CA-C-O 115.764 -2.065 . . . . 0.0 107.341 163.691 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 14.0 mt -62.58 -51.99 65.18 Favored 'General case' 0 C--N 1.372 1.561 0 CA-C-N 122.925 2.602 . . . . 0.0 115.896 177.534 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -63.7 -36.05 82.57 Favored 'General case' 0 N--CA 1.484 1.257 0 N-CA-C 114.5 1.296 . . . . 0.0 114.5 -177.824 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 12.7 tt -73.01 -43.26 58.98 Favored 'Isoleucine or valine' 0 C--O 1.189 -2.099 0 CA-C-O 113.108 -3.33 . . . . 0.0 114.198 160.347 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 3.1 t -65.09 -50.17 75.74 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.647 1 CA-C-N 126.61 4.277 . . . . 0.0 113.888 -177.457 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 38.0 mt-30 -46.49 -57.93 4.25 Favored 'General case' 0 C--N 1.365 1.24 0 CA-C-O 114.131 -2.842 . . . . 0.0 108.949 158.377 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . 0.548 4.6 t70 -36.68 -56.2 0.84 Allowed 'General case' 0 N--CA 1.496 1.827 0 N-CA-C 118.301 2.704 . . . . 0.0 118.301 161.997 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . 0.261 . . . . . . . 0 CA--C 1.544 0.713 0 N-CA-C 118.013 2.597 . . . . 0.0 118.013 -149.2 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 21.7 Cg_exo . . . . . 0 CA--C 1.572 2.412 0 N-CA-C 115.921 1.47 . . . . 0.0 115.921 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' B' B ' 6' ' ' HIS . . . . . . . . . . . . . 80.1 m80 -96.02 145.52 25.38 Favored 'General case' 0 CA--C 1.581 2.153 0 CA-C-N 113.154 -1.839 . . . . 0.0 111.287 177.978 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 7' ' ' PHE . . . . . . . . . . . . . 2.3 p90 -128.93 162.46 27.51 Favored 'General case' 0 CA--C 1.574 1.868 0 O-C-N 119.188 -2.195 . . . . 0.0 112.838 144.108 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 8' ' ' ASN . . . . . . . . . . . . . 7.9 p-10 -64.05 103.54 0.61 Allowed 'General case' 0 CA--C 1.572 1.789 0 O-C-N 120.153 -1.592 . . . . 0.0 115.134 171.646 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 9' ' ' PHE . . . . . . . . . . . . . 3.7 t80 -126.02 105.72 9.1 Favored 'General case' 0 CA--C 1.539 0.543 0 O-C-N 120.971 -1.08 . . . . 0.0 108.135 160.88 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 10' ' ' ARG . . . . . . . . . . . . 0.467 0.1 OUTLIER 94.64 87.39 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.596 1 O-C-N 114.081 -5.387 . . . . 0.0 109.519 -12.543 . . . . . . . . 4 3 . 1 . 005 nuclear orig core ' B' B ' 11' ' ' MET . . . . . . . . . . . . . 8.5 mtm -148.84 123.85 4.94 Favored Pre-proline 0 CA--C 1.566 1.568 0 CA-C-O 117.152 -1.404 . . . . 0.0 110.201 -159.133 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 12' ' ' PRO . . . . . . . . . . . . . 77.9 Cg_exo -40.76 143.16 0.62 Allowed 'Trans proline' 0 C--N 1.371 1.76 0 C-N-CA 123.467 2.778 . . . . 0.0 116.935 162.688 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 13' ' ' MET . . . . . . . . . . . . . 15.4 tpp -56.35 -32.47 64.74 Favored 'General case' 0 N--CA 1.493 1.691 0 N-CA-C 118.449 2.759 . . . . 0.0 118.449 -160.712 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 14' ' ' GLU . . . . . . . . . . . . 0.281 10.3 pt-20 -60.47 -50.92 71.64 Favored 'General case' 0 N--CA 1.49 1.534 0 N-CA-C 115.87 1.804 . . . . 0.0 115.87 162.36 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -58.35 -45.21 89.57 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.265 0 CA-C-N 122.924 2.602 . . . . 0.0 113.972 177.854 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 1.1 ttt180 -74.98 -34.4 61.99 Favored 'General case' 0 CA--C 1.544 0.727 0 CA-C-O 115.912 -1.994 . . . . 0.0 116.099 173.709 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 17' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -63.61 -39.37 94.2 Favored 'General case' 0 N--CA 1.497 1.886 0 CA-C-N 124.206 3.185 . . . . 0.0 114.052 161.632 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 44.5 mtmt -61.52 -60.55 3.52 Favored 'General case' 0 CA--C 1.568 1.641 0 CA-C-N 120.572 1.533 . . . . 0.0 114.199 169.913 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 19' ' ' LEU . . . . . . . . . . . . . 13.9 tp -60.86 -37.72 83.1 Favored 'General case' 0 N--CA 1.488 1.469 0 N-CA-C 115.249 1.574 . . . . 0.0 115.249 175.324 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 20' ' ' LYS . . . . . . . . . . . . . 19.8 ttpt -85.51 -30.87 23.09 Favored 'General case' 0 CA--C 1.561 1.366 0 CA-C-O 117.242 -1.361 . . . . 0.0 114.252 179.949 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 20.9 m-30 -64.91 -77.04 0.06 Allowed 'General case' 0 N--CA 1.491 1.598 0 CA-C-O 113.193 -3.289 . . . . 0.0 109.668 157.62 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . 0.316 0.0 OUTLIER -19.89 -53.44 0.01 OUTLIER 'General case' 0 CA--C 1.585 2.327 0 CA-C-N 125.776 3.898 . . . . 0.0 116.39 171.022 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -51.85 -80.63 0.01 OUTLIER 'General case' 0 CA--C 1.587 2.395 0 N-CA-C 118.978 2.955 . . . . 0.0 118.978 154.966 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 64.3 mm-40 -65.34 -35.28 80.5 Favored 'General case' 0 N--CA 1.501 2.099 0 N-CA-C 119.123 3.009 . . . . 0.0 119.123 -179.546 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 25' ' ' ALA . . . . . . . . . . . . . . . -39.25 -50.25 1.95 Allowed 'General case' 0 CA--C 1.588 2.43 0 N-CA-C 116.288 1.958 . . . . 0.0 116.288 153.38 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 26' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -95.65 -47.14 6.33 Favored 'General case' 0 CA--C 1.576 1.951 0 N-CA-C 116.592 2.071 . . . . 0.0 116.592 -174.059 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 27' ' ' GLY . . . . . . . . . . . . . . . 128.29 14.86 2.35 Favored Glycine 0 N--CA 1.498 2.822 0 N-CA-C 119.024 2.37 . . . . 0.0 119.024 -161.227 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 28' ' ' ARG . . . . . . . . . . . . . 79.0 mtm-85 -112.26 149.23 32.63 Favored 'General case' 0 N--CA 1.492 1.643 0 N-CA-C 104.779 -2.304 . . . . 0.0 104.779 168.766 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 29' ' ' SER . . . . . . . . . . . . . 92.3 p -117.93 109.58 16.68 Favored 'General case' 0 N--CA 1.503 2.185 0 O-C-N 118.053 -2.905 . . . . 0.0 105.786 -167.89 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 30' ' ' MET . . . . . . . . . . . . . 18.5 mtp -42.35 -42.73 3.27 Favored 'General case' 0 N--CA 1.499 1.985 0 N-CA-C 118.8 2.889 . . . . 0.0 118.8 -140.457 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 31' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -47.02 -42.63 18.53 Favored 'General case' 0 CA--C 1.592 2.586 0 CA-C-N 125.727 3.876 . . . . 0.0 115.556 165.444 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 32' ' ' SER . . . . . . . . . . . . 0.294 32.1 t -53.33 -67.8 0.23 Allowed 'General case' 0 N--CA 1.499 2.002 0 N-CA-C 119.048 2.981 . . . . 0.0 119.048 144.829 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -62.36 -59.85 4.4 Favored 'General case' 0 N--CA 1.513 2.687 0 CA-C-N 124.112 3.142 . . . . 0.0 117.066 -178.569 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -34.74 -56.96 0.54 Allowed 'General case' 0 CA--C 1.547 0.832 0 CA-C-O 115.413 -2.232 . . . . 0.0 109.61 164.426 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 35' ' ' LEU . . . . . . . . . . . . . 10.1 mt -61.55 -49.28 77.31 Favored 'General case' 0 C--N 1.367 1.359 0 CA-C-N 123.145 2.702 . . . . 0.0 116.164 177.055 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 36' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -54.92 -52.88 61.58 Favored 'General case' 0 CA--C 1.574 1.901 0 CA-C-O 116.874 -1.536 . . . . 0.0 114.026 173.95 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 37' ' ' ILE . . . . . . . . . . . . . 4.3 tt -64.29 -30.71 50.88 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.861 0 CA-C-N 122.546 2.43 . . . . 0.0 115.957 168.821 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 38' ' ' VAL . . . . . . . . . . . . . 3.5 t -73.96 -46.75 45.19 Favored 'Isoleucine or valine' 0 CA--C 1.575 1.923 0 CA-C-N 121.441 1.928 . . . . 0.0 110.967 -179.71 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 31.2 mt-30 -52.08 -43.07 63.68 Favored 'General case' 0 CA--C 1.572 1.801 0 N-CA-C 114.13 1.159 . . . . 0.0 114.13 155.413 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 40' ' ' ASP . . . . . . . . . . . . 0.385 15.6 m-20 -53.53 -42.01 66.99 Favored 'General case' 0 N--CA 1.495 1.817 0 N-CA-C 116.782 2.141 . . . . 0.0 116.782 156.055 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -70.34 -38.2 74.82 Favored 'General case' 0 CA--C 1.562 1.427 0 N-CA-C 115.27 1.581 . . . . 0.0 115.27 -171.609 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 3.8 mt . . . . . 0 CA--C 1.565 1.535 0 C-N-CA 125.635 1.574 . . . . 0.0 114.258 174.066 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 6.7 p-10 . . . . . 0 CA--C 1.567 1.601 0 CA-C-O 119.226 -0.416 . . . . 0.0 111.155 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 5.5 Cg_exo -100.19 146.1 0.39 Allowed 'Trans proline' 0 C--N 1.366 1.476 0 C-N-CA 122.065 1.844 . . . . 0.0 112.618 -160.58 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 66.1 m80 -68.31 146.79 52.96 Favored 'General case' 0 N--CA 1.485 1.294 0 N-CA-C 114.415 1.265 . . . . 0.0 114.415 -179.971 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 20.2 p90 -138.62 160.12 40.4 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 120.918 -1.114 . . . . 0.0 112.336 135.275 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 21.1 m120 -55.22 100.81 0.04 OUTLIER 'General case' 0 CA--C 1.572 1.808 0 N-CA-C 114.869 1.433 . . . . 0.0 114.869 174.168 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 10.1 t80 -130.97 103.78 6.74 Favored 'General case' 0 C--N 1.34 0.179 0 N-CA-C 106.685 -1.598 . . . . 0.0 106.685 165.479 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . 0.495 0.0 OUTLIER 88.42 68.66 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.691 1 O-C-N 114.367 -5.208 . . . . 0.0 112.533 -9.774 . . . . . . . . 4 3 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 8.4 ptp -144.02 116.77 5.71 Favored Pre-proline 0 CA--C 1.571 1.779 0 CA-C-O 115.114 -2.374 . . . . 0.0 109.27 -164.545 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 63.3 Cg_exo -34.69 143.94 0.06 OUTLIER 'Trans proline' 0 C--N 1.379 2.176 0 C-N-CA 124.667 3.578 . . . . 0.0 119.631 -172.564 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 4.4 tpp -44.35 -41.59 6.2 Favored 'General case' 0 CA--C 1.581 2.141 0 N-CA-C 116.598 2.073 . . . . 0.0 116.598 -161.042 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -63.43 -44.29 95.01 Favored 'General case' 0 CA--C 1.571 1.788 0 N-CA-C 117.379 2.363 . . . . 0.0 117.379 167.979 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 1.6 t -54.56 -45.15 71.21 Favored 'Isoleucine or valine' 0 N--CA 1.513 2.705 0 CA-C-N 122.935 2.607 . . . . 0.0 113.301 169.63 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 7.1 ttt180 -74.87 -43.25 55.43 Favored 'General case' 0 C--O 1.212 -0.918 0 CA-C-O 116.107 -1.902 . . . . 0.0 115.093 174.908 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 47.9 mt-10 -58.26 -32.1 68.05 Favored 'General case' 0 N--CA 1.493 1.681 0 CA-C-N 124.126 3.148 . . . . 0.0 115.266 163.296 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . 0.292 54.1 mtmt -67.82 -54.0 22.52 Favored 'General case' 0 CA--C 1.564 1.516 0 CA-C-N 121.112 1.778 . . . . 0.0 114.737 166.182 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . 0.288 14.9 tp -67.08 -33.84 76.37 Favored 'General case' 0 CA--C 1.574 1.874 0 N-CA-C 115.254 1.576 . . . . 0.0 115.254 175.632 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 15.0 ttpt -91.71 -28.58 17.34 Favored 'General case' 0 CA--C 1.555 1.162 0 C-N-CA 126.788 2.035 . . . . 0.0 114.143 -178.671 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 22.1 m-30 -63.18 -71.21 0.17 Allowed 'General case' 0 N--CA 1.49 1.526 0 CA-C-O 113.265 -3.255 . . . . 0.0 109.383 153.841 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . 0.304 0.0 OUTLIER -25.09 -53.35 0.04 OUTLIER 'General case' 0 CA--C 1.587 2.399 0 CA-C-N 125.71 3.868 . . . . 0.0 116.158 171.393 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -50.61 -79.22 0.02 OUTLIER 'General case' 0 CA--C 1.585 2.296 0 N-CA-C 119.806 3.261 . . . . 0.0 119.806 154.557 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 75.2 mm-40 . . . . . 0 N--CA 1.499 2.007 0 N-CA-C 118.809 2.892 . . . . 0.0 118.809 -177.251 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 32.4 mtm-85 . . . . . 0 N--CA 1.492 1.653 0 CA-C-O 122.42 1.105 . . . . 0.0 108.17 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 8.6 t -123.76 116.78 23.57 Favored 'General case' 0 N--CA 1.496 1.841 0 N-CA-C 105.206 -2.146 . . . . 0.0 105.206 -177.952 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 13.2 mtp -43.38 -42.57 4.7 Favored 'General case' 0 N--CA 1.497 1.908 0 N-CA-C 119.101 3.0 . . . . 0.0 119.101 -143.886 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . 0.258 0.1 OUTLIER -48.09 -41.97 27.65 Favored 'General case' 0 CA--C 1.592 2.594 0 CA-C-N 125.255 3.661 . . . . 0.0 114.957 166.522 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . 0.333 34.8 t -52.6 -64.04 0.95 Allowed 'General case' 0 N--CA 1.499 2.005 0 N-CA-C 120.507 3.521 . . . . 0.0 120.507 145.569 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 2.8 tp10 -72.48 -53.24 12.66 Favored 'General case' 0 N--CA 1.512 2.639 0 CA-C-N 123.461 2.846 . . . . 0.0 117.852 -177.523 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -38.47 -54.18 1.5 Allowed 'General case' 0 CA--C 1.554 1.133 0 CA-C-O 115.773 -2.06 . . . . 0.0 109.429 162.097 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 15.1 mt -63.38 -54.96 28.66 Favored 'General case' 0 C--N 1.37 1.481 0 CA-C-N 123.51 2.868 . . . . 0.0 114.935 176.398 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -52.4 -44.32 65.29 Favored 'General case' 0 CA--C 1.564 1.512 0 CA-C-O 116.818 -1.563 . . . . 0.0 115.04 175.868 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -68.58 -41.08 82.71 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.533 0 CA-C-N 121.946 2.157 . . . . 0.0 114.532 169.928 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 3.8 t -71.76 -46.24 62.37 Favored 'Isoleucine or valine' 0 CA--C 1.583 2.218 0 CA-C-N 121.393 1.906 . . . . 0.0 111.241 -178.108 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 26.5 mt-30 -51.8 -43.05 62.92 Favored 'General case' 0 N--CA 1.488 1.465 0 C-N-CA 124.65 1.18 . . . . 0.0 114.134 156.261 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . 0.459 24.2 m-20 -46.5 -56.47 5.93 Favored 'General case' 0 N--CA 1.488 1.461 0 N-CA-C 114.225 1.195 . . . . 0.0 114.225 155.622 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . 0.362 . . . . . . . 0 CA--C 1.543 0.704 0 N-CA-C 118.526 2.787 . . . . 0.0 118.526 -154.634 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 5' ' ' PRO . . . . . . . . . . . . 0.619 7.6 Cg_exo . . . . . 0 N--CA 1.492 1.407 1 N-CA-C 126.262 5.447 . . . . 0.0 126.262 . . . . . . . . . 2 1 . 1 . 006 nuclear orig core ' B' B ' 6' ' ' HIS . . . . . . . . . . . . . 64.9 m80 -75.17 111.73 10.71 Favored 'General case' 0 CA--C 1.564 1.503 0 N-CA-C 115.508 1.67 . . . . 0.0 115.508 -149.396 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 7' ' ' PHE . . . . . . . . . . . . 0.292 30.7 p90 -122.09 -166.22 1.37 Allowed 'General case' 0 CA--C 1.563 1.462 0 O-C-N 120.35 -1.469 . . . . 0.0 108.919 128.772 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 8' ' ' ASN . . . . . . . . . . . . . 34.6 m-20 -116.09 105.65 12.85 Favored 'General case' 0 CA--C 1.555 1.166 0 O-C-N 120.102 -1.624 . . . . 0.0 107.37 166.598 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 9' ' ' PHE . . . . . . . . . . . . 0.25 5.0 t80 -71.75 92.72 1.22 Allowed 'General case' 0 CA--C 1.576 1.977 0 CA-C-O 126.676 3.131 . . . . 0.0 113.256 176.126 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 10' ' ' ARG . . . . . . . . . . . . . 28.5 ptt85 -81.9 130.14 34.98 Favored 'General case' 0 N--CA 1.48 1.05 1 CA-C-N 108.291 -4.05 . . . . 0.0 111.256 168.498 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 11' ' ' MET . . . . . . . . . . . . . 28.3 mtm -136.44 121.91 13.31 Favored Pre-proline 0 CA--C 1.565 1.527 0 CA-C-O 117.509 -1.234 . . . . 0.0 111.7 -163.703 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 12' ' ' PRO . . . . . . . . . . . . . 80.3 Cg_exo -43.66 145.03 1.95 Allowed 'Trans proline' 0 C--N 1.378 2.123 0 C-N-CA 123.913 3.076 . . . . 0.0 116.02 169.23 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 13' ' ' MET . . . . . . . . . . . . . 15.7 tpp -60.8 -34.06 73.93 Favored 'General case' 0 N--CA 1.492 1.655 0 N-CA-C 117.083 2.253 . . . . 0.0 117.083 -150.559 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -59.7 -49.31 78.23 Favored 'General case' 0 CA--C 1.573 1.861 0 N-CA-C 117.688 2.477 . . . . 0.0 117.688 161.335 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -58.28 -48.06 85.91 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.453 0 CA-C-N 123.369 2.804 . . . . 0.0 113.331 174.253 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 4.2 ttt180 -71.21 -37.23 72.08 Favored 'General case' 0 C--O 1.216 -0.703 0 CA-C-O 115.951 -1.976 . . . . 0.0 115.519 173.024 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 17' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -60.6 -35.81 77.02 Favored 'General case' 0 CA--C 1.569 1.709 0 CA-C-N 124.119 3.145 . . . . 0.0 114.185 161.578 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . 0.291 44.1 mtmt -67.79 -48.71 65.54 Favored 'General case' 0 CA--C 1.566 1.574 0 CA-C-N 121.443 1.929 . . . . 0.0 115.483 169.55 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 19' ' ' LEU . . . . . . . . . . . . 0.278 0.4 OUTLIER -70.49 -36.29 73.73 Favored 'General case' 0 CA--C 1.574 1.891 0 CA-C-N 120.904 1.684 . . . . 0.0 115.06 173.604 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 20' ' ' LYS . . . . . . . . . . . . . 15.8 ttpt -88.34 -27.89 21.35 Favored 'General case' 0 CA--C 1.555 1.168 0 C-N-CA 125.822 1.649 . . . . 0.0 113.682 178.729 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 22.1 m-30 -64.09 -72.89 0.13 Allowed 'General case' 0 N--CA 1.49 1.545 1 CA-C-O 111.469 -4.11 . . . . 0.0 109.598 156.052 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . 0.253 12.0 tpp180 -13.19 -61.04 0.01 OUTLIER 'General case' 0 CA--C 1.592 2.558 1 CA-C-N 127.07 4.487 . . . . 0.0 116.34 164.519 . . . . . . . . 3 2 . 1 . 006 nuclear orig core ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -54.96 -75.86 0.03 OUTLIER 'General case' 0 CA--C 1.59 2.486 0 N-CA-C 119.29 3.07 . . . . 0.0 119.29 160.561 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 52.6 mt-10 -68.46 -34.77 76.54 Favored 'General case' 0 N--CA 1.504 2.263 0 N-CA-C 118.819 2.896 . . . . 0.0 118.819 -179.345 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 25' ' ' ALA . . . . . . . . . . . . . . . -38.31 -46.87 1.15 Allowed 'General case' 0 CA--C 1.579 2.062 0 N-CA-C 115.973 1.842 . . . . 0.0 115.973 152.321 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 26' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -98.66 -51.21 3.99 Favored 'General case' 0 CA--C 1.577 1.984 0 N-CA-C 117.458 2.392 . . . . 0.0 117.458 -173.651 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 27' ' ' GLY . . . . . . . . . . . . . . . 117.69 23.47 3.68 Favored Glycine 0 CA--C 1.563 3.082 0 N-CA-C 119.575 2.59 . . . . 0.0 119.575 -151.251 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 28' ' ' ARG . . . . . . . . . . . . . 16.8 mtt85 -112.47 147.44 36.52 Favored 'General case' 0 CA--C 1.572 1.821 0 N-CA-C 103.769 -2.678 . . . . 0.0 103.769 158.984 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 29' ' ' SER . . . . . . . . . . . . . 35.6 t -113.42 112.18 23.2 Favored 'General case' 0 N--CA 1.505 2.302 0 O-C-N 117.793 -3.067 . . . . 0.0 105.67 -172.884 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 30' ' ' MET . . . . . . . . . . . . . 22.7 mtp -40.65 -45.61 2.4 Favored 'General case' 0 N--CA 1.5 2.038 0 N-CA-C 118.822 2.897 . . . . 0.0 118.822 -144.364 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 31' ' ' ASN . . . . . . . . . . . . . 20.0 t-20 -44.44 -44.03 8.18 Favored 'General case' 0 CA--C 1.594 2.673 0 CA-C-N 125.494 3.77 . . . . 0.0 115.576 165.045 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 32' ' ' SER . . . . . . . . . . . . 0.279 56.3 m -57.36 -60.42 3.67 Favored 'General case' 0 N--CA 1.5 2.034 0 N-CA-C 120.7 3.593 . . . . 0.0 120.7 148.464 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -67.49 -61.64 1.8 Allowed 'General case' 0 N--CA 1.51 2.542 0 CA-C-N 123.666 2.939 . . . . 0.0 115.293 177.667 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -32.17 -53.78 0.3 Allowed 'General case' 0 N--CA 1.481 1.091 0 CA-C-O 115.289 -2.291 . . . . 0.0 109.266 163.967 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 35' ' ' LEU . . . . . . . . . . . . . 11.8 mt -62.28 -54.42 41.01 Favored 'General case' 0 C--N 1.368 1.382 0 CA-C-N 123.528 2.876 . . . . 0.0 115.053 176.275 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 36' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -59.86 -39.46 85.29 Favored 'General case' 0 CA--C 1.569 1.679 0 CA-C-O 116.302 -1.809 . . . . 0.0 115.582 175.479 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 37' ' ' ILE . . . . . . . . . . . . . 10.4 tt -68.55 -26.3 33.02 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.622 0 CA-C-N 123.452 2.842 . . . . 0.0 115.253 162.668 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 38' ' ' VAL . . . . . . . . . . . . . 4.3 t -86.68 -47.05 16.36 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.094 0 CA-C-N 125.037 3.562 . . . . 0.0 112.77 -178.891 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 27.8 mt-30 -46.07 -49.37 16.5 Favored 'General case' 0 N--CA 1.484 1.269 0 CA-C-O 116.119 -1.896 . . . . 0.0 113.068 150.961 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 40' ' ' ASP . . . . . . . . . . . . 0.374 50.1 t0 -44.01 -61.3 1.5 Allowed 'General case' 0 N--CA 1.494 1.76 0 CA-C-N 120.892 1.678 . . . . 0.0 114.638 154.533 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -82.62 19.21 1.33 Allowed 'General case' 0 CA--C 1.55 0.98 0 N-CA-C 120.556 3.539 . . . . 0.0 120.556 -162.39 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.484 1.232 0 N-CA-C 116.358 1.985 . . . . 0.0 116.358 143.772 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 . . . . . 0 CA--C 1.57 1.717 0 N-CA-C 108.12 -1.067 . . . . 0.0 108.12 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 5.7 Cg_exo -99.74 146.61 0.45 Allowed 'Trans proline' 0 C--N 1.366 1.473 0 CA-C-N 122.688 1.996 . . . . 0.0 113.782 -154.049 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 73.5 m80 -67.56 137.35 55.64 Favored 'General case' 0 CA--C 1.564 1.508 0 CA-C-N 114.377 -1.283 . . . . 0.0 113.383 173.031 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . 0.267 27.5 p90 -120.52 167.74 12.08 Favored 'General case' 0 CA--C 1.562 1.415 0 O-C-N 119.557 -1.965 . . . . 0.0 110.576 115.314 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 98.5 m-20 -89.99 90.87 8.34 Favored 'General case' 0 N--CA 1.487 1.411 0 O-C-N 119.695 -1.878 . . . . 0.0 108.059 166.365 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . 0.504 ' CD2' ' SD ' ' A' ' 11' ' ' MET . 8.5 t80 -63.67 150.77 43.57 Favored 'General case' 0 CA--C 1.557 1.217 0 CA-C-O 125.457 2.551 . . . . 0.0 112.344 168.749 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -154.32 94.55 1.73 Allowed 'General case' 0 C--N 1.307 -1.28 0 CA-C-N 111.616 -2.538 . . . . 0.0 107.825 -139.539 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' MET . . . . . 0.504 ' SD ' ' CD2' ' A' ' 9' ' ' PHE . 0.8 OUTLIER -114.77 115.59 43.71 Favored Pre-proline 0 CA--C 1.56 1.352 0 CA-C-O 117.219 -1.372 . . . . 0.0 111.785 -158.796 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 80.8 Cg_exo -42.47 140.61 2.55 Favored 'Trans proline' 0 CA--C 1.56 1.81 0 C-N-CA 122.79 2.327 . . . . 0.0 115.772 161.233 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 22.9 tpp -55.68 -32.36 63.19 Favored 'General case' 0 N--CA 1.492 1.668 0 N-CA-C 118.376 2.732 . . . . 0.0 118.376 -157.671 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . 0.256 9.4 pt-20 -60.9 -46.49 90.45 Favored 'General case' 0 CA--C 1.568 1.66 0 N-CA-C 116.568 2.062 . . . . 0.0 116.568 162.186 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -57.24 -49.6 79.35 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.234 0 CA-C-N 122.925 2.602 . . . . 0.0 112.82 172.7 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 1.4 ttt180 -72.39 -33.95 67.56 Favored 'General case' 0 C--O 1.216 -0.703 0 CA-C-O 116.086 -1.911 . . . . 0.0 115.433 175.39 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -61.89 -40.32 95.01 Favored 'General case' 0 CA--C 1.566 1.563 0 CA-C-N 124.062 3.119 . . . . 0.0 114.53 161.093 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . 0.255 46.3 mtmt -67.92 -48.5 65.79 Favored 'General case' 0 CA--C 1.564 1.484 0 CA-C-N 121.577 1.989 . . . . 0.0 115.366 173.024 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . 0.365 0.2 OUTLIER -68.16 -37.3 80.86 Favored 'General case' 0 CA--C 1.574 1.876 0 C-N-CA 124.791 1.236 . . . . 0.0 112.461 172.362 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 27.8 ttpt -90.17 -22.83 21.52 Favored 'General case' 0 CA--C 1.567 1.612 0 O-C-N 119.155 -2.216 . . . . 0.0 115.382 179.534 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 14.8 m-85 -62.8 -68.02 0.37 Allowed 'General case' 0 N--CA 1.492 1.657 0 CA-C-O 114.009 -2.901 . . . . 0.0 110.511 151.88 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . 0.349 32.2 ttt85 -28.45 -45.19 0.03 OUTLIER 'General case' 0 CA--C 1.601 2.933 0 CA-C-N 125.682 3.856 . . . . 0.0 116.917 166.635 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . 0.288 . . -54.2 -80.29 0.02 OUTLIER 'General case' 0 CA--C 1.58 2.103 0 N-CA-C 118.111 2.634 . . . . 0.0 118.111 153.796 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 51.8 mm-40 . . . . . 0 CA--C 1.578 2.049 0 N-CA-C 118.742 2.867 . . . . 0.0 118.742 -178.3 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 75.7 mtm180 . . . . . 0 CA--C 1.576 1.975 0 N-CA-C 104.308 -2.479 . . . . 0.0 104.308 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 77.3 p -126.03 109.85 12.88 Favored 'General case' 0 N--CA 1.509 2.508 0 O-C-N 117.47 -3.269 . . . . 0.0 107.654 -171.822 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -45.56 -38.52 6.53 Favored 'General case' 0 N--CA 1.496 1.863 0 N-CA-C 120.265 3.432 . . . . 0.0 120.265 -137.739 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 11.0 t-20 -47.3 -46.51 25.14 Favored 'General case' 0 CA--C 1.597 2.771 0 CA-C-N 124.931 3.514 . . . . 0.0 114.411 163.808 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . 0.314 17.5 t -48.77 -76.22 0.02 OUTLIER 'General case' 0 N--CA 1.5 2.05 0 N-CA-C 117.582 2.438 . . . . 0.0 117.582 143.923 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 10.6 tm-20 -60.74 -53.58 55.66 Favored 'General case' 0 N--CA 1.506 2.351 0 CA-C-N 123.559 2.89 . . . . 0.0 118.745 -172.104 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -42.99 -53.98 4.49 Favored 'General case' 0 CA--C 1.567 1.618 0 CA-C-O 115.699 -2.096 . . . . 0.0 106.244 167.52 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 19.7 mt -62.93 -44.56 95.75 Favored 'General case' 0 C--N 1.375 1.701 0 CA-C-N 124.093 3.133 . . . . 0.0 115.759 177.545 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.47 -44.46 97.06 Favored 'General case' 0 N--CA 1.48 1.046 0 CA-C-O 115.632 -2.128 . . . . 0.0 113.8 177.892 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -69.79 -35.12 63.74 Favored 'Isoleucine or valine' 0 CA--C 1.564 1.504 0 CA-C-N 121.278 1.853 . . . . 0.0 115.027 165.95 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 6.6 t -76.51 -46.56 31.55 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.839 0 CA-C-N 121.93 2.15 . . . . 0.0 111.641 -173.147 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 14.0 tp60 -62.61 -36.77 83.82 Favored 'General case' 0 CA--C 1.567 1.613 0 O-C-N 121.142 -0.974 . . . . 0.0 112.957 160.58 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . 0.446 0.3 OUTLIER -41.35 -53.4 3.3 Favored 'General case' 0 N--CA 1.502 2.164 0 N-CA-C 116.467 2.025 . . . . 0.0 116.467 149.101 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.553 1.092 0 N-CA-C 118.031 2.604 . . . . 0.0 118.031 -164.722 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 7.3 Cg_exo . . . . . 0 CA--C 1.553 1.442 0 N-CA-C 115.514 1.313 . . . . 0.0 115.514 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' B' B ' 6' ' ' HIS . . . . . . . . . . . . . 80.3 m80 -79.51 126.19 30.55 Favored 'General case' 0 CA--C 1.566 1.575 0 CA-C-N 113.99 -1.459 . . . . 0.0 112.277 175.278 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 7' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -128.93 155.61 45.04 Favored 'General case' 0 CA--C 1.567 1.609 0 O-C-N 120.655 -1.278 . . . . 0.0 111.067 154.322 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 8' ' ' ASN . . . . . . . . . . . . . 6.7 p-10 -59.18 103.27 0.17 Allowed 'General case' 0 CA--C 1.575 1.904 0 N-CA-C 115.709 1.744 . . . . 0.0 115.709 171.15 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 9' ' ' PHE . . . . . . . . . . . . . 2.6 t80 -126.49 104.95 8.42 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 124.515 1.126 . . . . 0.0 108.557 158.365 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 10' ' ' ARG . . . . . . . . . . . . 0.472 34.8 tpt85 97.66 83.55 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.784 1 O-C-N 113.746 -5.596 . . . . 0.0 111.297 -19.161 . . . . . . . . 3 2 . 1 . 007 nuclear orig core ' B' B ' 11' ' ' MET . . . . . . . . . . . . . 16.1 mtt -151.5 130.13 6.25 Favored Pre-proline 0 CA--C 1.567 1.621 0 CA-C-O 117.26 -1.352 . . . . 0.0 110.46 -155.842 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 12' ' ' PRO . . . . . . . . . . . . . 83.8 Cg_exo -43.92 147.87 1.16 Allowed 'Trans proline' 0 CA--C 1.559 1.734 0 C-N-CA 123.172 2.582 . . . . 0.0 117.971 168.101 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 13' ' ' MET . . . . . . . . . . . . . 2.0 tpt -47.27 -39.84 15.4 Favored 'General case' 0 CA--C 1.575 1.917 0 N-CA-C 117.867 2.543 . . . . 0.0 117.867 -166.393 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -63.85 -50.92 66.97 Favored 'General case' 0 N--CA 1.487 1.421 0 N-CA-C 116.722 2.119 . . . . 0.0 116.722 171.15 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -59.35 -51.15 76.04 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.612 0 CA-C-N 121.145 1.793 . . . . 0.0 113.65 176.522 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -67.0 -31.63 72.32 Favored 'General case' 0 CA--C 1.547 0.847 0 CA-C-O 115.987 -1.959 . . . . 0.0 116.266 170.811 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 17' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -60.23 -47.47 85.82 Favored 'General case' 0 N--CA 1.492 1.629 0 CA-C-N 123.775 2.989 . . . . 0.0 113.822 160.691 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . 0.671 3.9 pttt -72.13 -35.43 69.1 Favored 'General case' 0 CA--C 1.568 1.641 0 N-CA-C 118.359 2.726 . . . . 0.0 118.359 177.459 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 19' ' ' LEU . . . . . . . . . . . . 0.361 0.4 OUTLIER -68.81 -40.13 79.7 Favored 'General case' 0 CA--C 1.587 2.37 0 O-C-N 120.753 -1.217 . . . . 0.0 113.637 164.568 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 20' ' ' LYS . . . . . . . . . . . . . 28.8 ttpt -88.75 -30.39 19.09 Favored 'General case' 0 CA--C 1.56 1.358 0 O-C-N 120.135 -1.603 . . . . 0.0 115.09 -177.368 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 35.5 m-85 -58.52 -69.61 0.18 Allowed 'General case' 0 N--CA 1.49 1.526 0 CA-C-O 112.211 -3.757 . . . . 0.0 110.387 153.708 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . 0.295 23.5 ttt180 -21.99 -56.76 0.03 OUTLIER 'General case' 0 CA--C 1.589 2.46 1 CA-C-N 126.717 4.326 . . . . 0.0 116.579 168.219 . . . . . . . . 3 2 . 1 . 007 nuclear orig core ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -51.99 -71.94 0.06 Allowed 'General case' 0 CA--C 1.575 1.927 0 N-CA-C 121.199 3.778 . . . . 0.0 121.199 157.544 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 66.7 mm-40 -73.25 -32.11 64.52 Favored 'General case' 0 N--CA 1.497 1.917 0 N-CA-C 118.019 2.6 . . . . 0.0 118.019 -177.996 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 25' ' ' ALA . . . . . . . . . . . . . . . -41.71 -48.36 4.17 Favored 'General case' 0 CA--C 1.578 2.023 0 N-CA-C 116.775 2.139 . . . . 0.0 116.775 151.462 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 26' ' ' ASN . . . . . . . . . . . . 0.253 0.1 OUTLIER -93.82 -41.2 9.77 Favored 'General case' 0 CA--C 1.581 2.169 0 N-CA-C 116.862 2.171 . . . . 0.0 116.862 -179.349 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 27' ' ' GLY . . . . . . . . . . . . . . . 113.94 49.98 0.52 Allowed Glycine 0 N--CA 1.497 2.72 0 N-CA-C 116.152 1.221 . . . . 0.0 116.152 -167.218 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 28' ' ' ARG . . . . . . . . . . . . . 5.2 ttt85 -156.24 86.95 1.03 Allowed 'General case' 0 N--CA 1.496 1.837 0 N-CA-C 106.817 -1.549 . . . . 0.0 106.817 -164.826 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 29' ' ' SER . . . . . . . . . . . . . 12.3 t -81.9 129.57 34.8 Favored 'General case' 0 N--CA 1.5 2.027 0 O-C-N 118.58 -2.575 . . . . 0.0 107.747 -150.95 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 30' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -46.62 -39.79 11.84 Favored 'General case' 0 N--CA 1.496 1.871 0 N-CA-C 119.546 3.165 . . . . 0.0 119.546 -143.349 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 31' ' ' ASN . . . . . . . . . . . . 0.261 0.1 OUTLIER -48.55 -39.38 23.37 Favored 'General case' 0 CA--C 1.589 2.456 0 CA-C-N 125.781 3.9 . . . . 0.0 114.997 166.332 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 32' ' ' SER . . . . . . . . . . . . 0.319 33.5 t -56.77 -67.19 0.33 Allowed 'General case' 0 CA--C 1.576 1.952 0 N-CA-C 119.39 3.108 . . . . 0.0 119.39 147.385 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . 0.25 6.2 tp10 -66.23 -55.1 17.83 Favored 'General case' 0 N--CA 1.52 3.068 0 CA-C-N 124.963 3.529 . . . . 0.0 115.809 -178.298 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -39.71 -54.91 2.0 Favored 'General case' 0 CA--C 1.553 1.086 0 CA-C-O 115.057 -2.401 . . . . 0.0 108.086 167.239 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 35' ' ' LEU . . . . . . . . . . . . . 11.6 mt -63.08 -54.66 34.5 Favored 'General case' 0 C--N 1.373 1.622 0 CA-C-N 124.485 3.312 . . . . 0.0 115.124 177.533 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 36' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -56.59 -38.13 71.59 Favored 'General case' 0 CA--C 1.566 1.592 0 N-CA-C 115.484 1.661 . . . . 0.0 115.484 177.858 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 37' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -69.66 -38.05 75.48 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.474 0 N-CA-C 115.658 1.725 . . . . 0.0 115.658 164.885 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 38' ' ' VAL . . . . . . . . . . . . . 3.1 t -73.83 -48.07 40.87 Favored 'Isoleucine or valine' 0 CA--C 1.577 1.989 0 C-N-CA 127.14 2.176 . . . . 0.0 111.732 -178.849 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -47.17 -51.44 18.28 Favored 'General case' 0 CA--C 1.556 1.208 0 CA-C-O 117.508 -1.234 . . . . 0.0 113.427 153.416 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 40' ' ' ASP . . . . . . . . . . . . 0.936 0.5 OUTLIER -52.14 -37.41 54.32 Favored 'General case' 0 CA--C 1.573 1.833 0 N-CA-C 118.879 2.918 . . . . 0.0 118.879 160.706 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -68.86 -49.01 61.94 Favored 'General case' 0 CA--C 1.554 1.126 0 N-CA-C 115.892 1.812 . . . . 0.0 115.892 -170.263 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 1.4 pp . . . . . 0 CA--C 1.566 1.585 0 N-CA-C 117.534 2.42 . . . . 0.0 117.534 178.364 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 23.8 p-10 . . . . . 0 CA--C 1.57 1.745 0 N-CA-C 113.18 0.807 . . . . 0.0 113.18 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 65.2 Cg_endo -67.5 157.7 60.54 Favored 'Trans proline' 0 CA--C 1.564 2.024 0 C-N-CA 123.044 2.496 . . . . 0.0 117.566 175.949 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 76.0 m80 -85.1 145.13 27.81 Favored 'General case' 0 CA--C 1.565 1.538 0 N-CA-C 115.296 1.591 . . . . 0.0 115.296 -171.28 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 1.3 p90 -128.31 136.78 51.46 Favored 'General case' 0 N--CA 1.487 1.407 0 O-C-N 120.094 -1.629 . . . . 0.0 109.351 135.987 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 58.5 m-20 -73.53 92.47 1.91 Allowed 'General case' 0 CA--C 1.558 1.257 0 O-C-N 120.953 -1.092 . . . . 0.0 110.748 175.75 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 3.9 t80 -68.87 163.35 24.51 Favored 'General case' 0 CA--C 1.562 1.423 0 CA-C-O 124.69 2.186 . . . . 0.0 110.466 164.347 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 173.18 98.74 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.783 0 CA-C-N 113.114 -1.857 . . . . 0.0 107.135 -124.304 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 7.3 mtt -145.75 131.74 9.54 Favored Pre-proline 0 N--CA 1.496 1.852 0 CA-C-O 116.751 -1.595 . . . . 0.0 112.275 -153.125 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 79.9 Cg_exo -43.27 150.16 0.43 Allowed 'Trans proline' 0 CA--C 1.561 1.846 0 C-N-CA 123.113 2.542 . . . . 0.0 116.936 170.585 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 21.2 tpp -64.38 -28.72 69.89 Favored 'General case' 0 N--CA 1.491 1.619 0 N-CA-C 116.987 2.217 . . . . 0.0 116.987 -164.192 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 9.1 pm0 -57.54 -48.01 80.46 Favored 'General case' 0 CA--C 1.566 1.571 0 N-CA-C 116.973 2.212 . . . . 0.0 116.973 156.365 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 2.0 t -60.97 -47.28 94.26 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.047 0 CA-C-N 122.019 2.19 . . . . 0.0 115.25 -179.747 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . 0.509 0.1 OUTLIER -114.87 27.43 9.43 Favored 'General case' 0 N--CA 1.485 1.314 0 N-CA-C 118.376 2.732 . . . . 0.0 118.376 170.979 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 5.5 pt-20 -71.61 -45.96 60.62 Favored 'General case' 0 N--CA 1.483 1.222 0 O-C-N 119.141 -2.224 . . . . 0.0 113.517 119.856 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . 0.297 56.0 mtmt -60.98 -52.26 65.77 Favored 'General case' 0 CA--C 1.563 1.469 0 N-CA-C 116.338 1.977 . . . . 0.0 116.338 177.986 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 6.9 mt -65.67 -43.93 87.79 Favored 'General case' 0 CA--C 1.576 1.946 0 CA-C-N 120.291 1.405 . . . . 0.0 114.326 166.898 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 5.7 ttpt -77.7 -29.36 51.33 Favored 'General case' 0 CA--C 1.572 1.806 0 CA-C-N 123.296 2.771 . . . . 0.0 113.69 -178.499 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 17.3 m-30 -63.71 -67.86 0.39 Allowed 'General case' 0 N--CA 1.485 1.317 0 CA-C-O 115.627 -2.13 . . . . 0.0 111.725 159.792 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . 0.307 14.1 ttt180 -26.06 -49.19 0.03 OUTLIER 'General case' 0 CA--C 1.595 2.697 0 CA-C-N 124.626 3.376 . . . . 0.0 115.889 164.782 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . 0.293 . . -55.26 -76.53 0.03 OUTLIER 'General case' 0 CA--C 1.591 2.52 0 O-C-N 117.174 -3.454 . . . . 0.0 118.225 156.278 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 38.8 mt-10 . . . . . 0 N--CA 1.504 2.238 0 N-CA-C 119.342 3.09 . . . . 0.0 119.342 -179.182 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . 0.396 36.6 mtm105 . . . . . 0 N--CA 1.498 1.945 0 N-CA-C 107.39 -1.337 . . . . 0.0 107.39 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 80.2 p -131.4 105.81 7.84 Favored 'General case' 0 N--CA 1.502 2.171 0 O-C-N 117.487 -3.258 . . . . 0.0 105.757 -172.0 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -38.26 -45.65 1.0 Allowed 'General case' 0 N--CA 1.495 1.81 0 N-CA-C 120.336 3.458 . . . . 0.0 120.336 -139.947 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 15.0 t-20 -42.63 -47.59 5.3 Favored 'General case' 0 CA--C 1.597 2.763 0 O-C-N 117.758 -3.089 . . . . 0.0 115.293 162.788 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . 0.277 42.8 t -54.0 -63.94 0.99 Allowed 'General case' 0 N--CA 1.501 2.119 0 N-CA-C 120.073 3.36 . . . . 0.0 120.073 147.052 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 5.9 tm-20 -69.35 -51.77 33.65 Favored 'General case' 0 N--CA 1.515 2.79 0 CA-C-N 123.042 2.655 . . . . 0.0 116.986 -175.598 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -44.08 -54.8 5.21 Favored 'General case' 0 CA--C 1.561 1.387 0 CA-C-O 115.535 -2.174 . . . . 0.0 107.59 162.793 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 10.9 mt -64.3 -56.2 16.1 Favored 'General case' 0 N--CA 1.491 1.622 0 CA-C-N 124.759 3.436 . . . . 0.0 115.099 -176.598 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -57.73 -38.59 75.58 Favored 'General case' 0 CA--C 1.563 1.45 0 CA-C-O 115.928 -1.987 . . . . 0.0 113.366 177.206 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -69.59 -33.3 56.19 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.668 0 CA-C-N 122.485 2.402 . . . . 0.0 115.441 166.972 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 2.3 t -74.98 -49.49 28.35 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.544 0 C-N-CA 128.535 2.734 . . . . 0.0 112.974 178.906 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 34.3 mt-30 -43.34 -55.13 4.25 Favored 'General case' 0 N--CA 1.484 1.254 0 CA-C-O 116.695 -1.622 . . . . 0.0 112.294 151.531 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . 0.429 0.9 OUTLIER -41.6 -49.81 4.1 Favored 'General case' 0 N--CA 1.495 1.812 0 N-CA-C 118.072 2.619 . . . . 0.0 118.072 158.789 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . 0.331 . . . . . . . 0 CA--C 1.548 0.875 0 N-CA-C 117.784 2.513 . . . . 0.0 117.784 -159.361 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo . . . . . 0 CA--C 1.568 2.196 0 N-CA-C 116.991 1.881 . . . . 0.0 116.991 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' B' B ' 6' ' ' HIS . . . . . . . . . . . . . 76.6 m80 -88.27 153.46 21.2 Favored 'General case' 0 CA--C 1.569 1.711 0 CA-C-N 111.723 -2.49 . . . . 0.0 112.429 169.544 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 7' ' ' PHE . . . . . . . . . . . . . 10.0 p90 -130.43 159.69 36.29 Favored 'General case' 0 CA--C 1.568 1.647 0 O-C-N 119.491 -2.006 . . . . 0.0 112.047 129.782 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 8' ' ' ASN . . . . . . . . . . . . . 14.6 p-10 -65.74 87.69 0.09 Allowed 'General case' 0 CA--C 1.567 1.626 0 N-CA-C 114.279 1.214 . . . . 0.0 114.279 168.937 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 9' ' ' PHE . . . . . 0.523 ' CD2' ' SD ' ' B' ' 11' ' ' MET 0.254 1.9 t80 -79.76 179.44 7.53 Favored 'General case' 0 CA--C 1.556 1.177 0 CA-C-O 123.724 1.726 . . . . 0.0 110.361 158.932 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 10' ' ' ARG . . . . . . . . . . . . 0.425 67.4 mtt180 -127.16 -136.94 0.25 Allowed 'General case' 0 N--CA 1.477 0.886 0 CA-C-N 114.246 -1.343 . . . . 0.0 110.832 -164.418 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 11' ' ' MET . . . . . 0.523 ' SD ' ' CD2' ' B' ' 9' ' ' PHE . 5.1 mmt -146.12 171.14 6.8 Favored Pre-proline 0 CA--C 1.579 2.071 0 O-C-N 117.301 -3.375 . . . . 0.0 110.683 63.331 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 12' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -45.76 131.92 13.31 Favored 'Trans proline' 0 C--N 1.371 1.721 0 O-C-N 117.103 -2.104 . . . . 0.0 113.328 147.882 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 13' ' ' MET . . . . . . . . . . . . . 22.5 tpp -60.17 -27.12 66.86 Favored 'General case' 0 CA--C 1.568 1.637 0 N-CA-C 118.14 2.644 . . . . 0.0 118.14 -154.335 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 14' ' ' GLU . . . . . . . . . . . . 0.271 11.1 pt-20 -57.14 -50.07 73.96 Favored 'General case' 0 CA--C 1.565 1.546 0 N-CA-C 117.001 2.223 . . . . 0.0 117.001 162.309 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -63.52 -43.06 98.17 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.884 0 CA-C-N 121.037 1.744 . . . . 0.0 114.375 173.756 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 16' ' ' ARG . . . . . . . . . . . . 0.261 4.8 ttt180 -78.97 -32.22 45.26 Favored 'General case' 0 N--CA 1.478 0.943 0 CA-C-O 116.058 -1.925 . . . . 0.0 114.518 175.404 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 17' ' ' GLU . . . . . . . . . . . . . 5.3 pt-20 -64.77 -43.97 91.53 Favored 'General case' 0 N--CA 1.484 1.26 0 CA-C-N 124.0 3.091 . . . . 0.0 113.305 163.209 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . 0.615 16.5 pttt -70.14 -33.25 71.57 Favored 'General case' 0 CA--C 1.565 1.551 0 N-CA-C 117.858 2.54 . . . . 0.0 117.858 173.712 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 19' ' ' LEU . . . . . . . . . . . . 0.367 0.7 OUTLIER -76.59 -40.27 50.01 Favored 'General case' 0 CA--C 1.567 1.617 0 CA-C-N 121.016 1.735 . . . . 0.0 114.021 166.689 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 20' ' ' LYS . . . . . . . . . . . . . 3.0 ttpt -79.71 -32.77 41.32 Favored 'General case' 0 CA--C 1.563 1.458 0 O-C-N 119.861 -1.774 . . . . 0.0 114.556 179.174 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 18.9 m-85 -60.78 -73.86 0.09 Allowed 'General case' 0 N--CA 1.491 1.619 1 CA-C-O 111.613 -4.042 . . . . 0.0 109.951 155.213 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . 0.276 17.9 ttt180 -22.81 -54.82 0.03 OUTLIER 'General case' 0 N--CA 1.506 2.334 1 CA-C-N 127.601 4.728 . . . . 0.0 117.066 170.655 . . . . . . . . 3 2 . 1 . 008 nuclear orig core ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -48.63 -79.8 0.01 OUTLIER 'General case' 0 CA--C 1.58 2.102 0 N-CA-C 118.489 2.774 . . . . 0.0 118.489 156.592 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 46.4 mm-40 -65.82 -34.22 77.65 Favored 'General case' 0 N--CA 1.498 1.93 0 N-CA-C 118.978 2.955 . . . . 0.0 118.978 -178.429 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 25' ' ' ALA . . . . . . . . . . . . . . . -41.96 -48.1 4.47 Favored 'General case' 0 CA--C 1.578 2.052 0 N-CA-C 117.536 2.421 . . . . 0.0 117.536 153.712 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 26' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -97.97 -44.52 6.63 Favored 'General case' 0 CA--C 1.576 1.951 0 N-CA-C 116.64 2.089 . . . . 0.0 116.64 -173.614 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 27' ' ' GLY . . . . . . . . . . . . . . . 122.62 13.7 4.58 Favored Glycine 0 N--CA 1.498 2.798 0 N-CA-C 119.05 2.38 . . . . 0.0 119.05 -159.584 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 28' ' ' ARG . . . . . . . . . . . . . 61.8 mtm-85 -109.54 154.72 22.31 Favored 'General case' 0 CA--C 1.575 1.924 0 N-CA-C 103.981 -2.6 . . . . 0.0 103.981 167.302 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 29' ' ' SER . . . . . . . . . . . . . 79.1 p -129.35 112.35 13.76 Favored 'General case' 0 N--CA 1.505 2.311 0 O-C-N 117.049 -3.532 . . . . 0.0 106.001 -169.737 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 30' ' ' MET . . . . . . . . . . . . . 24.1 mtp -47.15 -38.58 11.95 Favored 'General case' 0 N--CA 1.497 1.915 0 N-CA-C 118.772 2.878 . . . . 0.0 118.772 -135.198 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 31' ' ' ASN . . . . . . . . . . . . 0.26 0.1 OUTLIER -48.21 -43.27 31.85 Favored 'General case' 0 CA--C 1.598 2.816 0 O-C-N 116.906 -3.622 . . . . 0.0 115.315 164.425 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 32' ' ' SER . . . . . . . . . . . . 0.461 75.4 p -54.84 -63.5 1.13 Allowed 'General case' 0 N--CA 1.505 2.319 0 N-CA-C 118.755 2.872 . . . . 0.0 118.755 145.262 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 3.0 tm-20 -67.18 -50.15 62.11 Favored 'General case' 0 N--CA 1.511 2.624 0 N-CA-C 120.35 3.463 . . . . 0.0 120.35 -177.052 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -42.07 -54.69 3.48 Favored 'General case' 0 CA--C 1.554 1.126 0 CA-C-O 114.881 -2.485 . . . . 0.0 107.756 159.807 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 35' ' ' LEU . . . . . . . . . . . . . 12.2 mt -60.38 -40.11 89.71 Favored 'General case' 0 N--CA 1.492 1.633 0 CA-C-N 124.75 3.432 . . . . 0.0 116.766 176.028 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 36' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.22 -46.07 74.94 Favored 'General case' 0 N--CA 1.488 1.438 0 N-CA-C 115.017 1.488 . . . . 0.0 115.017 176.145 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 37' ' ' ILE . . . . . . . . . . . . . 5.3 tt -63.12 -30.2 49.11 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.408 0 CA-C-O 114.858 -2.496 . . . . 0.0 116.101 161.89 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 38' ' ' VAL . . . . . . . . . . . . . 2.2 t -83.63 -46.21 18.4 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.923 0 CA-C-N 121.893 2.133 . . . . 0.0 112.704 -172.301 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 33.5 mt-30 -57.28 -38.89 74.63 Favored 'General case' 0 CA--C 1.572 1.82 0 O-C-N 121.148 -0.97 . . . . 0.0 112.497 157.291 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 40' ' ' ASP . . . . . . . . . . . . 0.528 5.2 m-20 -52.93 -41.45 64.46 Favored 'General case' 0 CA--C 1.58 2.103 0 N-CA-C 119.264 3.061 . . . . 0.0 119.264 151.168 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -75.68 -20.62 58.3 Favored 'General case' 0 N--CA 1.493 1.715 0 N-CA-C 116.695 2.109 . . . . 0.0 116.695 -175.663 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 22.4 mt . . . . . 0 N--CA 1.488 1.464 0 C-N-CA 125.057 1.343 . . . . 0.0 113.673 170.743 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 26.3 p-10 . . . . . 0 CA--C 1.57 1.736 0 N-CA-C 113.715 1.006 . . . . 0.0 113.715 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 1.9 Cg_endo -109.55 173.51 0.07 OUTLIER 'Trans proline' 0 CA--C 1.556 1.619 0 C-N-CA 121.94 1.76 . . . . 0.0 112.964 -157.554 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . 0.268 1.8 p-80 -143.61 148.35 35.73 Favored 'General case' 0 N--CA 1.486 1.347 0 N-CA-C 118.173 2.657 . . . . 0.0 118.173 -144.581 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 25.5 p90 -131.71 166.18 22.08 Favored 'General case' 0 CA--C 1.561 1.393 0 CA-C-N 113.806 -1.543 . . . . 0.0 109.033 168.91 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 14.1 m120 -74.39 98.39 3.26 Favored 'General case' 0 CA--C 1.563 1.467 0 O-C-N 119.641 -1.912 . . . . 0.0 110.872 162.67 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 3.6 t80 -69.97 157.61 37.15 Favored 'General case' 0 CA--C 1.568 1.662 0 CA-C-O 124.26 1.981 . . . . 0.0 109.873 147.283 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 12.3 tpt180 169.27 87.34 0.0 OUTLIER 'General case' 0 N--CA 1.502 2.137 0 O-C-N 119.264 -2.147 . . . . 0.0 106.904 -124.283 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -136.79 121.7 12.79 Favored Pre-proline 0 CA--C 1.575 1.909 0 CA-C-O 117.248 -1.358 . . . . 0.0 112.886 -149.172 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 98.9 Cg_exo -43.26 150.91 0.35 Allowed 'Trans proline' 0 C--N 1.379 2.142 0 C-N-CA 123.875 3.05 . . . . 0.0 118.969 -179.904 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -50.94 -40.19 56.72 Favored 'General case' 0 N--CA 1.499 1.994 0 N-CA-C 117.983 2.586 . . . . 0.0 117.983 -165.805 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 9.6 pt-20 -63.37 -43.25 98.15 Favored 'General case' 0 CA--C 1.564 1.492 0 N-CA-C 116.287 1.958 . . . . 0.0 116.287 165.428 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 1.2 t -59.96 -48.91 86.0 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.064 0 CA-C-N 123.002 2.637 . . . . 0.0 112.637 172.457 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 3.4 ttt180 -69.7 -41.29 75.59 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-N 121.13 1.786 . . . . 0.0 115.797 174.111 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -60.91 -37.68 83.08 Favored 'General case' 0 CA--C 1.565 1.543 0 CA-C-N 123.289 2.768 . . . . 0.0 114.378 166.237 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 48.4 mtmt -62.47 -62.76 1.53 Allowed 'General case' 0 CA--C 1.564 1.488 0 CA-C-N 121.229 1.832 . . . . 0.0 114.481 166.7 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 12.5 tp -56.89 -36.19 69.84 Favored 'General case' 0 N--CA 1.491 1.578 0 N-CA-C 115.855 1.798 . . . . 0.0 115.855 176.319 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 12.1 ttpt -89.29 -27.85 20.28 Favored 'General case' 0 CA--C 1.568 1.656 0 C-N-CA 125.143 1.377 . . . . 0.0 114.046 179.081 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 13.2 m-30 -65.31 -70.67 0.22 Allowed 'General case' 0 N--CA 1.493 1.681 0 CA-C-O 115.103 -2.38 . . . . 0.0 110.926 156.887 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . 0.35 0.0 OUTLIER -23.55 -47.71 0.01 OUTLIER 'General case' 0 CA--C 1.6 2.869 0 CA-C-N 124.631 3.378 . . . . 0.0 115.102 163.794 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -57.94 -76.96 0.03 OUTLIER 'General case' 0 CA--C 1.587 2.377 0 N-CA-C 117.61 2.448 . . . . 0.0 117.61 156.726 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 . . . . . 0 N--CA 1.503 2.198 0 N-CA-C 118.948 2.944 . . . . 0.0 118.948 179.102 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 29.1 mtm-85 . . . . . 0 CA--C 1.569 1.689 0 N-CA-C 106.532 -1.655 . . . . 0.0 106.532 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 38.1 t -119.6 115.0 23.09 Favored 'General case' 0 N--CA 1.501 2.105 0 O-C-N 118.842 -2.411 . . . . 0.0 105.411 -177.681 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 22.7 mtp -43.72 -40.93 4.54 Favored 'General case' 0 N--CA 1.5 2.068 0 N-CA-C 119.109 3.003 . . . . 0.0 119.109 -146.175 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -46.17 -44.63 16.14 Favored 'General case' 0 CA--C 1.601 2.906 0 CA-C-N 125.683 3.856 . . . . 0.0 115.371 163.721 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . 0.356 28.7 t -49.07 -75.59 0.03 OUTLIER 'General case' 0 N--CA 1.503 2.191 0 N-CA-C 118.338 2.718 . . . . 0.0 118.338 143.608 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 10.4 tp10 -60.6 -55.01 38.45 Favored 'General case' 0 N--CA 1.516 2.87 0 CA-C-N 124.217 3.19 . . . . 0.0 116.191 -173.208 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -39.88 -53.9 2.23 Favored 'General case' 0 CA--C 1.55 0.972 0 CA-C-O 115.805 -2.045 . . . . 0.0 108.3 167.481 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 13.1 mt -61.1 -47.24 87.21 Favored 'General case' 0 N--CA 1.486 1.348 0 CA-C-N 123.263 2.756 . . . . 0.0 115.913 174.75 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.56 -44.71 93.21 Favored 'General case' 0 N--CA 1.479 0.989 0 CA-C-O 116.748 -1.596 . . . . 0.0 114.269 177.472 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 3.8 tt -69.94 -32.68 52.46 Favored 'Isoleucine or valine' 0 C--O 1.199 -1.598 0 CA-C-O 114.989 -2.434 . . . . 0.0 114.719 166.168 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 3.0 t -78.21 -48.36 23.09 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.179 0 CA-C-N 123.581 2.9 . . . . 0.0 112.156 -174.435 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 27.2 mt-30 -49.4 -46.15 47.03 Favored 'General case' 0 CA--C 1.563 1.462 0 C-N-CA 123.77 0.828 . . . . 0.0 112.153 154.507 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . 0.422 3.9 t0 -51.55 -41.65 61.25 Favored 'General case' 0 N--CA 1.488 1.439 0 N-CA-C 118.913 2.931 . . . . 0.0 118.913 158.444 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . 0.275 . . . . . . . 0 N--CA 1.479 0.978 0 N-CA-C 115.465 1.654 . . . . 0.0 115.465 -155.494 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 7.2 Cg_exo . . . . . 0 CA--C 1.552 1.379 0 CA-C-O 121.601 0.584 . . . . 0.0 113.183 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' B' B ' 6' ' ' HIS . . . . . . . . . . . . . 67.5 m80 -72.29 128.13 34.69 Favored 'General case' 0 CA--C 1.575 1.923 0 CA-C-N 114.852 -1.067 . . . . 0.0 111.784 173.008 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 7' ' ' PHE . . . . . . . . . . . . 0.252 2.5 p90 -131.92 149.47 52.43 Favored 'General case' 0 CA--C 1.565 1.529 0 O-C-N 119.882 -1.761 . . . . 0.0 111.036 147.877 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 8' ' ' ASN . . . . . . . . . . . . . 12.9 m120 -71.86 84.69 0.94 Allowed 'General case' 0 N--CA 1.491 1.606 0 O-C-N 120.521 -1.362 . . . . 0.0 112.234 176.727 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 9' ' ' PHE . . . . . 0.408 ' CD2' ' SD ' ' B' ' 11' ' ' MET . 9.0 t80 -81.23 149.75 28.9 Favored 'General case' 0 CA--C 1.561 1.374 0 CA-C-O 126.151 2.881 . . . . 0.0 111.306 171.033 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 10' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -172.6 112.5 0.26 Allowed 'General case' 0 C--N 1.307 -1.243 0 CA-C-N 111.5 -2.591 . . . . 0.0 105.54 -129.351 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 11' ' ' MET . . . . . 0.408 ' SD ' ' CD2' ' B' ' 9' ' ' PHE . 0.9 OUTLIER -133.71 117.91 14.31 Favored Pre-proline 0 CA--C 1.564 1.487 0 CA-C-O 117.375 -1.298 . . . . 0.0 110.032 -153.176 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 12' ' ' PRO . . . . . . . . . . . . . 76.1 Cg_exo -42.92 145.59 1.09 Allowed 'Trans proline' 0 C--N 1.374 1.869 0 C-N-CA 123.249 2.633 . . . . 0.0 116.1 163.886 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 13' ' ' MET . . . . . . . . . . . . . 3.5 tpt -51.56 -41.18 60.94 Favored 'General case' 0 N--CA 1.494 1.736 0 N-CA-C 118.551 2.797 . . . . 0.0 118.551 -154.632 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -63.39 -43.29 98.0 Favored 'General case' 0 CA--C 1.563 1.457 0 N-CA-C 116.722 2.119 . . . . 0.0 116.722 166.708 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -57.43 -47.25 85.22 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.39 0 CA-C-N 124.394 3.27 . . . . 0.0 112.951 172.576 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 1.9 ttt180 -75.13 -37.84 61.26 Favored 'General case' 0 N--CA 1.475 0.818 0 CA-C-O 116.6 -1.666 . . . . 0.0 115.236 176.381 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 17' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -61.74 -37.37 83.99 Favored 'General case' 0 CA--C 1.569 1.676 0 CA-C-N 123.12 2.691 . . . . 0.0 114.056 163.405 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . 0.269 43.2 mtmt -66.3 -49.93 65.36 Favored 'General case' 0 CA--C 1.563 1.461 0 CA-C-N 122.018 2.19 . . . . 0.0 115.112 170.416 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 19' ' ' LEU . . . . . . . . . . . . 0.27 11.8 tp -70.12 -39.22 75.59 Favored 'General case' 0 N--CA 1.487 1.391 0 C-N-CA 124.98 1.312 . . . . 0.0 114.526 176.374 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 20' ' ' LYS . . . . . . . . . . . . . 13.4 ttpt -84.92 -28.6 25.81 Favored 'General case' 0 CA--C 1.565 1.525 0 CA-C-O 117.423 -1.275 . . . . 0.0 114.271 177.597 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 18.5 m-30 -67.03 -70.72 0.23 Allowed 'General case' 0 N--CA 1.492 1.644 0 CA-C-O 113.093 -3.337 . . . . 0.0 109.945 160.337 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . 0.275 37.2 ttt85 -20.26 -53.78 0.02 OUTLIER 'General case' 0 CA--C 1.587 2.391 1 CA-C-N 126.284 4.129 . . . . 0.0 116.372 165.399 . . . . . . . . 3 2 . 1 . 009 nuclear orig core ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -54.32 -79.53 0.02 OUTLIER 'General case' 0 CA--C 1.588 2.438 0 N-CA-C 117.288 2.329 . . . . 0.0 117.288 159.023 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 66.7 mm-40 -71.49 -32.58 68.4 Favored 'General case' 0 CA--C 1.575 1.934 0 N-CA-C 119.361 3.097 . . . . 0.0 119.361 -176.41 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 25' ' ' ALA . . . . . . . . . . . . . . . -41.56 -49.99 4.05 Favored 'General case' 0 CA--C 1.58 2.1 0 N-CA-C 116.549 2.055 . . . . 0.0 116.549 153.131 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 26' ' ' ASN . . . . . . . . . . . . 0.264 0.0 OUTLIER -107.6 -42.27 4.81 Favored 'General case' 0 CA--C 1.576 1.972 0 N-CA-C 116.09 1.885 . . . . 0.0 116.09 -163.975 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 27' ' ' GLY . . . . . . . . . . . . . . . 134.27 12.24 1.46 Allowed Glycine 0 N--CA 1.498 2.824 0 N-CA-C 119.232 2.453 . . . . 0.0 119.232 -167.097 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 28' ' ' ARG . . . . . . . . . . . . . 72.4 mtm-85 -111.35 165.75 11.69 Favored 'General case' 0 CA--C 1.575 1.922 0 CA-C-N 120.39 2.095 . . . . 0.0 105.424 168.087 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 29' ' ' SER . . . . . . . . . . . . . 8.8 t -133.7 113.62 12.54 Favored 'General case' 0 N--CA 1.506 2.361 0 O-C-N 117.103 -3.498 . . . . 0.0 107.129 -177.247 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 30' ' ' MET . . . . . . . . . . . . . 25.6 mtp -44.8 -34.46 2.32 Favored 'General case' 0 N--CA 1.5 2.029 0 N-CA-C 121.338 3.829 . . . . 0.0 121.338 -139.533 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 31' ' ' ASN . . . . . . . . . . . . 0.26 8.8 t-20 -49.75 -49.64 47.42 Favored 'General case' 0 CA--C 1.591 2.543 0 O-C-N 118.572 -2.58 . . . . 0.0 113.882 161.318 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 32' ' ' SER . . . . . . . . . . . . 0.29 27.6 t -49.43 -64.26 0.86 Allowed 'General case' 0 N--CA 1.501 2.115 0 N-CA-C 119.649 3.203 . . . . 0.0 119.649 146.955 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -67.55 -60.47 2.53 Favored 'General case' 0 N--CA 1.516 2.863 0 CA-C-N 123.45 2.841 . . . . 0.0 116.156 -176.449 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . 0.543 0.1 OUTLIER -49.06 -37.06 19.83 Favored 'General case' 0 CA--C 1.563 1.48 0 CA-C-O 114.184 -2.817 . . . . 0.0 108.207 172.009 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 35' ' ' LEU . . . . . . . . . . . . . 13.9 mt -64.67 -56.73 11.92 Favored 'General case' 0 N--CA 1.491 1.613 1 CA-C-N 126.158 4.072 . . . . 0.0 115.725 167.559 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 36' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -50.64 -40.26 52.78 Favored 'General case' 0 CA--C 1.58 2.101 0 N-CA-C 115.784 1.772 . . . . 0.0 115.784 175.734 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 37' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -74.03 -35.62 42.28 Favored 'Isoleucine or valine' 0 CA--C 1.571 1.762 0 N-CA-C 116.164 1.913 . . . . 0.0 116.164 166.47 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 38' ' ' VAL . . . . . . . . . . . . . 3.3 t -72.5 -46.76 54.47 Favored 'Isoleucine or valine' 0 CA--C 1.575 1.941 0 O-C-N 119.041 -2.287 . . . . 0.0 110.796 177.699 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 23.7 mt-30 -51.38 -40.85 60.06 Favored 'General case' 0 CA--C 1.562 1.427 0 N-CA-C 114.539 1.311 . . . . 0.0 114.539 155.517 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 44.8 t0 -53.32 -47.71 69.07 Favored 'General case' 0 N--CA 1.492 1.634 0 N-CA-C 116.518 2.044 . . . . 0.0 116.518 156.102 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 41' ' ' ALA . . . . . . . . . . . . 0.263 . . -69.6 -26.86 64.65 Favored 'General case' 0 CA--C 1.564 1.514 0 N-CA-C 117.462 2.393 . . . . 0.0 117.462 -174.618 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.573 1.856 0 C-N-CA 124.687 1.195 . . . . 0.0 112.993 175.356 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 2.1 p30 . . . . . 0 CA--C 1.568 1.67 0 CA-C-O 118.652 -0.689 . . . . 0.0 112.1 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 3.7 Cg_exo -98.06 148.74 0.75 Allowed 'Trans proline' 0 CA--C 1.551 1.343 0 CA-C-N 122.363 1.88 . . . . 0.0 114.131 -155.246 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 80.8 m80 -84.9 130.42 34.65 Favored 'General case' 0 CA--C 1.566 1.577 0 CA-C-N 113.946 -1.479 . . . . 0.0 112.369 178.476 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 3.2 p90 -132.45 159.56 38.99 Favored 'General case' 0 CA--C 1.567 1.625 0 CA-C-O 122.704 1.24 . . . . 0.0 111.048 153.896 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 70.7 m-80 -66.18 101.73 0.75 Allowed 'General case' 0 CA--C 1.573 1.847 0 O-C-N 120.877 -1.14 . . . . 0.0 112.68 173.999 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 5.2 t80 -120.18 110.08 16.19 Favored 'General case' 0 CA--C 1.547 0.838 0 N-CA-C 106.372 -1.714 . . . . 0.0 106.372 157.839 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . 0.383 0.0 OUTLIER 98.66 89.05 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.633 1 O-C-N 113.897 -5.502 . . . . 0.0 110.098 -17.654 . . . . . . . . 4 3 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 1.6 mpt? -147.74 149.57 33.91 Favored Pre-proline 0 CA--C 1.567 1.632 0 CA-C-O 118.086 -0.959 . . . . 0.0 111.976 -170.237 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_exo -44.85 141.94 5.56 Favored 'Trans proline' 0 CA--C 1.567 2.155 0 C-N-CA 122.436 2.091 . . . . 0.0 115.989 154.783 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 13.7 tpp -56.07 -27.79 54.96 Favored 'General case' 0 N--CA 1.496 1.847 0 N-CA-C 118.934 2.939 . . . . 0.0 118.934 -169.811 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 7.6 pt-20 -65.93 -47.62 74.12 Favored 'General case' 0 CA--C 1.57 1.712 0 N-CA-C 115.957 1.836 . . . . 0.0 115.957 165.304 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -60.37 -49.07 85.72 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.216 0 CA-C-N 122.263 2.301 . . . . 0.0 112.513 174.402 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 5.8 ttt180 -69.8 -33.11 71.91 Favored 'General case' 0 CA--C 1.548 0.894 0 CA-C-O 116.047 -1.93 . . . . 0.0 115.562 173.8 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 37.1 mt-10 -60.19 -48.1 83.16 Favored 'General case' 0 N--CA 1.491 1.615 0 CA-C-N 123.941 3.064 . . . . 0.0 114.197 160.312 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 53.0 mtmt -61.89 -45.66 92.79 Favored 'General case' 0 CA--C 1.562 1.436 0 N-CA-C 116.134 1.902 . . . . 0.0 116.134 174.529 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . 0.258 14.0 tp -69.0 -40.55 78.65 Favored 'General case' 0 CA--C 1.565 1.544 0 N-CA-C 115.01 1.485 . . . . 0.0 115.01 172.195 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 16.1 ttpt -85.22 -26.2 26.87 Favored 'General case' 0 CA--C 1.567 1.603 0 N-CA-C 114.259 1.207 . . . . 0.0 114.259 179.757 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 13.1 m-85 -61.94 -69.31 0.26 Allowed 'General case' 0 N--CA 1.49 1.554 0 CA-C-O 114.05 -2.881 . . . . 0.0 110.722 155.224 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . 0.304 1.9 ttt85 -23.22 -49.21 0.02 OUTLIER 'General case' 0 CA--C 1.598 2.8 0 CA-C-N 125.363 3.711 . . . . 0.0 116.53 163.406 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . 0.268 . . -58.13 -77.43 0.03 OUTLIER 'General case' 0 CA--C 1.59 2.502 0 N-CA-C 117.301 2.334 . . . . 0.0 117.301 158.482 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 87.9 mt-10 . . . . . 0 N--CA 1.503 2.193 0 N-CA-C 118.774 2.879 . . . . 0.0 118.774 178.606 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 12.0 mtt85 . . . . . 0 CA--C 1.57 1.746 0 N-CA-C 106.03 -1.841 . . . . 0.0 106.03 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 41.3 t -119.71 115.14 23.32 Favored 'General case' 0 N--CA 1.503 2.184 0 O-C-N 118.377 -2.702 . . . . 0.0 105.096 -178.948 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 8.3 mtp -43.22 -36.71 1.86 Allowed 'General case' 0 N--CA 1.502 2.145 0 N-CA-C 121.405 3.854 . . . . 0.0 121.405 -148.282 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 11.5 t-20 -48.71 -46.36 40.63 Favored 'General case' 0 CA--C 1.592 2.586 0 O-C-N 118.572 -2.58 . . . . 0.0 114.457 162.0 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . 0.287 46.6 t -51.78 -66.41 0.39 Allowed 'General case' 0 N--CA 1.499 2.004 0 N-CA-C 119.908 3.299 . . . . 0.0 119.908 146.918 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 -64.49 -59.92 3.76 Favored 'General case' 0 N--CA 1.515 2.801 0 CA-C-N 123.895 3.043 . . . . 0.0 114.774 -176.042 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . 0.477 0.3 OUTLIER -51.17 -41.36 60.11 Favored 'General case' 0 CA--C 1.56 1.365 0 CA-C-O 113.55 -3.119 . . . . 0.0 106.692 174.912 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 12.9 mt -62.99 -55.36 26.39 Favored 'General case' 0 N--CA 1.495 1.813 1 CA-C-N 127.281 4.582 . . . . 0.0 115.403 169.59 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . 0.276 1.0 OUTLIER -55.75 -49.81 72.1 Favored 'General case' 0 CA--C 1.566 1.561 0 CA-C-O 116.25 -1.833 . . . . 0.0 113.764 179.559 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 1.6 tt -60.11 -39.48 80.59 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.843 0 CA-C-N 122.619 2.463 . . . . 0.0 115.124 165.421 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 2.4 t -70.1 -49.97 51.36 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.994 0 CA-C-N 123.418 2.826 . . . . 0.0 112.696 -178.015 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 24.8 mt-30 -43.46 -46.7 6.91 Favored 'General case' 0 N--CA 1.489 1.522 0 C-N-CA 124.781 1.233 . . . . 0.0 113.724 152.995 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . 0.372 28.7 m-20 -58.46 -42.59 87.78 Favored 'General case' 0 CA--C 1.558 1.285 0 N-CA-C 117.356 2.354 . . . . 0.0 117.356 163.928 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . 0.265 . . . . . . . 0 CA--C 1.553 1.095 0 N-CA-C 115.955 1.835 . . . . 0.0 115.955 -159.589 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 95.2 Cg_endo . . . . . 0 CA--C 1.567 2.169 0 CA-C-O 124.543 1.81 . . . . 0.0 116.128 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' B' B ' 6' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -154.15 148.1 25.59 Favored 'General case' 0 CA--C 1.548 0.873 0 CA-C-N 112.745 -2.025 . . . . 0.0 114.663 -153.175 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 7' ' ' PHE . . . . . . . . . . . . . 17.3 p90 -122.53 170.36 10.08 Favored 'General case' 0 CA--C 1.561 1.371 0 CA-C-O 122.978 1.371 . . . . 0.0 109.961 153.18 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 8' ' ' ASN . . . . . . . . . . . . . 20.7 m-80 -85.18 92.52 8.42 Favored 'General case' 0 N--CA 1.485 1.291 0 O-C-N 119.894 -1.754 . . . . 0.0 108.06 160.616 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 9' ' ' PHE . . . . . . . . . . . . . 16.0 t80 -69.55 159.04 34.09 Favored 'General case' 0 CA--C 1.561 1.39 0 CA-C-O 125.296 2.474 . . . . 0.0 110.809 162.002 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 10' ' ' ARG . . . . . . . . . . . . . 2.3 tmm_? -176.35 107.76 0.08 Allowed 'General case' 0 C--N 1.304 -1.386 0 N-CA-C 103.399 -2.815 . . . . 0.0 103.399 -122.643 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 11' ' ' MET . . . . . . . . . . . . . 13.4 mtm -134.43 119.59 14.28 Favored Pre-proline 0 N--CA 1.484 1.235 0 CA-C-O 117.218 -1.373 . . . . 0.0 112.216 -161.428 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 12' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_exo -40.61 141.11 0.9 Allowed 'Trans proline' 0 C--N 1.372 1.8 0 C-N-CA 122.962 2.442 . . . . 0.0 116.192 160.991 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 13' ' ' MET . . . . . . . . . . . . . 27.2 tpp -58.98 -26.13 64.21 Favored 'General case' 0 N--CA 1.495 1.822 0 N-CA-C 118.378 2.733 . . . . 0.0 118.378 -157.754 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 14' ' ' GLU . . . . . . . . . . . . 0.252 6.4 pt-20 -64.4 -49.14 72.74 Favored 'General case' 0 CA--C 1.572 1.803 0 N-CA-C 116.213 1.931 . . . . 0.0 116.213 161.477 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -58.22 -47.0 88.56 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.301 0 CA-C-N 122.568 2.44 . . . . 0.0 113.309 173.646 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 2.7 ttt180 -75.06 -32.57 61.54 Favored 'General case' 0 CA--C 1.543 0.684 0 CA-C-O 116.305 -1.807 . . . . 0.0 115.763 175.652 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 17' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -61.39 -44.83 96.47 Favored 'General case' 0 N--CA 1.492 1.647 0 CA-C-N 123.23 2.741 . . . . 0.0 113.242 159.916 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . 0.262 53.2 mtmt -58.74 -52.68 64.65 Favored 'General case' 0 CA--C 1.562 1.421 0 CA-C-N 121.173 1.806 . . . . 0.0 115.345 171.215 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 19' ' ' LEU . . . . . . . . . . . . 0.26 12.5 tp -71.12 -36.35 72.1 Favored 'General case' 0 CA--C 1.563 1.444 0 N-CA-C 115.442 1.645 . . . . 0.0 115.442 178.41 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 20' ' ' LYS . . . . . . . . . . . . . 18.3 ttpt -83.66 -20.81 32.92 Favored 'General case' 0 CA--C 1.584 2.262 0 N-CA-C 114.132 1.16 . . . . 0.0 114.132 172.756 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 9.4 m-30 -73.34 -65.88 0.76 Allowed 'General case' 0 N--CA 1.497 1.875 0 CA-C-N 122.547 2.43 . . . . 0.0 110.847 162.866 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . 0.311 0.2 OUTLIER -17.23 -52.57 0.01 OUTLIER 'General case' 0 CA--C 1.597 2.76 0 CA-C-N 124.79 3.45 . . . . 0.0 114.757 153.614 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -58.27 -77.06 0.03 OUTLIER 'General case' 0 CA--C 1.575 1.905 0 N-CA-C 118.272 2.693 . . . . 0.0 118.272 158.975 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 58.0 mm-40 -75.5 -33.65 60.79 Favored 'General case' 0 CA--C 1.576 1.98 0 N-CA-C 118.303 2.705 . . . . 0.0 118.303 -174.996 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 25' ' ' ALA . . . . . . . . . . . . . . . -45.61 -51.66 11.79 Favored 'General case' 0 CA--C 1.585 2.293 0 N-CA-C 116.009 1.855 . . . . 0.0 116.009 154.162 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 26' ' ' ASN . . . . . . . . . . . . . 90.8 m-20 -78.68 -53.02 7.59 Favored 'General case' 0 N--CA 1.499 1.989 0 N-CA-C 115.145 1.535 . . . . 0.0 115.145 174.867 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 27' ' ' GLY . . . . . . . . . . . . . . . 120.36 24.69 2.6 Favored Glycine 0 CA--C 1.562 2.99 0 N-CA-C 118.403 2.121 . . . . 0.0 118.403 -154.277 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 28' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -104.88 178.96 4.41 Favored 'General case' 0 CA--C 1.574 1.87 0 CA-C-N 120.211 2.005 . . . . 0.0 107.798 157.546 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 29' ' ' SER . . . . . . . . . . . . . 6.8 t -135.24 115.95 13.88 Favored 'General case' 0 N--CA 1.5 2.052 0 O-C-N 118.73 -2.481 . . . . 0.0 106.92 171.385 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 30' ' ' MET . . . . . . . . . . . . 0.355 2.7 ptm -48.84 -17.2 0.16 Allowed 'General case' 0 N--CA 1.506 2.341 1 N-CA-C 123.761 4.726 . . . . 0.0 123.761 -146.323 . . . . . . . . 3 2 . 1 . 010 nuclear orig core ' B' B ' 31' ' ' ASN . . . . . . . . . . . . . 15.6 t-20 -56.29 -52.85 62.98 Favored 'General case' 0 CA--C 1.587 2.37 0 O-C-N 117.513 -3.242 . . . . 0.0 113.452 151.498 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 32' ' ' SER . . . . . . . . . . . . 0.299 71.0 m -49.37 -64.74 0.72 Allowed 'General case' 0 N--CA 1.496 1.849 0 N-CA-C 118.09 2.626 . . . . 0.0 118.09 150.329 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . 0.27 4.9 tp10 -62.67 -60.15 3.91 Favored 'General case' 0 N--CA 1.513 2.676 0 CA-C-N 124.064 3.12 . . . . 0.0 114.449 -178.195 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . 0.63 0.1 OUTLIER -53.57 -36.11 61.54 Favored 'General case' 0 CA--C 1.562 1.409 0 CA-C-O 114.607 -2.616 . . . . 0.0 106.548 -177.855 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 35' ' ' LEU . . . . . . . . . . . . . 19.6 mt -66.16 -48.95 69.05 Favored 'General case' 0 C--N 1.37 1.484 0 CA-C-N 125.365 3.711 . . . . 0.0 115.926 167.361 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 36' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.14 -45.72 86.87 Favored 'General case' 0 N--CA 1.487 1.382 0 N-CA-C 114.671 1.36 . . . . 0.0 114.671 177.097 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 37' ' ' ILE . . . . . . . . . . . . . 3.0 tp -71.09 -28.46 33.06 Favored 'Isoleucine or valine' 0 CA--C 1.579 2.068 0 N-CA-C 116.851 2.167 . . . . 0.0 116.851 164.914 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 38' ' ' VAL . . . . . . . . . . . . . 2.8 t -83.75 -47.04 18.16 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.312 0 CA-C-N 124.265 3.211 . . . . 0.0 110.708 -177.923 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 26.1 mt-30 -54.53 -40.87 69.07 Favored 'General case' 0 CA--C 1.566 1.572 0 CA-C-O 118.093 -0.956 . . . . 0.0 112.268 158.038 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 40' ' ' ASP . . . . . . . . . . . . 0.315 24.9 t0 -46.75 -57.32 4.97 Favored 'General case' 0 N--CA 1.493 1.692 0 N-CA-C 115.881 1.808 . . . . 0.0 115.881 153.06 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 41' ' ' ALA . . . . . . . . . . . . 0.31 . . -78.83 -31.96 45.98 Favored 'General case' 0 N--CA 1.474 0.737 0 N-CA-C 119.12 3.007 . . . . 0.0 119.12 -155.18 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 2.1 pp . . . . . 0 CA--C 1.563 1.474 0 N-CA-C 117.261 2.319 . . . . 0.0 117.261 159.216 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . 0.3 2.5 p30 . . . . . 0 CA--C 1.567 1.614 0 N-CA-C 113.361 0.874 . . . . 0.0 113.361 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 47.8 Cg_endo -81.9 168.26 15.75 Favored 'Trans proline' 0 CA--C 1.567 2.159 0 C-N-CA 123.557 2.838 . . . . 0.0 115.983 176.492 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 65.0 m80 -108.75 144.93 35.91 Favored 'General case' 0 CA--C 1.567 1.607 0 CA-C-N 113.068 -1.878 . . . . 0.0 112.35 -165.438 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 20.2 p90 -138.46 150.08 46.1 Favored 'General case' 0 CA--C 1.564 1.51 0 O-C-N 120.062 -1.649 . . . . 0.0 111.397 142.63 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 11.7 m120 -71.98 83.48 0.96 Allowed 'General case' 0 N--CA 1.491 1.612 0 O-C-N 120.089 -1.632 . . . . 0.0 111.689 170.083 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 6.1 t80 -64.09 147.19 52.76 Favored 'General case' 0 CA--C 1.55 0.943 0 CA-C-O 125.313 2.482 . . . . 0.0 112.026 167.717 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 2.7 tmm_? -144.27 110.06 5.31 Favored 'General case' 0 C--N 1.304 -1.379 0 CA-C-N 111.166 -2.743 . . . . 0.0 104.974 -152.369 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 1.2 mpp? -116.12 116.2 40.11 Favored Pre-proline 0 CA--C 1.562 1.437 0 CA-C-O 117.64 -1.172 . . . . 0.0 111.764 -170.536 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_exo -41.55 140.35 1.74 Allowed 'Trans proline' 0 CA--C 1.559 1.768 0 C-N-CA 122.958 2.439 . . . . 0.0 115.575 156.411 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 25.0 tpp -57.85 -29.04 64.66 Favored 'General case' 0 N--CA 1.496 1.858 0 N-CA-C 118.173 2.657 . . . . 0.0 118.173 -158.87 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -57.43 -52.21 66.29 Favored 'General case' 0 CA--C 1.566 1.594 0 N-CA-C 117.696 2.48 . . . . 0.0 117.696 160.343 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -58.79 -49.45 82.82 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.249 0 CA-C-N 122.087 2.221 . . . . 0.0 112.507 172.207 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . 0.262 1.1 ttt180 -72.39 -37.54 68.7 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-O 115.405 -2.236 . . . . 0.0 115.191 176.959 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 41.8 mm-40 -62.42 -38.56 90.16 Favored 'General case' 0 CA--C 1.559 1.313 0 CA-C-N 124.485 3.311 . . . . 0.0 113.659 164.899 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . 0.576 26.5 pttt -74.72 -36.56 62.67 Favored 'General case' 0 CA--C 1.565 1.543 0 N-CA-C 117.777 2.51 . . . . 0.0 117.777 174.53 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . 0.253 11.2 tp -74.41 -34.91 63.38 Favored 'General case' 0 CA--C 1.574 1.891 0 N-CA-C 114.868 1.433 . . . . 0.0 114.868 167.978 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 2.2 ttpt -91.09 -31.27 16.32 Favored 'General case' 0 CA--C 1.57 1.715 0 O-C-N 120.124 -1.61 . . . . 0.0 113.631 179.908 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 22.7 m-85 -57.41 -68.58 0.22 Allowed 'General case' 0 N--CA 1.496 1.828 0 CA-C-O 113.649 -3.072 . . . . 0.0 110.416 153.977 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . 0.287 30.7 ttt85 -29.4 -43.38 0.03 OUTLIER 'General case' 0 CA--C 1.598 2.81 1 CA-C-N 126.017 4.008 . . . . 0.0 117.676 166.169 . . . . . . . . 3 2 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . 0.289 . . -60.05 -71.36 0.13 Allowed 'General case' 0 CA--C 1.589 2.476 0 O-C-N 118.484 -2.635 . . . . 0.0 116.93 159.508 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 . . . . . 0 N--CA 1.502 2.147 0 N-CA-C 118.477 2.769 . . . . 0.0 118.477 177.371 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 1.4 mpp_? . . . . . 0 CA--C 1.575 1.91 0 CA-C-O 122.597 1.189 . . . . 0.0 108.0 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 35.0 t -132.86 112.08 11.62 Favored 'General case' 0 N--CA 1.501 2.104 0 O-C-N 118.602 -2.561 . . . . 0.0 106.921 179.88 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 26.5 mtp -46.12 -31.78 2.56 Favored 'General case' 0 N--CA 1.501 2.105 0 N-CA-C 121.552 3.908 . . . . 0.0 121.552 -138.947 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . 0.275 5.6 t-20 -51.12 -50.91 57.92 Favored 'General case' 0 CA--C 1.59 2.486 0 O-C-N 118.506 -2.622 . . . . 0.0 114.11 160.51 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . 0.308 22.8 t -44.44 -68.08 0.23 Allowed 'General case' 0 N--CA 1.503 2.211 0 N-CA-C 117.055 2.243 . . . . 0.0 117.055 143.987 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 4.9 tm-20 -70.28 -54.79 11.19 Favored 'General case' 0 N--CA 1.505 2.293 0 N-CA-C 118.606 2.817 . . . . 0.0 118.606 -168.157 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . 0.589 0.0 OUTLIER -52.2 -34.03 43.55 Favored 'General case' 0 CA--C 1.574 1.87 0 CA-C-O 114.192 -2.813 . . . . 0.0 107.618 168.549 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 21.7 mt -65.7 -46.1 80.27 Favored 'General case' 0 N--CA 1.495 1.787 1 CA-C-N 126.835 4.379 . . . . 0.0 116.257 164.853 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -60.92 -45.1 96.03 Favored 'General case' 0 N--CA 1.488 1.455 0 N-CA-C 114.779 1.4 . . . . 0.0 114.779 178.606 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . 0.27 2.8 tt -60.56 -46.36 95.68 Favored 'Isoleucine or valine' 0 CA--C 1.566 1.573 0 CA-C-O 114.866 -2.492 . . . . 0.0 116.453 156.553 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 3.3 t -71.26 -44.75 72.89 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.215 0 CA-C-N 123.93 3.059 . . . . 0.0 111.676 -169.747 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 23.8 mt-30 -55.7 -45.61 77.83 Favored 'General case' 0 CA--C 1.565 1.551 0 C-N-CA 124.423 1.089 . . . . 0.0 112.776 158.503 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . 0.475 0.9 OUTLIER -49.52 -34.84 18.29 Favored 'General case' 0 N--CA 1.5 2.055 0 N-CA-C 118.648 2.832 . . . . 0.0 118.648 156.74 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.545 0.771 0 C-N-CA 123.914 0.886 . . . . 0.0 111.113 -166.509 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo . . . . . 0 CA--C 1.549 1.23 0 N-CA-C 113.991 0.727 . . . . 0.0 113.991 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' B' B ' 6' ' ' HIS . . . . . . . . . . . . . 75.0 m80 -82.04 115.24 21.09 Favored 'General case' 0 CA--C 1.567 1.601 0 CA-C-N 114.137 -1.392 . . . . 0.0 111.109 170.833 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 7' ' ' PHE . . . . . . . . . . . . . 1.1 p90 -118.51 150.23 39.97 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 120.856 -1.153 . . . . 0.0 109.855 159.959 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 8' ' ' ASN . . . . . . . . . . . . . 18.2 m120 -68.94 91.02 0.45 Allowed 'General case' 0 N--CA 1.489 1.492 0 O-C-N 120.472 -1.392 . . . . 0.0 112.512 171.077 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 9' ' ' PHE . . . . . . . . . . . . . 4.4 t80 -77.8 146.42 35.8 Favored 'General case' 0 CA--C 1.564 1.486 0 CA-C-O 125.836 2.732 . . . . 0.0 109.592 153.725 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 177.78 102.75 0.02 OUTLIER 'General case' 0 N--CA 1.487 1.381 0 CA-C-N 112.59 -2.095 . . . . 0.0 106.699 -130.363 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 11' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -132.73 136.53 27.96 Favored Pre-proline 0 N--CA 1.491 1.623 0 CA-C-O 117.549 -1.215 . . . . 0.0 113.677 -154.486 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 12' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -59.19 154.25 47.34 Favored 'Trans proline' 0 CA--C 1.565 2.041 0 CA-C-N 122.692 1.997 . . . . 0.0 114.087 168.517 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 13' ' ' MET . . . . . . . . . . . . . 4.7 tpp -61.77 -37.45 84.35 Favored 'General case' 0 N--CA 1.487 1.422 0 N-CA-C 118.365 2.728 . . . . 0.0 118.365 -146.66 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 -61.81 -40.92 96.93 Favored 'General case' 0 CA--C 1.566 1.566 0 N-CA-C 116.428 2.01 . . . . 0.0 116.428 167.139 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -63.09 -49.43 83.4 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.08 0 CA-C-N 123.293 2.769 . . . . 0.0 111.921 171.788 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 16' ' ' ARG . . . . . . . . . . . . 0.296 6.0 ttt180 -70.45 -37.05 74.28 Favored 'General case' 0 N--CA 1.477 0.908 0 CA-C-N 121.729 2.059 . . . . 0.0 115.997 175.341 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 17' ' ' GLU . . . . . . . . . . . . . 37.6 mt-10 -63.03 -39.44 94.74 Favored 'General case' 0 N--CA 1.491 1.609 0 CA-C-N 123.548 2.886 . . . . 0.0 114.234 163.473 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . 0.257 53.6 mtmt -65.0 -49.09 71.61 Favored 'General case' 0 CA--C 1.563 1.452 0 CA-C-N 121.921 2.146 . . . . 0.0 115.344 170.352 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 19' ' ' LEU . . . . . . . . . . . . 0.263 11.9 tp -65.75 -39.69 91.33 Favored 'General case' 0 CA--C 1.568 1.668 0 CA-C-N 120.759 1.618 . . . . 0.0 114.336 173.791 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 20' ' ' LYS . . . . . . . . . . . . . 12.1 ttpt -84.84 -31.31 23.88 Favored 'General case' 0 CA--C 1.557 1.238 0 C-N-CA 125.244 1.418 . . . . 0.0 114.36 179.621 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 20.0 m-85 -60.91 -74.1 0.08 Allowed 'General case' 0 N--CA 1.49 1.531 0 CA-C-O 112.282 -3.723 . . . . 0.0 110.583 154.711 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . 0.292 8.7 ttt180 -16.84 -57.96 0.01 OUTLIER 'General case' 0 CA--C 1.586 2.347 1 CA-C-N 126.487 4.221 . . . . 0.0 116.699 168.866 . . . . . . . . 3 2 . 1 . 011 nuclear orig core ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -53.41 -72.31 0.06 Allowed 'General case' 0 CA--C 1.583 2.242 1 N-CA-C 122.153 4.131 . . . . 0.0 122.153 156.896 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 49.3 mt-10 -66.92 -38.71 86.72 Favored 'General case' 0 N--CA 1.505 2.305 0 N-CA-C 118.138 2.644 . . . . 0.0 118.138 177.144 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 25' ' ' ALA . . . . . . . . . . . . . . . -38.5 -48.47 1.4 Allowed 'General case' 0 CA--C 1.585 2.325 0 N-CA-C 116.493 2.034 . . . . 0.0 116.493 155.883 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 26' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -101.27 -48.01 4.52 Favored 'General case' 0 CA--C 1.578 2.031 0 N-CA-C 116.626 2.084 . . . . 0.0 116.626 -173.748 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 27' ' ' GLY . . . . . . . . . . . . . . . 117.95 39.41 0.76 Allowed Glycine 0 CA--C 1.558 2.754 0 N-CA-C 117.774 1.87 . . . . 0.0 117.774 -157.75 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 28' ' ' ARG . . . . . . . . . . . . . 3.1 mtt85 -138.14 97.97 3.52 Favored 'General case' 0 N--CA 1.492 1.663 0 CA-C-N 119.936 1.868 . . . . 0.0 106.078 174.852 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 29' ' ' SER . . . . . . . . . . . . . 32.2 t -75.82 127.88 33.96 Favored 'General case' 0 N--CA 1.504 2.26 0 O-C-N 117.758 -3.089 . . . . 0.0 107.92 -162.301 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 30' ' ' MET . . . . . . . . . . . . . 25.4 mtp -44.93 -42.7 8.35 Favored 'General case' 0 N--CA 1.503 2.198 0 N-CA-C 118.663 2.838 . . . . 0.0 118.663 -144.973 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 31' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -46.26 -40.7 11.93 Favored 'General case' 0 CA--C 1.595 2.688 0 CA-C-N 125.245 3.657 . . . . 0.0 115.788 165.899 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 32' ' ' SER . . . . . . . . . . . . 0.28 40.4 t -56.4 -66.36 0.45 Allowed 'General case' 0 N--CA 1.498 1.963 0 N-CA-C 119.361 3.097 . . . . 0.0 119.361 148.133 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 8.1 tp10 -66.22 -56.27 12.12 Favored 'General case' 0 N--CA 1.515 2.807 0 CA-C-N 124.007 3.094 . . . . 0.0 114.739 -177.857 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -37.64 -52.61 1.23 Allowed 'General case' 0 CA--C 1.546 0.81 0 CA-C-O 115.614 -2.136 . . . . 0.0 109.379 165.935 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 35' ' ' LEU . . . . . . . . . . . . . 9.5 mt -62.37 -53.13 59.42 Favored 'General case' 0 N--CA 1.485 1.321 0 CA-C-N 123.984 3.084 . . . . 0.0 115.306 175.148 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 36' ' ' GLN . . . . . . . . . . . . 0.271 0.5 OUTLIER -63.89 -33.12 74.99 Favored 'General case' 0 CA--C 1.58 2.109 0 N-CA-C 115.963 1.838 . . . . 0.0 115.963 179.644 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 37' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -71.71 -31.05 40.41 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.703 0 CA-C-N 121.058 1.754 . . . . 0.0 115.183 160.905 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 38' ' ' VAL . . . . . . . . . . . . . 2.4 t -80.15 -49.02 19.58 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.262 0 CA-C-N 122.682 2.492 . . . . 0.0 112.328 -179.033 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 32.4 mt-30 -47.01 -41.41 16.39 Favored 'General case' 0 CA--C 1.563 1.448 0 CA-C-O 116.72 -1.61 . . . . 0.0 113.856 149.447 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 40' ' ' ASP . . . . . . . . . . . . 0.447 8.1 t70 -51.32 -55.07 20.33 Favored 'General case' 0 N--CA 1.497 1.899 0 CA-C-N 121.766 2.075 . . . . 0.0 115.936 155.212 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -73.63 -33.31 64.49 Favored 'General case' 0 CA--C 1.552 1.023 0 N-CA-C 116.431 2.012 . . . . 0.0 116.431 -153.467 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.488 1.444 0 N-CA-C 118.691 2.849 . . . . 0.0 118.691 156.273 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 12.1 p-10 . . . . . 0 CA--C 1.57 1.714 0 CA-C-O 118.761 -0.638 . . . . 0.0 110.485 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_exo -98.21 145.95 0.64 Allowed 'Trans proline' 0 C--N 1.364 1.39 0 CA-C-N 123.059 2.128 . . . . 0.0 114.537 -153.793 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 81.0 m80 -75.46 132.85 41.1 Favored 'General case' 0 CA--C 1.563 1.475 0 CA-C-N 113.999 -1.455 . . . . 0.0 112.603 174.569 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 5.1 p90 -133.28 154.21 50.89 Favored 'General case' 0 CA--C 1.563 1.444 0 O-C-N 120.815 -1.178 . . . . 0.0 110.412 146.843 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 4.2 p-10 -59.77 86.44 0.01 OUTLIER 'General case' 0 CA--C 1.566 1.568 0 N-CA-C 115.744 1.757 . . . . 0.0 115.744 168.193 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . 0.26 2.6 t80 -82.26 141.51 32.88 Favored 'General case' 0 CA--C 1.564 1.511 0 CA-C-O 126.375 2.988 . . . . 0.0 110.273 162.019 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 23.2 ttt85 -166.56 121.43 1.13 Allowed 'General case' 0 C--N 1.309 -1.174 0 CA-C-N 111.466 -2.607 . . . . 0.0 107.911 -146.482 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 2.3 mpt? -133.63 119.49 15.09 Favored Pre-proline 0 CA--C 1.56 1.336 0 CA-C-O 117.73 -1.129 . . . . 0.0 111.314 -148.498 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_exo -46.59 146.27 5.47 Favored 'Trans proline' 0 CA--C 1.561 1.841 0 C-N-CA 122.68 2.253 . . . . 0.0 114.931 161.61 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.4 tpp -64.83 -27.99 69.25 Favored 'General case' 0 CA--C 1.568 1.672 0 N-CA-C 118.386 2.736 . . . . 0.0 118.386 -151.188 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . 0.25 8.2 pt-20 -64.63 -43.71 92.83 Favored 'General case' 0 CA--C 1.566 1.593 0 N-CA-C 116.654 2.094 . . . . 0.0 116.654 160.609 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -59.7 -48.2 88.38 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.275 0 CA-C-N 123.269 2.759 . . . . 0.0 112.603 173.231 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 2.0 ttt180 -71.36 -40.28 70.76 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-O 116.265 -1.826 . . . . 0.0 115.611 174.486 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -60.85 -38.71 86.45 Favored 'General case' 0 CA--C 1.567 1.62 0 CA-C-N 123.349 2.795 . . . . 0.0 114.007 166.036 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 52.2 mtmt -66.9 -51.1 59.46 Favored 'General case' 0 CA--C 1.562 1.42 0 CA-C-N 121.362 1.892 . . . . 0.0 115.363 170.791 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . 0.281 14.1 tp -65.44 -39.76 92.46 Favored 'General case' 0 CA--C 1.566 1.564 0 N-CA-C 115.542 1.682 . . . . 0.0 115.542 173.863 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 18.9 ttpt -88.2 -25.97 22.63 Favored 'General case' 0 CA--C 1.567 1.629 0 C-N-CA 124.923 1.289 . . . . 0.0 113.922 -179.754 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 19.5 m-30 -67.47 -66.72 0.53 Allowed 'General case' 0 N--CA 1.493 1.693 0 CA-C-O 113.929 -2.938 . . . . 0.0 110.812 158.545 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . 0.336 1.6 tmt_? -27.04 -45.99 0.03 OUTLIER 'General case' 0 CA--C 1.602 2.944 0 CA-C-N 125.699 3.863 . . . . 0.0 114.614 164.528 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -59.73 -74.87 0.06 Allowed 'General case' 0 CA--C 1.585 2.29 0 N-CA-C 117.298 2.333 . . . . 0.0 117.298 159.314 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 . . . . . 0 N--CA 1.502 2.141 0 N-CA-C 118.72 2.859 . . . . 0.0 118.72 -179.023 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 24.5 mtm-85 . . . . . 0 N--CA 1.491 1.594 0 N-CA-C 107.161 -1.422 . . . . 0.0 107.161 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 43.1 t -114.6 113.73 24.77 Favored 'General case' 0 N--CA 1.496 1.845 0 N-CA-C 104.35 -2.463 . . . . 0.0 104.35 -178.082 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 6.2 mtp -38.03 -40.32 0.47 Allowed 'General case' 0 N--CA 1.501 2.084 0 N-CA-C 121.01 3.708 . . . . 0.0 121.01 -152.111 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . 0.253 0.1 OUTLIER -47.87 -46.79 31.71 Favored 'General case' 0 CA--C 1.592 2.56 0 O-C-N 118.575 -2.578 . . . . 0.0 115.446 163.93 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . 0.354 38.4 t -47.4 -76.14 0.02 OUTLIER 'General case' 0 N--CA 1.5 2.064 0 N-CA-C 118.151 2.649 . . . . 0.0 118.151 142.444 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -62.87 -56.76 14.42 Favored 'General case' 0 N--CA 1.507 2.39 0 CA-C-N 123.185 2.72 . . . . 0.0 117.261 -170.057 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . 0.458 0.4 OUTLIER -47.04 -42.01 17.74 Favored 'General case' 0 CA--C 1.563 1.445 0 CA-C-O 113.274 -3.251 . . . . 0.0 107.313 168.863 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 12.8 mt -61.09 -48.09 83.32 Favored 'General case' 0 N--CA 1.499 1.996 1 CA-C-N 127.11 4.504 . . . . 0.0 116.529 166.201 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.28 -43.32 99.07 Favored 'General case' 0 N--CA 1.487 1.41 0 N-CA-C 115.544 1.683 . . . . 0.0 115.544 -179.145 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 5.4 tt -67.57 -35.44 73.09 Favored 'Isoleucine or valine' 0 C--O 1.199 -1.597 0 CA-C-O 114.29 -2.767 . . . . 0.0 115.781 160.508 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 2.1 t -75.04 -47.67 35.51 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.143 0 CA-C-N 124.398 3.272 . . . . 0.0 112.619 -174.527 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 32.9 mt-30 -50.52 -46.71 57.41 Favored 'General case' 0 N--CA 1.486 1.341 0 N-CA-C 113.116 0.784 . . . . 0.0 113.116 156.026 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . 0.807 0.0 OUTLIER -55.83 -34.24 65.2 Favored 'General case' 0 CA--C 1.576 1.972 0 N-CA-C 119.555 3.169 . . . . 0.0 119.555 159.971 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.105 0 N-CA-C 115.142 1.534 . . . . 0.0 115.142 -166.307 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 62.7 Cg_endo . . . . . 0 CA--C 1.566 2.107 0 N-CA-C 116.127 1.549 . . . . 0.0 116.127 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' B' B ' 6' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -153.68 159.95 42.2 Favored 'General case' 0 CA--C 1.552 1.028 0 CA-C-N 113.797 -1.547 . . . . 0.0 114.88 -149.802 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 7' ' ' PHE . . . . . . . . . . . . . 36.9 p90 -142.29 156.58 45.28 Favored 'General case' 0 CA--C 1.56 1.328 0 CA-C-O 122.499 1.142 . . . . 0.0 109.145 161.01 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 8' ' ' ASN . . . . . . . . . . . . . 91.6 m-20 -76.0 87.27 2.93 Favored 'General case' 0 CA--C 1.566 1.581 0 O-C-N 119.922 -1.736 . . . . 0.0 110.716 172.128 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 9' ' ' PHE . . . . . . . . . . . . . 4.8 t80 -62.7 142.3 58.18 Favored 'General case' 0 CA--C 1.56 1.35 0 CA-C-O 125.323 2.487 . . . . 0.0 111.245 171.001 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -148.05 96.78 2.69 Favored 'General case' 0 N--CA 1.486 1.358 0 CA-C-N 111.657 -2.52 . . . . 0.0 107.986 -147.015 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 11' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -114.23 118.26 42.26 Favored Pre-proline 0 CA--C 1.567 1.607 0 CA-C-O 117.135 -1.412 . . . . 0.0 112.012 -156.053 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 12' ' ' PRO . . . . . . . . . . . . . 80.3 Cg_exo -42.57 140.57 2.67 Favored 'Trans proline' 0 C--N 1.373 1.848 0 C-N-CA 123.389 2.726 . . . . 0.0 116.252 164.544 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 13' ' ' MET . . . . . . . . . . . . . 25.9 tpp -58.71 -26.53 64.0 Favored 'General case' 0 N--CA 1.498 1.931 0 N-CA-C 119.003 2.964 . . . . 0.0 119.003 -157.818 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 14' ' ' GLU . . . . . . . . . . . . 0.297 7.0 pt-20 -61.28 -50.96 70.92 Favored 'General case' 0 CA--C 1.566 1.588 0 N-CA-C 115.905 1.817 . . . . 0.0 115.905 160.161 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -58.8 -52.88 54.87 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.794 0 CA-C-N 122.092 2.224 . . . . 0.0 112.109 174.013 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 16' ' ' ARG . . . . . . . . . . . . 0.261 1.8 ttt180 -69.01 -33.21 73.27 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-N 122.255 2.298 . . . . 0.0 115.857 177.889 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 17' ' ' GLU . . . . . . . . . . . . . 5.4 pt-20 -65.3 -44.73 86.98 Favored 'General case' 0 N--CA 1.487 1.385 0 CA-C-N 123.326 2.784 . . . . 0.0 113.948 164.988 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . 0.296 52.5 mtmt -53.12 -55.86 20.8 Favored 'General case' 0 N--CA 1.487 1.412 0 N-CA-C 115.765 1.765 . . . . 0.0 115.765 166.006 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 19' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -71.87 -32.91 67.94 Favored 'General case' 0 CA--C 1.566 1.558 0 N-CA-C 116.321 1.971 . . . . 0.0 116.321 -179.984 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 20' ' ' LYS . . . . . . . . . . . . . 7.6 ttpt -87.29 -21.62 25.65 Favored 'General case' 0 CA--C 1.57 1.72 0 C-N-CA 124.78 1.232 . . . . 0.0 113.78 173.413 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 10.5 m-85 -66.25 -66.7 0.52 Allowed 'General case' 0 N--CA 1.49 1.53 0 CA-C-N 122.132 2.242 . . . . 0.0 110.635 155.195 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . 0.274 1.8 tpt180 -21.48 -53.27 0.02 OUTLIER 'General case' 0 CA--C 1.596 2.742 0 CA-C-N 124.459 3.299 . . . . 0.0 115.259 160.052 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 23' ' ' ALA . . . . . . . . . . . . 0.318 . . -54.18 -77.0 0.03 OUTLIER 'General case' 0 CA--C 1.577 2.0 0 N-CA-C 120.546 3.536 . . . . 0.0 120.546 154.066 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 50.6 mm-40 -74.19 -34.38 63.73 Favored 'General case' 0 CA--C 1.576 1.968 0 N-CA-C 118.766 2.876 . . . . 0.0 118.766 -175.836 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 25' ' ' ALA . . . . . . . . . . . . . . . -46.2 -52.41 12.45 Favored 'General case' 0 CA--C 1.579 2.083 0 N-CA-C 116.015 1.857 . . . . 0.0 116.015 154.562 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 26' ' ' ASN . . . . . . . . . . . . . 72.0 m-20 -82.5 -56.8 3.66 Favored 'General case' 0 CA--C 1.575 1.935 0 N-CA-C 114.536 1.31 . . . . 0.0 114.536 179.236 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 27' ' ' GLY . . . . . . . . . . . . . . . 128.17 28.28 0.86 Allowed Glycine 0 CA--C 1.561 2.952 0 N-CA-C 119.037 2.375 . . . . 0.0 119.037 -166.703 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 28' ' ' ARG . . . . . . . . . . . . 0.254 8.3 mtm-85 -118.13 166.13 12.94 Favored 'General case' 0 N--CA 1.497 1.92 0 N-CA-C 105.682 -1.97 . . . . 0.0 105.682 159.929 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 29' ' ' SER . . . . . . . . . . . . . 87.4 p -115.85 113.24 23.09 Favored 'General case' 0 N--CA 1.498 1.935 0 O-C-N 118.836 -2.415 . . . . 0.0 105.244 -173.098 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 30' ' ' MET . . . . . . . . . . . . . 13.3 mtp -36.76 -39.5 0.22 Allowed 'General case' 0 N--CA 1.502 2.174 0 N-CA-C 121.397 3.851 . . . . 0.0 121.397 -147.87 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 31' ' ' ASN . . . . . . . . . . . . 0.3 0.5 OUTLIER -48.56 -50.47 32.06 Favored 'General case' 0 CA--C 1.587 2.368 0 O-C-N 118.857 -2.402 . . . . 0.0 114.662 162.945 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 32' ' ' SER . . . . . . . . . . . . 0.361 35.4 t -47.6 -69.95 0.11 Allowed 'General case' 0 N--CA 1.497 1.923 0 N-CA-C 118.392 2.738 . . . . 0.0 118.392 144.449 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 6.6 tm-20 -76.15 -50.06 15.61 Favored 'General case' 0 N--CA 1.51 2.569 0 CA-C-N 123.978 3.081 . . . . 0.0 119.022 -169.496 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . 0.47 0.3 OUTLIER -47.06 -39.12 12.34 Favored 'General case' 0 CA--C 1.579 2.09 0 CA-C-O 113.679 -3.057 . . . . 0.0 107.226 161.82 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 35' ' ' LEU . . . . . . . . . . . . . 16.1 mt -65.19 -53.15 49.19 Favored 'General case' 0 N--CA 1.499 1.975 1 CA-C-N 127.692 4.769 . . . . 0.0 114.795 166.341 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 36' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -60.96 -33.79 73.76 Favored 'General case' 0 N--CA 1.493 1.688 0 N-CA-C 115.911 1.819 . . . . 0.0 115.911 -178.034 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 37' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -72.35 -42.2 65.25 Favored 'Isoleucine or valine' 0 C--O 1.2 -1.516 0 CA-C-O 115.115 -2.374 . . . . 0.0 115.383 159.409 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 38' ' ' VAL . . . . . . . . . . . . . 3.0 t -71.79 -48.71 49.9 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.408 0 CA-C-N 124.532 3.333 . . . . 0.0 113.111 -177.18 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 24.3 mt-30 -47.72 -51.1 23.27 Favored 'General case' 0 N--CA 1.476 0.856 0 CA-C-O 115.518 -2.182 . . . . 0.0 111.336 155.216 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 40' ' ' ASP . . . . . . . . . . . . 0.69 0.0 OUTLIER -44.1 -51.99 7.55 Favored 'General case' 0 N--CA 1.493 1.71 0 N-CA-C 117.274 2.324 . . . . 0.0 117.274 161.873 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 41' ' ' ALA . . . . . . . . . . . . 0.305 . . -80.18 -27.68 38.87 Favored 'General case' 0 CA--C 1.562 1.426 0 N-CA-C 116.507 2.04 . . . . 0.0 116.507 -159.812 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 1.1 pp . . . . . 0 N--CA 1.489 1.523 0 N-CA-C 118.217 2.673 . . . . 0.0 118.217 158.112 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 47.8 t0 . . . . . 0 CA--C 1.571 1.757 0 N-CA-C 108.549 -0.908 . . . . 0.0 108.549 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 2.8 Cg_endo -106.07 149.68 0.12 Allowed 'Trans proline' 0 C--N 1.371 1.722 0 C-N-CA 122.461 2.107 . . . . 0.0 114.643 -164.723 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 74.5 m80 -89.89 138.52 31.42 Favored 'General case' 0 N--CA 1.489 1.485 0 N-CA-C 113.605 0.965 . . . . 0.0 113.605 -178.744 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 15.8 p90 -128.26 157.35 41.15 Favored 'General case' 0 CA--C 1.566 1.583 0 O-C-N 120.193 -1.567 . . . . 0.0 110.726 144.654 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 85.5 m-20 -71.4 88.02 0.88 Allowed 'General case' 0 N--CA 1.491 1.598 0 O-C-N 119.938 -1.726 . . . . 0.0 111.666 169.956 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 2.2 t80 -66.45 151.33 47.42 Favored 'General case' 0 CA--C 1.556 1.185 0 CA-C-O 125.319 2.485 . . . . 0.0 111.014 157.728 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -166.97 99.87 0.54 Allowed 'General case' 0 N--CA 1.488 1.428 0 CA-C-N 111.666 -2.516 . . . . 0.0 108.074 -142.545 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 1.3 mpt? -125.43 117.4 25.0 Favored Pre-proline 0 CA--C 1.561 1.392 0 CA-C-O 116.727 -1.606 . . . . 0.0 112.831 -151.213 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 82.7 Cg_exo -42.66 145.98 0.9 Allowed 'Trans proline' 0 CA--C 1.561 1.869 0 C-N-CA 123.062 2.508 . . . . 0.0 116.679 166.13 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -52.61 -38.45 60.2 Favored 'General case' 0 N--CA 1.498 1.932 0 N-CA-C 117.43 2.382 . . . . 0.0 117.43 -160.713 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . 0.26 9.9 pt-20 -64.59 -42.54 95.52 Favored 'General case' 0 CA--C 1.563 1.476 0 N-CA-C 116.719 2.118 . . . . 0.0 116.719 167.239 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -60.55 -50.31 80.89 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.191 0 CA-C-N 123.977 3.08 . . . . 0.0 113.005 173.795 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 1.2 ttt180 -68.65 -40.95 80.01 Favored 'General case' 0 C--O 1.215 -0.722 0 CA-C-O 115.983 -1.961 . . . . 0.0 115.467 173.191 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -58.5 -41.41 85.3 Favored 'General case' 0 CA--C 1.565 1.521 0 CA-C-N 123.858 3.026 . . . . 0.0 114.427 164.033 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . 0.277 48.8 mtmt -63.07 -54.67 34.4 Favored 'General case' 0 CA--C 1.562 1.418 0 CA-C-N 121.337 1.88 . . . . 0.0 115.046 169.94 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 9.0 mt -62.53 -38.16 88.88 Favored 'General case' 0 CA--C 1.57 1.747 0 N-CA-C 116.532 2.049 . . . . 0.0 116.532 172.832 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 14.3 ttpt -89.32 -24.94 21.88 Favored 'General case' 0 CA--C 1.57 1.718 0 C-N-CA 125.202 1.401 . . . . 0.0 113.19 -177.733 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 13.3 m-30 -65.23 -65.29 0.69 Allowed 'General case' 0 N--CA 1.49 1.571 0 CA-C-O 115.374 -2.25 . . . . 0.0 111.051 154.363 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . 0.273 7.3 ttm180 -20.71 -54.59 0.02 OUTLIER 'General case' 0 CA--C 1.587 2.401 0 CA-C-N 124.416 3.28 . . . . 0.0 115.922 158.146 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . 0.287 . . -57.87 -74.33 0.06 Allowed 'General case' 0 CA--C 1.585 2.319 0 N-CA-C 118.512 2.782 . . . . 0.0 118.512 158.919 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 15.6 mm-40 . . . . . 0 N--CA 1.499 1.976 0 N-CA-C 118.814 2.894 . . . . 0.0 118.814 -175.621 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . 0.305 2.7 mtm-85 . . . . . 0 CA--C 1.576 1.958 0 N-CA-C 105.541 -2.022 . . . . 0.0 105.541 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 28.4 t -126.69 112.7 15.75 Favored 'General case' 0 N--CA 1.506 2.346 0 O-C-N 117.359 -3.338 . . . . 0.0 106.59 -173.793 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 14.2 mtp -38.2 -39.03 0.38 Allowed 'General case' 0 N--CA 1.501 2.096 1 N-CA-C 121.854 4.02 . . . . 0.0 121.854 -144.676 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 11.6 t-20 -47.15 -53.38 13.14 Favored 'General case' 0 CA--C 1.588 2.413 0 O-C-N 118.713 -2.492 . . . . 0.0 114.186 159.985 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . 0.308 30.2 t -49.17 -61.43 2.08 Favored 'General case' 0 N--CA 1.501 2.076 0 N-CA-C 120.219 3.415 . . . . 0.0 120.219 148.41 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -84.14 -47.83 10.48 Favored 'General case' 0 N--CA 1.517 2.918 0 CA-C-N 124.0 3.091 . . . . 0.0 117.829 -174.036 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . 0.489 0.3 OUTLIER -50.12 -39.27 42.49 Favored 'General case' 0 CA--C 1.584 2.288 0 CA-C-O 113.744 -3.027 . . . . 0.0 106.326 163.0 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 13.8 mt -66.26 -57.15 8.16 Favored 'General case' 0 N--CA 1.499 2.014 1 CA-C-N 127.437 4.653 . . . . 0.0 115.014 169.272 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -56.36 -40.52 74.65 Favored 'General case' 0 CA--C 1.557 1.25 0 CA-C-O 115.54 -2.172 . . . . 0.0 113.719 -179.813 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -70.49 -31.04 45.2 Favored 'Isoleucine or valine' 0 C--O 1.201 -1.481 0 CA-C-N 123.156 2.707 . . . . 0.0 116.254 165.144 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 2.4 t -75.94 -49.83 24.78 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.136 0 CA-C-N 124.084 3.129 . . . . 0.0 112.077 177.076 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 27.1 mt-30 -46.25 -47.21 18.11 Favored 'General case' 0 N--CA 1.486 1.33 0 CA-C-O 116.662 -1.637 . . . . 0.0 113.214 154.09 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . 0.417 24.7 m-20 -47.33 -67.18 0.3 Allowed 'General case' 0 N--CA 1.491 1.593 0 CA-C-N 120.82 1.646 . . . . 0.0 110.509 158.307 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . 0.348 . . . . . . . 0 CA--C 1.558 1.252 0 N-CA-C 116.975 2.213 . . . . 0.0 116.975 -152.693 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 7.7 Cg_exo . . . . . 0 CA--C 1.55 1.324 0 N-CA-C 114.75 1.019 . . . . 0.0 114.75 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' B' B ' 6' ' ' HIS . . . . . . . . . . . . . 74.2 m80 -79.44 126.74 31.23 Favored 'General case' 0 CA--C 1.565 1.522 0 CA-C-N 113.931 -1.486 . . . . 0.0 111.612 177.107 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 7' ' ' PHE . . . . . . . . . . . . 0.255 2.3 p90 -131.8 153.44 50.13 Favored 'General case' 0 CA--C 1.561 1.372 0 O-C-N 120.239 -1.538 . . . . 0.0 110.419 146.81 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 8' ' ' ASN . . . . . . . . . . . . . 43.4 p-10 -70.48 77.12 0.57 Allowed 'General case' 0 CA--C 1.569 1.683 0 O-C-N 120.989 -1.069 . . . . 0.0 113.842 172.238 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 9' ' ' PHE . . . . . . . . . . . . . 12.2 t80 -73.52 145.7 45.4 Favored 'General case' 0 CA--C 1.558 1.268 0 CA-C-O 126.666 3.126 . . . . 0.0 110.207 168.262 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 10' ' ' ARG . . . . . . . . . . . . . 1.6 ttp180 -173.74 127.77 0.4 Allowed 'General case' 0 C--N 1.298 -1.652 0 CA-C-N 111.235 -2.711 . . . . 0.0 104.818 -135.847 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 11' ' ' MET . . . . . . . . . . . . . 1.3 mpt? -143.04 129.71 10.61 Favored Pre-proline 0 CA--C 1.559 1.307 0 CA-C-O 117.271 -1.347 . . . . 0.0 113.836 -159.896 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 12' ' ' PRO . . . . . . . . . . . . . 85.0 Cg_exo -43.06 146.27 0.98 Allowed 'Trans proline' 0 C--N 1.376 1.987 0 C-N-CA 123.201 2.601 . . . . 0.0 116.005 164.167 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 13' ' ' MET . . . . . . . . . . . . . 1.7 tpt -51.34 -36.41 42.83 Favored 'General case' 0 CA--C 1.57 1.749 0 N-CA-C 117.177 2.288 . . . . 0.0 117.177 -159.868 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 14' ' ' GLU . . . . . . . . . . . . 0.252 7.5 pt-20 -64.04 -51.02 66.13 Favored 'General case' 0 CA--C 1.572 1.799 0 N-CA-C 116.36 1.985 . . . . 0.0 116.36 170.407 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -56.03 -49.9 72.87 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.393 0 CA-C-N 123.364 2.802 . . . . 0.0 111.972 171.797 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.4 -24.89 63.02 Favored 'General case' 0 N--CA 1.474 0.758 0 N-CA-C 117.304 2.335 . . . . 0.0 117.304 174.484 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 17' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -68.96 -40.41 78.9 Favored 'General case' 0 N--CA 1.492 1.655 0 CA-C-N 123.273 2.76 . . . . 0.0 113.986 154.632 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . 0.263 53.8 mtmt -71.85 -47.79 50.57 Favored 'General case' 0 CA--C 1.563 1.46 0 CA-C-N 121.534 1.97 . . . . 0.0 115.732 179.157 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 19' ' ' LEU . . . . . . . . . . . . . 12.6 mt -56.02 -54.55 43.49 Favored 'General case' 0 CA--C 1.566 1.593 0 CA-C-N 120.225 1.375 . . . . 0.0 114.238 158.989 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 20' ' ' LYS . . . . . . . . . . . . . 15.1 ttpt -78.67 -20.84 49.31 Favored 'General case' 0 CA--C 1.572 1.809 0 O-C-N 119.453 -2.029 . . . . 0.0 114.371 -173.191 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 14.2 m-85 -68.62 -68.74 0.37 Allowed 'General case' 0 N--CA 1.489 1.516 0 CA-C-O 113.696 -3.05 . . . . 0.0 111.194 156.218 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . 0.276 13.5 tpp180 -22.97 -49.71 0.02 OUTLIER 'General case' 0 CA--C 1.599 2.86 1 CA-C-N 126.231 4.105 . . . . 0.0 115.554 162.7 . . . . . . . . 3 2 . 1 . 013 nuclear orig core ' B' B ' 23' ' ' ALA . . . . . . . . . . . . 0.265 . . -60.09 -76.08 0.05 Allowed 'General case' 0 CA--C 1.582 2.176 0 N-CA-C 116.815 2.154 . . . . 0.0 116.815 160.884 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 57.7 mm-40 -71.43 -35.03 70.82 Favored 'General case' 0 N--CA 1.5 2.057 0 N-CA-C 118.921 2.934 . . . . 0.0 118.921 -177.516 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 25' ' ' ALA . . . . . . . . . . . . . . . -44.69 -50.27 10.02 Favored 'General case' 0 CA--C 1.585 2.32 0 N-CA-C 115.89 1.811 . . . . 0.0 115.89 155.705 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 26' ' ' ASN . . . . . . . . . . . . . 88.4 m-20 -82.74 -43.37 16.88 Favored 'General case' 0 N--CA 1.501 2.124 0 N-CA-C 116.823 2.157 . . . . 0.0 116.823 176.3 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 27' ' ' GLY . . . . . . . . . . . . . . . 106.51 30.29 4.42 Favored Glycine 0 CA--C 1.561 2.936 0 N-CA-C 118.001 1.96 . . . . 0.0 118.001 -152.875 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 28' ' ' ARG . . . . . . . . . . . . . 48.4 mtm180 -114.62 145.39 42.06 Favored 'General case' 0 CA--C 1.57 1.742 0 N-CA-C 104.179 -2.526 . . . . 0.0 104.179 171.852 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 29' ' ' SER . . . . . . . . . . . . . 81.0 p -113.05 115.15 27.91 Favored 'General case' 0 N--CA 1.507 2.419 0 O-C-N 117.964 -2.96 . . . . 0.0 105.896 -170.271 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 30' ' ' MET . . . . . . . . . . . . . 32.6 mtp -46.62 -42.18 15.8 Favored 'General case' 0 N--CA 1.498 1.943 0 N-CA-C 118.833 2.901 . . . . 0.0 118.833 -141.566 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 31' ' ' ASN . . . . . . . . . . . . . 6.0 t-20 -45.1 -45.52 11.2 Favored 'General case' 0 CA--C 1.594 2.652 0 CA-C-N 125.974 3.988 . . . . 0.0 115.835 163.225 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 32' ' ' SER . . . . . . . . . . . . 0.274 51.7 m -55.34 -62.73 1.48 Allowed 'General case' 0 N--CA 1.502 2.156 0 N-CA-C 120.47 3.507 . . . . 0.0 120.47 151.963 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 6.2 tm-20 -58.54 -62.58 1.75 Allowed 'General case' 0 N--CA 1.507 2.42 0 CA-C-N 123.076 2.671 . . . . 0.0 115.675 175.343 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -44.23 -52.07 7.74 Favored 'General case' 0 C--O 1.212 -0.894 0 CA-C-O 115.653 -2.118 . . . . 0.0 105.948 178.254 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 35' ' ' LEU . . . . . . . . . . . . . 8.3 mt -63.17 -56.12 19.39 Favored 'General case' 0 C--N 1.364 1.237 0 CA-C-N 123.319 2.782 . . . . 0.0 116.839 179.98 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 36' ' ' GLN . . . . . . . . . . . . 0.287 0.7 OUTLIER -59.11 -35.85 74.14 Favored 'General case' 0 CA--C 1.568 1.663 0 CA-C-O 117.599 -1.191 . . . . 0.0 113.875 176.122 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 37' ' ' ILE . . . . . . . . . . . . . 1.3 tp -73.54 -26.08 21.65 Favored 'Isoleucine or valine' 0 CA--C 1.568 1.672 0 N-CA-C 117.831 2.53 . . . . 0.0 117.831 164.015 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 38' ' ' VAL . . . . . . . . . . . . . 2.4 t -80.97 -46.26 20.82 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.091 0 C-N-CA 127.887 2.475 . . . . 0.0 112.285 179.807 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 33.5 mt-30 -46.26 -46.92 18.12 Favored 'General case' 0 CA--C 1.576 1.968 0 C-N-CA 124.094 0.958 . . . . 0.0 113.53 150.023 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 40' ' ' ASP . . . . . . . . . . . . 0.289 1.2 t70 -58.56 -32.36 68.84 Favored 'General case' 0 CA--C 1.575 1.918 0 N-CA-C 118.151 2.648 . . . . 0.0 118.151 159.534 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -78.34 -50.92 10.9 Favored 'General case' 0 N--CA 1.48 1.072 0 N-CA-C 115.811 1.782 . . . . 0.0 115.811 -167.715 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 2.6 pp . . . . . 0 CA--C 1.566 1.564 0 N-CA-C 117.281 2.326 . . . . 0.0 117.281 164.812 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 8.8 p-10 . . . . . 0 CA--C 1.567 1.617 0 N-CA-C 112.049 0.388 . . . . 0.0 112.049 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 64.1 Cg_endo -64.37 148.39 90.86 Favored 'Trans proline' 0 CA--C 1.559 1.752 0 C-N-CA 123.698 2.932 . . . . 0.0 116.486 175.847 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 73.2 m80 -92.44 133.01 36.31 Favored 'General case' 0 CA--C 1.566 1.57 0 CA-C-N 113.301 -1.772 . . . . 0.0 110.956 178.977 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 2.8 p90 -125.82 151.23 47.07 Favored 'General case' 0 CA--C 1.563 1.479 0 O-C-N 120.423 -1.423 . . . . 0.0 110.28 154.285 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 14.3 m120 -69.25 90.67 0.5 Allowed 'General case' 0 N--CA 1.488 1.445 0 O-C-N 120.434 -1.416 . . . . 0.0 111.465 167.517 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . 0.489 ' CD2' ' SD ' ' A' ' 11' ' ' MET . 4.5 t80 -72.57 159.7 33.48 Favored 'General case' 0 CA--C 1.565 1.54 0 CA-C-O 125.207 2.432 . . . . 0.0 109.824 153.723 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 3.1 tmm_? -176.5 114.93 0.11 Allowed 'General case' 0 C--N 1.308 -1.232 0 N-CA-C 104.499 -2.408 . . . . 0.0 104.499 -141.493 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' MET . . . . . 0.489 ' SD ' ' CD2' ' A' ' 9' ' ' PHE . 0.1 OUTLIER -127.18 116.28 21.74 Favored Pre-proline 0 CA--C 1.559 1.311 0 CA-C-O 116.957 -1.497 . . . . 0.0 110.934 -162.488 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 81.5 Cg_exo -40.04 138.13 1.18 Allowed 'Trans proline' 0 CA--C 1.562 1.914 0 CA-C-N 123.798 2.392 . . . . 0.0 116.074 160.488 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 15.5 tpp -54.84 -25.83 31.18 Favored 'General case' 0 N--CA 1.496 1.836 0 N-CA-C 119.496 3.147 . . . . 0.0 119.496 -160.323 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -58.31 -57.55 12.41 Favored 'General case' 0 CA--C 1.568 1.655 0 N-CA-C 117.353 2.353 . . . . 0.0 117.353 156.976 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -55.42 -45.88 78.38 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.433 0 CA-C-N 121.887 2.13 . . . . 0.0 113.454 173.731 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -77.42 -27.89 52.42 Favored 'General case' 0 N--CA 1.474 0.75 0 CA-C-O 115.792 -2.052 . . . . 0.0 116.137 175.176 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 -65.0 -41.27 95.53 Favored 'General case' 0 N--CA 1.485 1.29 0 CA-C-N 124.252 3.205 . . . . 0.0 113.345 158.684 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . 0.542 32.5 pttt -77.44 -39.41 46.88 Favored 'General case' 0 CA--C 1.563 1.449 0 N-CA-C 116.989 2.218 . . . . 0.0 116.989 179.768 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 12.9 tp -66.27 -36.99 84.41 Favored 'General case' 0 CA--C 1.569 1.674 0 CA-C-N 120.595 1.543 . . . . 0.0 114.885 163.632 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 13.3 ttpt -90.26 -25.22 20.67 Favored 'General case' 0 CA--C 1.574 1.873 0 N-CA-C 114.821 1.415 . . . . 0.0 114.821 -179.825 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 24.1 m-85 -64.98 -69.58 0.28 Allowed 'General case' 0 N--CA 1.494 1.751 0 CA-C-O 113.581 -3.104 . . . . 0.0 110.501 155.974 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . 0.35 2.5 tmt_? -28.84 -44.0 0.03 OUTLIER 'General case' 0 CA--C 1.605 3.074 0 CA-C-N 125.747 3.885 . . . . 0.0 115.272 166.58 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -57.85 -76.28 0.04 OUTLIER 'General case' 0 CA--C 1.582 2.203 0 N-CA-C 117.445 2.387 . . . . 0.0 117.445 157.727 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 37.6 mt-10 . . . . . 0 N--CA 1.505 2.276 0 N-CA-C 118.092 2.627 . . . . 0.0 118.092 178.026 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 44.4 mtt85 . . . . . 0 CA--C 1.568 1.654 0 N-CA-C 106.762 -1.57 . . . . 0.0 106.762 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 39.2 t -114.14 118.96 35.5 Favored 'General case' 0 N--CA 1.5 2.064 0 N-CA-C 105.194 -2.15 . . . . 0.0 105.194 -178.893 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 15.1 mtp -47.61 -36.95 11.62 Favored 'General case' 0 N--CA 1.5 2.061 0 N-CA-C 119.25 3.056 . . . . 0.0 119.25 -146.599 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 15.8 t-20 -45.53 -45.65 13.49 Favored 'General case' 0 CA--C 1.598 2.827 0 CA-C-N 125.622 3.828 . . . . 0.0 115.715 161.881 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . 0.35 12.8 t -49.12 -73.73 0.04 OUTLIER 'General case' 0 N--CA 1.499 1.982 0 N-CA-C 117.877 2.547 . . . . 0.0 117.877 145.574 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -57.92 -57.35 13.18 Favored 'General case' 0 N--CA 1.516 2.834 0 CA-C-N 124.017 3.099 . . . . 0.0 116.523 -174.656 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -42.56 -53.2 4.49 Favored 'General case' 0 CA--C 1.555 1.145 0 CA-C-O 115.476 -2.202 . . . . 0.0 107.183 171.164 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 16.0 mt -62.24 -43.85 97.9 Favored 'General case' 0 C--N 1.368 1.388 0 CA-C-N 124.077 3.126 . . . . 0.0 115.954 174.036 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.76 -44.23 93.95 Favored 'General case' 0 N--CA 1.49 1.553 0 N-CA-C 115.37 1.619 . . . . 0.0 115.37 175.106 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 3.4 tt -75.07 -20.79 16.46 Favored 'Isoleucine or valine' 0 CA--C 1.564 1.493 0 CA-C-O 114.667 -2.587 . . . . 0.0 116.056 165.537 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 4.1 t -89.91 -48.53 14.33 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.001 0 CA-C-N 123.222 2.737 . . . . 0.0 109.927 -174.915 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 26.6 mt-30 -55.32 -43.67 75.13 Favored 'General case' 0 CA--C 1.565 1.527 0 O-C-N 121.276 -0.89 . . . . 0.0 112.31 156.953 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . 0.672 0.4 OUTLIER -61.02 -28.02 68.75 Favored 'General case' 0 CA--C 1.571 1.78 0 N-CA-C 118.531 2.789 . . . . 0.0 118.531 157.572 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.494 1.728 0 O-C-N 119.431 -2.043 . . . . 0.0 114.238 -179.766 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 3.3 Cg_exo . . . . . 0 CA--C 1.552 1.408 0 CA-C-O 122.025 0.76 . . . . 0.0 113.683 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' B' B ' 6' ' ' HIS . . . . . . . . . . . . . 78.5 m80 -83.22 128.95 34.94 Favored 'General case' 0 CA--C 1.562 1.44 0 CA-C-N 114.155 -1.384 . . . . 0.0 111.974 -178.171 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 7' ' ' PHE . . . . . . . . . . . . . 4.2 p90 -129.45 146.53 51.28 Favored 'General case' 0 CA--C 1.562 1.406 0 O-C-N 120.599 -1.313 . . . . 0.0 110.754 154.577 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 8' ' ' ASN . . . . . . . . . . . . . 12.6 m120 -70.26 86.42 0.58 Allowed 'General case' 0 N--CA 1.489 1.509 0 O-C-N 120.552 -1.343 . . . . 0.0 111.261 170.369 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 9' ' ' PHE . . . . . . . . . . . . . 5.9 t80 -70.48 153.12 43.27 Favored 'General case' 0 CA--C 1.551 1.006 0 CA-C-O 124.91 2.29 . . . . 0.0 110.745 161.907 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -162.65 126.15 2.93 Favored 'General case' 0 N--CA 1.481 1.114 0 CA-C-N 112.433 -2.167 . . . . 0.0 108.504 -160.752 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 11' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -127.02 115.44 21.96 Favored Pre-proline 0 CA--C 1.562 1.435 0 CA-C-O 117.253 -1.356 . . . . 0.0 110.605 -156.689 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 12' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_exo -41.96 142.99 1.31 Allowed 'Trans proline' 0 C--N 1.374 1.883 0 C-N-CA 122.99 2.46 . . . . 0.0 115.69 160.371 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 13' ' ' MET . . . . . . . . . . . . . 20.2 tpp -61.74 -35.56 78.46 Favored 'General case' 0 N--CA 1.493 1.69 0 N-CA-C 117.403 2.371 . . . . 0.0 117.403 -149.14 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 8.0 pt-20 -59.07 -41.44 88.0 Favored 'General case' 0 CA--C 1.568 1.645 0 N-CA-C 116.649 2.092 . . . . 0.0 116.649 163.564 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -59.65 -48.85 85.93 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.146 0 CA-C-N 122.885 2.584 . . . . 0.0 112.594 171.101 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 16' ' ' ARG . . . . . . . . . . . . 0.259 2.8 ttt180 -72.15 -41.23 67.33 Favored 'General case' 0 C--O 1.216 -0.704 0 CA-C-N 120.69 1.586 . . . . 0.0 114.855 176.986 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 17' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -61.52 -34.82 76.18 Favored 'General case' 0 CA--C 1.571 1.781 0 CA-C-N 122.779 2.536 . . . . 0.0 115.043 166.41 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 55.7 mtmt -66.55 -55.61 14.63 Favored 'General case' 0 CA--C 1.563 1.452 0 CA-C-N 121.34 1.882 . . . . 0.0 114.666 165.31 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 19' ' ' LEU . . . . . . . . . . . . . 11.3 tp -64.71 -37.06 86.31 Favored 'General case' 0 CA--C 1.566 1.572 0 N-CA-C 116.353 1.982 . . . . 0.0 116.353 176.965 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 20' ' ' LYS . . . . . . . . . . . . . 3.8 ttpt -87.22 -25.02 24.21 Favored 'General case' 0 CA--C 1.568 1.655 0 CA-C-O 116.917 -1.516 . . . . 0.0 113.598 176.331 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 13.6 m-30 -65.27 -71.06 0.2 Allowed 'General case' 0 N--CA 1.496 1.85 0 CA-C-O 113.551 -3.118 . . . . 0.0 110.667 158.218 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . 0.273 1.5 tpp180 -13.69 -56.68 0.0 OUTLIER 'General case' 0 CA--C 1.595 2.707 0 CA-C-N 125.263 3.665 . . . . 0.0 115.988 158.273 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 23' ' ' ALA . . . . . . . . . . . . 0.261 . . -57.91 -77.65 0.03 OUTLIER 'General case' 0 CA--C 1.589 2.47 0 N-CA-C 117.653 2.464 . . . . 0.0 117.653 160.664 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 54.5 mt-10 -61.13 -42.83 99.26 Favored 'General case' 0 N--CA 1.503 2.216 0 N-CA-C 118.874 2.916 . . . . 0.0 118.874 179.251 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 25' ' ' ALA . . . . . . . . . . . . . . . -39.63 -50.26 2.25 Favored 'General case' 0 CA--C 1.585 2.322 0 N-CA-C 115.882 1.808 . . . . 0.0 115.882 158.45 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 26' ' ' ASN . . . . . . . . . . . . . 71.2 m-20 -82.11 -49.15 10.5 Favored 'General case' 0 N--CA 1.498 1.952 0 N-CA-C 116.293 1.96 . . . . 0.0 116.293 174.79 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 27' ' ' GLY . . . . . . . . . . . . . . . 109.49 15.06 12.86 Favored Glycine 0 CA--C 1.561 2.964 0 N-CA-C 118.756 2.262 . . . . 0.0 118.756 -148.25 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 28' ' ' ARG . . . . . . . . . . . . . 1.7 mtt85 -98.66 156.04 17.02 Favored 'General case' 0 CA--C 1.573 1.829 0 CA-C-N 120.358 2.079 . . . . 0.0 105.59 162.737 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 29' ' ' SER . . . . . . . . . . . . . 38.9 t -122.14 112.22 17.94 Favored 'General case' 0 N--CA 1.503 2.21 0 O-C-N 117.928 -2.983 . . . . 0.0 105.774 -172.228 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 30' ' ' MET . . . . . . . . . . . . . 20.4 mtp -42.88 -32.12 0.58 Allowed 'General case' 0 N--CA 1.505 2.305 0 N-CA-C 121.46 3.874 . . . . 0.0 121.46 -146.133 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 31' ' ' ASN . . . . . . . . . . . . 0.269 12.5 t-20 -50.46 -52.12 40.86 Favored 'General case' 0 CA--C 1.594 2.659 0 O-C-N 118.34 -2.725 . . . . 0.0 114.414 159.002 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 32' ' ' SER . . . . . . . . . . . . 0.321 30.5 t -45.2 -77.54 0.02 OUTLIER 'General case' 0 N--CA 1.501 2.088 0 N-CA-C 116.793 2.145 . . . . 0.0 116.793 145.223 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 -67.83 -52.52 35.91 Favored 'General case' 0 N--CA 1.505 2.282 0 CA-C-N 123.728 2.967 . . . . 0.0 116.198 -168.095 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . 0.595 0.1 OUTLIER -49.56 -36.76 24.83 Favored 'General case' 0 CA--C 1.569 1.683 0 CA-C-O 114.061 -2.876 . . . . 0.0 107.882 170.833 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 35' ' ' LEU . . . . . . . . . . . . . 19.2 mt -65.56 -51.23 61.36 Favored 'General case' 0 N--CA 1.494 1.757 1 CA-C-N 126.493 4.224 . . . . 0.0 115.317 165.829 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 36' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -62.7 -39.12 93.0 Favored 'General case' 0 N--CA 1.477 0.905 0 CA-C-O 116.569 -1.682 . . . . 0.0 114.892 -177.325 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 37' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -69.36 -33.16 56.3 Favored 'Isoleucine or valine' 0 CA--C 1.572 1.802 0 CA-C-O 114.064 -2.874 . . . . 0.0 116.935 158.231 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 38' ' ' VAL . . . . . . . . . . . . . 2.2 t -77.24 -50.68 20.08 Favored 'Isoleucine or valine' 0 N--CA 1.513 2.706 0 CA-C-N 125.453 3.751 . . . . 0.0 112.259 -178.09 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 23.6 mt-30 -47.38 -44.76 24.53 Favored 'General case' 0 CA--C 1.557 1.226 0 CA-C-O 116.935 -1.507 . . . . 0.0 112.072 153.534 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 40' ' ' ASP . . . . . . . . . . . . 0.671 0.0 OUTLIER -48.0 -57.31 5.93 Favored 'General case' 0 N--CA 1.494 1.73 0 N-CA-C 117.051 2.241 . . . . 0.0 117.051 156.03 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -71.01 -44.64 65.48 Favored 'General case' 0 CA--C 1.543 0.684 0 N-CA-C 115.076 1.51 . . . . 0.0 115.076 -151.153 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . 0.312 0.7 OUTLIER . . . . . 0 N--CA 1.49 1.56 0 N-CA-C 118.394 2.738 . . . . 0.0 118.394 157.372 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 52.8 p-10 . . . . . 0 CA--C 1.57 1.714 0 CA-C-O 118.545 -0.74 . . . . 0.0 110.685 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 5.9 Cg_exo -101.12 144.98 0.29 Allowed 'Trans proline' 0 CA--C 1.559 1.733 0 CA-C-N 122.293 1.855 . . . . 0.0 114.619 -156.717 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 75.2 m80 -85.78 129.73 34.75 Favored 'General case' 0 CA--C 1.577 1.985 0 CA-C-N 115.011 -0.995 . . . . 0.0 112.144 179.754 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 8.3 p90 -129.42 152.95 48.41 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 119.329 -2.107 . . . . 0.0 111.115 147.871 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 14.2 m120 -71.17 87.05 0.78 Allowed 'General case' 0 N--CA 1.491 1.602 0 O-C-N 120.059 -1.651 . . . . 0.0 112.614 172.49 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 2.8 t80 -74.19 138.0 43.48 Favored 'General case' 0 CA--C 1.556 1.18 0 CA-C-O 125.573 2.606 . . . . 0.0 110.271 163.075 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -163.29 120.37 1.85 Allowed 'General case' 0 N--CA 1.487 1.422 0 CA-C-N 112.003 -2.362 . . . . 0.0 107.955 -153.002 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 2.5 mpt? -131.27 119.32 17.57 Favored Pre-proline 0 N--CA 1.485 1.278 0 CA-C-O 116.845 -1.55 . . . . 0.0 113.199 -142.162 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 75.5 Cg_exo -42.73 142.78 1.91 Allowed 'Trans proline' 0 C--N 1.372 1.807 0 C-N-CA 123.082 2.521 . . . . 0.0 115.529 165.003 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -57.19 -36.41 70.78 Favored 'General case' 0 N--CA 1.493 1.691 0 N-CA-C 117.227 2.306 . . . . 0.0 117.227 -152.405 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -62.28 -43.58 98.5 Favored 'General case' 0 CA--C 1.565 1.521 0 N-CA-C 116.969 2.211 . . . . 0.0 116.969 165.03 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -58.76 -50.64 78.58 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.355 0 CA-C-N 124.087 3.131 . . . . 0.0 113.158 174.584 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -67.37 -41.99 84.14 Favored 'General case' 0 C--O 1.214 -0.767 0 CA-C-O 116.041 -1.933 . . . . 0.0 115.789 171.284 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 51.0 mt-10 -59.04 -36.06 74.36 Favored 'General case' 0 CA--C 1.573 1.831 0 CA-C-N 123.935 3.061 . . . . 0.0 114.132 165.889 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . 0.276 42.3 mtmt -69.86 -54.71 12.25 Favored 'General case' 0 CA--C 1.564 1.492 0 CA-C-N 121.705 2.048 . . . . 0.0 115.138 171.909 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 10.8 mt -57.99 -45.63 86.51 Favored 'General case' 0 CA--C 1.57 1.723 0 N-CA-C 117.248 2.314 . . . . 0.0 117.248 167.565 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 17.1 ttpt -85.91 -24.46 26.61 Favored 'General case' 0 CA--C 1.569 1.681 0 C-N-CA 124.941 1.296 . . . . 0.0 113.486 -176.281 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 16.9 m-30 -67.44 -64.35 0.87 Allowed 'General case' 0 N--CA 1.492 1.662 0 CA-C-O 114.54 -2.647 . . . . 0.0 110.739 159.138 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . 0.305 12.1 tpp180 -25.22 -45.41 0.02 OUTLIER 'General case' 0 CA--C 1.614 3.406 0 CA-C-N 125.294 3.679 . . . . 0.0 116.089 159.086 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . 0.281 . . -64.45 -69.03 0.31 Allowed 'General case' 0 CA--C 1.59 2.492 0 O-C-N 117.618 -3.177 . . . . 0.0 116.265 163.442 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 39.8 mt-10 . . . . . 0 N--CA 1.501 2.075 0 N-CA-C 118.458 2.762 . . . . 0.0 118.458 -179.427 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.573 1.837 0 CA-C-O 122.622 1.201 . . . . 0.0 108.608 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 37.5 t -125.61 116.88 22.42 Favored 'General case' 0 N--CA 1.499 2.018 0 O-C-N 119.413 -2.054 . . . . 0.0 105.91 173.174 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 15.2 mtp -46.3 -30.7 2.16 Favored 'General case' 0 N--CA 1.501 2.109 0 N-CA-C 121.705 3.965 . . . . 0.0 121.705 -146.1 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . 0.251 4.0 t-20 -51.3 -49.68 60.83 Favored 'General case' 0 CA--C 1.584 2.281 0 O-C-N 118.512 -2.618 . . . . 0.0 114.164 160.538 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . 0.328 29.6 t -45.63 -71.42 0.08 Allowed 'General case' 0 N--CA 1.499 1.985 0 N-CA-C 117.335 2.346 . . . . 0.0 117.335 145.405 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -66.3 -60.24 2.96 Favored 'General case' 0 N--CA 1.503 2.217 0 CA-C-N 122.977 2.626 . . . . 0.0 114.547 -168.541 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . 0.573 0.1 OUTLIER -50.46 -34.25 24.17 Favored 'General case' 0 CA--C 1.575 1.907 0 CA-C-O 113.67 -3.062 . . . . 0.0 106.33 175.059 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 17.7 mt -66.4 -49.93 65.16 Favored 'General case' 0 C--N 1.378 1.812 1 CA-C-N 127.288 4.585 . . . . 0.0 116.8 164.227 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -58.43 -41.36 84.85 Favored 'General case' 0 N--CA 1.492 1.627 0 N-CA-C 114.983 1.475 . . . . 0.0 114.983 178.393 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 2.6 tt -71.8 -31.07 40.03 Favored 'Isoleucine or valine' 0 CA--C 1.567 1.622 0 CA-C-O 114.066 -2.873 . . . . 0.0 116.972 161.398 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 3.3 t -77.9 -45.72 27.48 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.291 0 CA-C-N 124.717 3.417 . . . . 0.0 112.156 -179.979 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 23.8 mt-30 -52.74 -43.25 65.6 Favored 'General case' 0 CA--C 1.565 1.54 0 C-N-CA 124.362 1.065 . . . . 0.0 113.14 155.272 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . 0.494 2.8 m-20 -57.65 -32.65 67.5 Favored 'General case' 0 N--CA 1.5 2.055 0 N-CA-C 118.938 2.94 . . . . 0.0 118.938 155.089 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.551 1.001 0 O-C-N 119.635 -1.916 . . . . 0.0 112.803 -167.372 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo . . . . . 0 CA--C 1.569 2.23 0 N-CA-C 117.207 1.964 . . . . 0.0 117.207 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' B' B ' 6' ' ' HIS . . . . . . . . . . . . . 70.5 m80 -106.6 143.52 34.59 Favored 'General case' 0 CA--C 1.56 1.341 0 CA-C-N 113.555 -1.657 . . . . 0.0 112.402 -167.004 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 7' ' ' PHE . . . . . . . . . . . . . 8.9 p90 -140.63 155.71 46.46 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 120.411 -1.43 . . . . 0.0 111.1 149.166 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 8' ' ' ASN . . . . . . . . . . . . . 14.7 m120 -71.04 90.04 0.83 Allowed 'General case' 0 N--CA 1.489 1.494 0 O-C-N 120.218 -1.551 . . . . 0.0 111.659 168.537 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 9' ' ' PHE . . . . . . . . . . . . . 6.8 t80 -73.31 149.24 42.81 Favored 'General case' 0 CA--C 1.561 1.397 0 CA-C-O 125.121 2.391 . . . . 0.0 110.428 156.822 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 10' ' ' ARG . . . . . . . . . . . . . 34.0 tpt85 -179.78 93.3 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.651 0 O-C-N 119.718 -1.863 . . . . 0.0 107.869 -123.991 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 11' ' ' MET . . . . . . . . . . . . . 1.2 mpt? -130.09 129.88 23.01 Favored Pre-proline 0 CA--C 1.567 1.625 0 CA-C-O 117.302 -1.332 . . . . 0.0 112.805 -153.68 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 12' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_exo -44.89 146.14 2.57 Favored 'Trans proline' 0 CA--C 1.564 2.012 0 C-N-CA 123.082 2.521 . . . . 0.0 116.976 166.867 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 13' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -48.87 -37.53 19.87 Favored 'General case' 0 N--CA 1.496 1.827 0 N-CA-C 118.348 2.721 . . . . 0.0 118.348 -165.554 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 14' ' ' GLU . . . . . . . . . . . . 0.262 8.6 pt-20 -64.29 -48.08 77.05 Favored 'General case' 0 CA--C 1.566 1.572 0 N-CA-C 115.64 1.719 . . . . 0.0 115.64 170.028 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -59.6 -46.97 92.65 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.067 0 CA-C-N 123.408 2.822 . . . . 0.0 112.385 172.052 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.25 -33.86 63.45 Favored 'General case' 0 N--CA 1.475 0.781 0 N-CA-C 116.455 2.02 . . . . 0.0 116.455 177.184 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 17' ' ' GLU . . . . . . . . . . . . . 74.5 mm-40 -65.32 -41.89 93.54 Favored 'General case' 0 N--CA 1.491 1.623 0 CA-C-N 123.611 2.914 . . . . 0.0 113.896 159.742 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . 0.289 50.9 mtmt -62.56 -45.79 91.3 Favored 'General case' 0 CA--C 1.566 1.561 0 CA-C-N 121.912 2.142 . . . . 0.0 115.361 172.241 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 19' ' ' LEU . . . . . . . . . . . . . 13.9 tp -72.65 -34.94 67.61 Favored 'General case' 0 CA--C 1.569 1.696 0 CA-C-N 120.739 1.608 . . . . 0.0 114.399 176.585 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 20' ' ' LYS . . . . . . . . . . . . . 8.5 ttpt -88.21 -30.3 19.83 Favored 'General case' 0 CA--C 1.564 1.488 0 C-N-CA 125.635 1.574 . . . . 0.0 114.388 178.468 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 15.1 m-85 -56.82 -73.59 0.06 Allowed 'General case' 0 N--CA 1.491 1.599 0 CA-C-O 113.581 -3.104 . . . . 0.0 110.46 148.915 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . 0.406 4.9 tmm_? -31.34 -41.68 0.04 OUTLIER 'General case' 0 CA--C 1.594 2.655 0 CA-C-N 125.829 3.922 . . . . 0.0 116.869 173.66 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -57.46 -74.48 0.06 Allowed 'General case' 0 CA--C 1.585 2.316 0 N-CA-C 118.856 2.91 . . . . 0.0 118.856 154.357 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -59.92 -45.82 91.37 Favored 'General case' 0 N--CA 1.504 2.274 0 N-CA-C 118.826 2.899 . . . . 0.0 118.826 175.363 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 25' ' ' ALA . . . . . . . . . . . . . . . -38.98 -51.92 1.79 Allowed 'General case' 0 CA--C 1.587 2.378 0 N-CA-C 116.824 2.157 . . . . 0.0 116.824 159.42 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 26' ' ' ASN . . . . . . . . . . . . . 34.8 m-20 -87.53 -51.75 5.74 Favored 'General case' 0 CA--C 1.575 1.936 0 N-CA-C 115.236 1.569 . . . . 0.0 115.236 179.67 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 27' ' ' GLY . . . . . . . . . . . . . . . 128.61 19.76 1.62 Allowed Glycine 0 CA--C 1.56 2.875 0 N-CA-C 119.275 2.47 . . . . 0.0 119.275 -161.054 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 28' ' ' ARG . . . . . . . . . . . . . 80.0 mtt-85 -116.22 166.49 11.97 Favored 'General case' 0 N--CA 1.495 1.778 0 CA-C-N 121.049 2.425 . . . . 0.0 106.957 167.535 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 29' ' ' SER . . . . . . . . . . . . . 91.1 p -121.14 112.55 18.82 Favored 'General case' 0 N--CA 1.5 2.049 0 O-C-N 118.742 -2.474 . . . . 0.0 105.491 -173.115 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 30' ' ' MET . . . . . . . . . . . . . 38.3 mtp -41.88 -46.14 3.91 Favored 'General case' 0 N--CA 1.499 2.002 0 N-CA-C 119.438 3.125 . . . . 0.0 119.438 -141.436 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 31' ' ' ASN . . . . . . . . . . . . . 25.2 t-20 -43.43 -44.52 5.83 Favored 'General case' 0 CA--C 1.598 2.796 0 CA-C-N 125.245 3.657 . . . . 0.0 115.712 164.179 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 32' ' ' SER . . . . . . . . . . . . 0.282 62.9 m -58.01 -58.23 9.33 Favored 'General case' 0 N--CA 1.498 1.96 0 N-CA-C 120.914 3.672 . . . . 0.0 120.914 149.688 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -64.9 -61.99 1.83 Allowed 'General case' 0 N--CA 1.515 2.795 0 CA-C-N 123.76 2.982 . . . . 0.0 114.835 177.637 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -38.8 -53.96 1.64 Allowed 'General case' 0 CA--C 1.549 0.915 0 CA-C-O 115.004 -2.426 . . . . 0.0 107.934 170.726 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 35' ' ' LEU . . . . . . . . . . . . . 11.1 mt -65.09 -60.31 3.16 Favored 'General case' 0 N--CA 1.485 1.293 0 CA-C-N 124.448 3.295 . . . . 0.0 115.665 -178.156 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 36' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -53.0 -41.46 64.66 Favored 'General case' 0 CA--C 1.558 1.253 0 CA-C-O 117.213 -1.375 . . . . 0.0 113.932 175.073 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 37' ' ' ILE . . . . . . . . . . . . . 1.6 tp -75.08 -24.91 18.0 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.405 0 N-CA-C 116.37 1.989 . . . . 0.0 116.37 173.165 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 38' ' ' VAL . . . . . . . . . . . . . 2.2 t -81.15 -49.76 17.65 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.809 0 C-N-CA 127.487 2.315 . . . . 0.0 111.03 175.643 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 9.7 tt0 -44.27 -47.88 9.45 Favored 'General case' 0 CA--C 1.559 1.3 0 C-N-CA 124.771 1.229 . . . . 0.0 113.649 153.814 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 40' ' ' ASP . . . . . . . . . . . . 0.582 0.7 OUTLIER -53.09 -59.01 5.09 Favored 'General case' 0 CA--C 1.553 1.081 0 N-CA-C 116.092 1.886 . . . . 0.0 116.092 157.317 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -67.4 -37.34 82.96 Favored 'General case' 0 CA--C 1.555 1.147 0 N-CA-C 116.591 2.071 . . . . 0.0 116.591 -159.465 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . 0.331 1.2 pp . . . . . 0 N--CA 1.49 1.553 0 N-CA-C 119.321 3.082 . . . . 0.0 119.321 157.418 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.559 1.314 0 N-CA-C 113.757 1.021 . . . . 0.0 113.757 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 22.3 mmt180 -84.6 77.98 9.93 Favored 'General case' 0 N--CA 1.491 1.591 0 N-CA-C 114.502 1.297 . . . . 0.0 114.502 -176.639 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -106.04 23.11 14.54 Favored 'General case' 0 CA--C 1.572 1.792 0 N-CA-C 114.321 1.23 . . . . 0.0 114.321 154.673 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 2.5 p30 -151.86 86.72 4.51 Favored Pre-proline 0 CA--C 1.567 1.606 0 O-C-N 120.367 -1.458 . . . . 0.0 112.074 155.507 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 5.7 Cg_exo -87.89 148.55 7.04 Favored 'Trans proline' 0 CA--C 1.549 1.247 0 C-N-CA 122.486 2.124 . . . . 0.0 114.676 -170.704 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 37.8 m80 -73.57 141.3 46.66 Favored 'General case' 0 CA--C 1.561 1.394 0 CA-C-N 113.384 -1.734 . . . . 0.0 113.355 173.555 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 24.3 p90 -125.93 163.81 22.15 Favored 'General case' 0 CA--C 1.559 1.317 0 O-C-N 120.035 -1.666 . . . . 0.0 111.2 115.807 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 1.1 p-10 -73.98 91.08 2.0 Favored 'General case' 0 CA--C 1.567 1.604 0 O-C-N 120.106 -1.621 . . . . 0.0 110.398 159.525 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 4.1 t80 -66.99 168.07 10.62 Favored 'General case' 0 CA--C 1.559 1.325 0 CA-C-O 124.049 1.88 . . . . 0.0 110.489 154.274 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 9.6 tpt180 163.28 109.03 0.0 OUTLIER 'General case' 0 N--CA 1.488 1.443 0 O-C-N 119.724 -1.86 . . . . 0.0 106.211 -120.173 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 13.6 mtm -144.73 123.21 6.75 Favored Pre-proline 0 CA--C 1.562 1.438 0 CA-C-N 114.08 -1.418 . . . . 0.0 108.881 -157.228 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_exo -43.66 147.92 0.99 Allowed 'Trans proline' 0 CA--C 1.562 1.9 0 C-N-CA 122.613 2.209 . . . . 0.0 115.952 159.657 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 1.3 tpt -48.99 -40.79 32.02 Favored 'General case' 0 N--CA 1.494 1.749 0 N-CA-C 117.195 2.294 . . . . 0.0 117.195 -166.942 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 1.1 pm0 -56.77 -49.42 75.34 Favored 'General case' 0 CA--C 1.562 1.406 0 N-CA-C 117.774 2.509 . . . . 0.0 117.774 167.092 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -62.33 -45.54 98.53 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.27 0 CA-C-N 122.721 2.51 . . . . 0.0 113.116 173.891 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -78.15 -23.91 47.55 Favored 'General case' 0 CA--C 1.552 1.055 0 N-CA-C 116.51 2.041 . . . . 0.0 116.51 176.532 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 51.0 mt-10 -68.67 -38.52 80.44 Favored 'General case' 0 CA--C 1.559 1.296 0 CA-C-N 121.579 1.99 . . . . 0.0 114.33 154.089 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . 0.608 11.5 pttt -81.39 -35.09 31.19 Favored 'General case' 0 N--CA 1.497 1.907 0 CA-C-N 124.487 3.312 . . . . 0.0 117.142 177.68 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . 0.293 12.6 tp -63.92 -39.13 93.46 Favored 'General case' 0 CA--C 1.567 1.606 0 O-C-N 120.193 -1.567 . . . . 0.0 114.83 159.735 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 20.0 ttpt -89.08 -20.78 23.91 Favored 'General case' 0 CA--C 1.568 1.656 0 CA-C-O 115.167 -2.349 . . . . 0.0 117.027 175.887 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -102.83 6.5 39.25 Favored 'General case' 0 N--CA 1.529 3.493 0 N-CA-C 119.987 3.329 . . . . 0.0 119.987 164.358 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . 0.509 ' O ' ' N ' ' A' ' 24' ' ' GLU . 2.2 tpp180 -72.71 -140.46 0.01 OUTLIER 'General case' 0 C--N 1.308 -1.205 0 CA-C-O 115.218 -2.325 . . . . 0.0 111.798 106.984 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.423 ' CB ' ' ND2' ' A' ' 26' ' ' ASN 0.66 . . 39.12 -48.32 0.0 OUTLIER 'General case' 0 CA--C 1.593 2.605 1 CA-C-N 127.101 4.5 . . . . 0.0 120.085 -163.865 . . . . . . . . 4 3 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . 0.509 ' N ' ' O ' ' A' ' 22' ' ' ARG . 2.5 tt0 -135.74 -64.11 0.64 Allowed 'General case' 0 N--CA 1.496 1.857 1 O-C-N 115.878 -4.264 . . . . 0.0 119.987 121.481 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . 0.613 . . -66.26 114.65 5.5 Favored 'General case' 0 N--CA 1.499 1.994 1 N-CA-C 134.186 8.587 . . . . 0.0 134.186 24.543 . . . . . . . . 3 2 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . 0.423 ' ND2' ' CB ' ' A' ' 23' ' ' ALA 1.171 0.7 OUTLIER 26.72 77.21 0.02 OUTLIER 'General case' 0 CA--C 1.577 2.002 2 N-CA-C 130.262 7.134 . . . . 0.0 130.262 -159.525 . . . . . . . . 5 4 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -108.69 -36.52 2.21 Favored Glycine 0 CA--C 1.558 2.744 0 N-CA-C 117.468 1.747 . . . . 0.0 117.468 148.908 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . 0.398 0.0 OUTLIER -118.35 109.67 16.56 Favored 'General case' 0 N--CA 1.487 1.401 0 N-CA-C 105.864 -1.902 . . . . 0.0 105.864 -173.371 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 32.6 t -102.0 112.55 25.23 Favored 'General case' 0 N--CA 1.488 1.458 0 CA-C-O 115.107 -2.378 . . . . 0.0 106.307 -118.733 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 21.1 mtp -37.45 -41.2 0.42 Allowed 'General case' 0 N--CA 1.506 2.366 0 N-CA-C 120.165 3.394 . . . . 0.0 120.165 -145.811 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 14.5 t-20 -42.1 -51.75 4.49 Favored 'General case' 0 CA--C 1.597 2.771 0 O-C-N 116.867 -3.646 . . . . 0.0 116.142 159.224 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . 0.37 24.4 t -46.12 -65.63 0.52 Allowed 'General case' 0 N--CA 1.5 2.042 0 N-CA-C 119.738 3.236 . . . . 0.0 119.738 144.598 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -71.14 -54.54 10.71 Favored 'General case' 0 N--CA 1.512 2.664 0 N-CA-C 119.269 3.063 . . . . 0.0 119.269 -176.789 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -37.46 -52.84 1.16 Allowed 'General case' 0 CA--C 1.55 0.96 0 CA-C-O 115.586 -2.149 . . . . 0.0 108.814 162.855 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 12.9 mt -61.96 -51.32 68.57 Favored 'General case' 0 C--N 1.369 1.444 0 CA-C-N 123.036 2.653 . . . . 0.0 115.098 177.091 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . 0.326 0.0 OUTLIER -67.04 -36.67 82.58 Favored 'General case' 0 CA--C 1.575 1.922 0 CA-C-O 116.081 -1.914 . . . . 0.0 115.022 -178.979 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 8.7 tt -61.97 -44.67 99.24 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.254 0 CA-C-N 124.133 3.151 . . . . 0.0 115.533 154.049 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 2.7 t -65.25 -48.23 84.27 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.117 0 CA-C-N 123.351 2.796 . . . . 0.0 112.782 -172.66 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 30.4 mt-30 -48.71 -47.76 40.9 Favored 'General case' 0 CA--C 1.567 1.631 0 C-N-CA 125.571 1.549 . . . . 0.0 114.226 155.685 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . 0.458 2.1 m-20 -52.83 -34.96 56.46 Favored 'General case' 0 CA--C 1.578 2.035 0 N-CA-C 118.68 2.844 . . . . 0.0 118.68 157.475 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -85.26 -57.37 3.11 Favored 'General case' 0 CA--C 1.55 0.965 0 N-CA-C 113.606 0.965 . . . . 0.0 113.606 -161.909 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 2.7 pp -85.23 -2.06 57.62 Favored 'General case' 0 CA--C 1.569 1.674 0 N-CA-C 117.812 2.523 . . . . 0.0 117.812 163.648 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 73.3 m -140.1 42.55 1.94 Allowed 'General case' 0 N--CA 1.496 1.83 0 CA-C-N 122.874 2.579 . . . . 0.0 116.637 173.182 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 8.1 mtpm? -115.28 150.92 45.25 Favored Pre-proline 0 N--CA 1.507 2.394 0 O-C-N 119.927 -1.733 . . . . 0.0 111.667 140.067 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_exo -93.77 165.44 2.21 Favored 'Trans proline' 0 N--CA 1.502 1.974 0 N-CA-C 120.965 3.409 . . . . 0.0 120.965 61.988 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 67.0 m -108.81 120.4 46.22 Favored Pre-proline 0 CA--C 1.576 1.945 0 CA-C-O 117.157 -1.402 . . . . 0.0 108.481 142.881 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 83.4 Cg_exo -50.57 101.86 0.05 OUTLIER 'Trans proline' 0 CA--C 1.575 2.542 0 CA-C-N 124.267 2.56 . . . . 0.0 118.412 179.786 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 4.6 t -25.93 116.5 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.518 2.936 0 N-CA-C 118.51 2.782 . . . . 0.0 118.51 -172.063 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . 0.542 0.5 OUTLIER 66.52 -152.52 0.22 Allowed 'General case' 0 N--CA 1.503 2.206 2 O-C-N 113.072 -6.018 . . . . 0.0 116.603 -12.951 . . . . . . . . 4 3 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -124.64 131.59 7.89 Favored Glycine 0 CA--C 1.563 3.05 0 O-C-N 120.557 -1.339 . . . . 0.0 113.507 135.504 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -154.42 172.9 16.99 Favored 'General case' 0 CA--C 1.587 2.381 2 O-C-N 113.969 -5.43 . . . . 0.0 112.36 -6.02 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 34.3 ttm-85 -94.84 -163.36 1.04 Allowed 'General case' 0 N--CA 1.508 2.472 0 O-C-N 120.104 -1.623 . . . . 0.0 112.818 163.07 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . 0.415 4.7 m120 80.78 -137.34 0.01 OUTLIER 'General case' 0 N--CA 1.512 2.638 0 O-C-N 118.642 -2.536 . . . . 0.0 111.055 -177.554 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . 0.3 21.1 p30 12.44 68.01 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.87 0 N-CA-C 116.243 1.942 . . . . 0.0 116.243 -101.55 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -84.39 -90.45 0.09 Allowed 'General case' 0 CA--C 1.545 0.77 0 N-CA-C 115.246 1.573 . . . . 0.0 115.246 -153.12 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 29.0 mt-10 31.84 -63.58 0.0 OUTLIER 'General case' 0 CA--C 1.563 1.462 1 N-CA-C 122.439 4.237 . . . . 0.0 122.439 82.146 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . 0.501 1.1 mpt_? -89.71 -44.53 9.95 Favored 'General case' 0 N--CA 1.479 1.016 0 O-C-N 120.153 -1.592 . . . . 0.0 115.057 -178.679 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . 0.604 33.0 mt -83.44 -1.37 53.38 Favored 'General case' 0 CA--C 1.606 3.111 0 O-C-N 118.567 -2.583 . . . . 0.0 114.063 160.963 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -65.07 -30.97 71.97 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 116.635 -3.791 . . . . 0.0 116.87 141.597 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -64.44 -19.28 65.44 Favored 'General case' 0 CA--C 1.571 1.787 0 N-CA-C 117.018 2.229 . . . . 0.0 117.018 154.897 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . 0.406 0.1 OUTLIER -55.83 -51.18 68.41 Favored 'General case' 0 N--CA 1.491 1.587 0 CA-C-O 116.492 -1.718 . . . . 0.0 112.174 151.947 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -52.46 -63.36 1.17 Allowed 'General case' 0 CA--C 1.56 1.341 0 CA-C-N 121.74 2.064 . . . . 0.0 112.537 170.674 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 28.1 m -21.03 -54.81 0.02 OUTLIER 'General case' 0 N--CA 1.508 2.466 0 N-CA-C 121.634 3.938 . . . . 0.0 121.634 163.039 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . 0.365 51.1 mt-10 -81.26 -9.66 59.73 Favored 'General case' 0 CA--C 1.586 2.352 0 N-CA-C 113.846 1.054 . . . . 0.0 113.846 -179.769 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -103.56 25.19 10.0 Favored 'General case' 0 CA--C 1.607 3.151 0 C-N-CA 126.597 1.959 . . . . 0.0 114.261 151.7 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 1.3 t . . . . . 0 N--CA 1.524 3.251 0 O-C-N 119.965 -1.709 . . . . 0.0 113.14 -166.309 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.566 1.562 0 N-CA-C 117.967 2.58 . . . . 0.0 117.967 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 2' ' ' ARG . . . . . . . . . . . . 0.286 3.5 mmp_? 63.46 37.87 10.32 Favored 'General case' 0 N--CA 1.506 2.334 0 N-CA-C 118.231 2.678 . . . . 0.0 118.231 173.156 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -160.02 -41.98 0.05 Allowed 'General case' 0 N--CA 1.491 1.609 0 C-N-CA 124.898 1.279 . . . . 0.0 112.046 164.47 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 4' ' ' ASP . . . . . . . . . . . . . 2.1 p30 -139.06 78.82 28.25 Favored Pre-proline 0 CA--C 1.569 1.695 0 O-C-N 120.859 -1.151 . . . . 0.0 111.209 156.01 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -69.75 136.73 33.77 Favored 'Trans proline' 0 CA--C 1.555 1.543 0 C-N-CA 123.478 2.785 . . . . 0.0 116.891 -179.974 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 6' ' ' HIS . . . . . . . . . . . . . 71.9 m80 -77.14 136.67 38.61 Favored 'General case' 0 CA--C 1.577 2.0 0 CA-C-N 113.615 -1.63 . . . . 0.0 111.859 164.222 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 7' ' ' PHE . . . . . . . . . . . . . 1.2 p90 -136.28 158.1 45.22 Favored 'General case' 0 CA--C 1.57 1.746 0 O-C-N 119.869 -1.769 . . . . 0.0 111.87 150.036 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 8' ' ' ASN . . . . . . . . . . . . . 80.8 m-20 -69.35 103.87 2.11 Favored 'General case' 0 CA--C 1.571 1.773 0 O-C-N 120.374 -1.454 . . . . 0.0 113.033 174.622 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 9' ' ' PHE . . . . . . . . . . . . . 6.8 t80 -120.65 104.81 10.22 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 124.31 1.044 . . . . 0.0 108.318 160.334 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 10' ' ' ARG . . . . . . . . . . . . 0.438 0.1 OUTLIER 91.75 86.9 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.737 1 O-C-N 113.503 -5.748 . . . . 0.0 111.2 -9.779 . . . . . . . . 4 3 . 1 . 001 nuclear orig full ' B' B ' 11' ' ' MET . . . . . . . . . . . . . 16.4 mtm -155.93 126.7 3.5 Favored Pre-proline 0 CA--C 1.572 1.808 0 CA-C-O 116.894 -1.527 . . . . 0.0 110.241 -154.777 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 12' ' ' PRO . . . . . . . . . . . . . 87.0 Cg_exo -42.55 147.55 0.56 Allowed 'Trans proline' 0 C--N 1.373 1.828 0 C-N-CA 123.788 2.992 . . . . 0.0 117.751 168.941 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 13' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -44.33 -53.17 6.99 Favored 'General case' 0 N--CA 1.493 1.723 0 N-CA-C 118.105 2.632 . . . . 0.0 118.105 -162.851 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -62.1 -39.26 91.89 Favored 'General case' 0 CA--C 1.561 1.375 0 N-CA-C 116.793 2.145 . . . . 0.0 116.793 173.034 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -59.98 -52.25 63.34 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.181 0 CA-C-N 123.509 2.868 . . . . 0.0 111.604 170.423 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -72.14 -30.04 64.64 Favored 'General case' 0 CA--C 1.553 1.07 0 N-CA-C 116.364 1.987 . . . . 0.0 116.364 179.152 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 17' ' ' GLU . . . . . . . . . . . . . 38.3 mt-10 -61.54 -49.25 77.45 Favored 'General case' 0 N--CA 1.492 1.674 0 CA-C-N 122.4 2.364 . . . . 0.0 114.086 155.333 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . 0.255 51.0 mtmt -58.48 -49.54 76.98 Favored 'General case' 0 N--CA 1.489 1.492 0 CA-C-N 122.055 2.207 . . . . 0.0 115.748 174.026 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 19' ' ' LEU . . . . . . . . . . . . 0.266 0.5 OUTLIER -66.21 -35.82 81.44 Favored 'General case' 0 CA--C 1.571 1.761 0 C-N-CA 125.574 1.55 . . . . 0.0 114.766 174.218 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 20' ' ' LYS . . . . . . . . . . . . . 15.9 ttpt -87.33 -31.2 20.3 Favored 'General case' 0 CA--C 1.564 1.492 0 N-CA-C 114.502 1.297 . . . . 0.0 114.502 178.201 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 13.8 m-85 -59.05 -72.29 0.1 Allowed 'General case' 0 N--CA 1.487 1.409 0 CA-C-O 114.855 -2.498 . . . . 0.0 110.956 155.014 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . 0.299 13.2 ttt85 -23.83 -50.28 0.02 OUTLIER 'General case' 0 CA--C 1.59 2.496 0 CA-C-N 125.098 3.59 . . . . 0.0 117.043 166.514 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 23' ' ' ALA . . . . . . . . . . . . 0.272 . . -53.78 -76.23 0.03 OUTLIER 'General case' 0 CA--C 1.587 2.383 0 N-CA-C 119.332 3.086 . . . . 0.0 119.332 154.849 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 51.1 mm-40 -71.11 -39.29 72.16 Favored 'General case' 0 CA--C 1.578 2.027 0 N-CA-C 119.229 3.048 . . . . 0.0 119.229 -178.351 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 25' ' ' ALA . . . . . . . . . . . . . . . -40.72 -49.87 3.08 Favored 'General case' 0 CA--C 1.578 2.053 0 N-CA-C 117.304 2.335 . . . . 0.0 117.304 154.938 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 26' ' ' ASN . . . . . . . . . . . . 0.303 0.0 OUTLIER -117.3 -36.71 3.68 Favored 'General case' 0 CA--C 1.578 2.028 0 N-CA-C 115.454 1.65 . . . . 0.0 115.454 -156.386 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 27' ' ' GLY . . . . . . . . . . . . . . . 131.64 31.75 0.5 Allowed Glycine 0 N--CA 1.496 2.674 0 N-CA-C 119.041 2.377 . . . . 0.0 119.041 172.825 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 28' ' ' ARG . . . . . . . . . . . . 0.343 3.2 mtm-85 -131.09 164.19 25.99 Favored 'General case' 0 CA--C 1.585 2.299 0 N-CA-C 103.647 -2.723 . . . . 0.0 103.647 168.177 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 29' ' ' SER . . . . . . . . . . . . . 89.9 p -127.41 107.59 10.09 Favored 'General case' 0 N--CA 1.511 2.623 1 O-C-N 116.064 -4.148 . . . . 0.0 108.2 -168.053 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 30' ' ' MET . . . . . . . . . . . . . 24.2 mtp -42.88 -42.81 3.81 Favored 'General case' 0 N--CA 1.498 1.972 0 N-CA-C 119.476 3.139 . . . . 0.0 119.476 -133.339 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 31' ' ' ASN . . . . . . . . . . . . 0.274 0.1 OUTLIER -49.28 -43.1 42.83 Favored 'General case' 0 CA--C 1.593 2.608 0 O-C-N 116.712 -3.742 . . . . 0.0 114.966 165.383 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 32' ' ' SER . . . . . . . . . . . . 0.29 27.2 t -50.47 -73.38 0.04 OUTLIER 'General case' 0 N--CA 1.501 2.124 0 N-CA-C 117.54 2.422 . . . . 0.0 117.54 141.927 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 5.2 tm-20 -65.05 -49.0 71.8 Favored 'General case' 0 N--CA 1.506 2.346 0 N-CA-C 119.598 3.184 . . . . 0.0 119.598 -171.274 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -41.51 -57.01 2.36 Favored 'General case' 0 CA--C 1.556 1.198 0 CA-C-O 115.495 -2.193 . . . . 0.0 108.628 158.926 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 35' ' ' LEU . . . . . . . . . . . . . 11.9 mt -60.93 -48.34 82.29 Favored 'General case' 0 N--CA 1.491 1.596 0 CA-C-N 124.44 3.291 . . . . 0.0 116.392 179.058 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 36' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -68.46 -34.56 76.16 Favored 'General case' 0 N--CA 1.478 0.964 0 CA-C-O 116.748 -1.596 . . . . 0.0 114.023 178.726 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 37' ' ' ILE . . . . . . . . . . . . . 2.0 tp -70.84 -27.94 32.12 Favored 'Isoleucine or valine' 0 CA--C 1.567 1.602 0 CA-C-O 115.836 -2.031 . . . . 0.0 115.363 163.191 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 38' ' ' VAL . . . . . . . . . . . . . 2.6 t -86.38 -52.96 11.26 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.194 0 C-N-CA 127.812 2.445 . . . . 0.0 110.917 -174.55 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 33.9 mt-30 -52.96 -37.67 61.36 Favored 'General case' 0 CA--C 1.562 1.427 0 CA-C-O 117.922 -1.037 . . . . 0.0 112.901 156.401 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 40' ' ' ASP . . . . . . . . . . . . 0.322 54.0 t0 -55.78 -54.63 42.13 Favored 'General case' 0 N--CA 1.49 1.548 0 N-CA-C 117.567 2.432 . . . . 0.0 117.567 154.516 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 41' ' ' ALA . . . . . . . . . . . . 0.315 . . -64.17 -40.43 96.11 Favored 'General case' 0 CA--C 1.558 1.253 0 N-CA-C 116.215 1.932 . . . . 0.0 116.215 -167.747 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 2.6 pp -118.28 -1.99 11.22 Favored 'General case' 0 N--CA 1.49 1.549 0 N-CA-C 118.176 2.658 . . . . 0.0 118.176 171.65 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 43' ' ' SER . . . . . . . . . . . . . 64.1 p -123.78 6.38 8.76 Favored 'General case' 0 N--CA 1.496 1.865 0 N-CA-C 117.076 2.25 . . . . 0.0 117.076 163.421 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 44' ' ' LYS . . . . . . . . . . . . 0.51 96.4 mttt 71.23 -102.69 0.0 OUTLIER Pre-proline 0 CA--C 1.591 2.531 0 N-CA-C 117.412 2.375 . . . . 0.0 117.412 149.197 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 70.7 Cg_endo -79.81 116.14 3.43 Favored 'Trans proline' 0 CA--C 1.568 2.218 0 CA-C-N 126.948 3.517 . . . . 0.0 118.51 -163.694 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 46' ' ' SER . . . . . . . . . . . . . 36.5 m -74.54 125.95 89.2 Favored Pre-proline 0 CA--C 1.582 2.178 0 CA-C-O 117.874 -1.06 . . . . 0.0 110.141 135.438 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -74.47 95.64 0.95 Allowed 'Trans proline' 0 CA--C 1.569 2.254 0 CA-C-N 123.028 2.117 . . . . 0.0 116.98 -160.764 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 48' ' ' VAL . . . . . . . . . . . . 0.285 97.0 t -85.58 -59.47 2.75 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.098 0 N-CA-C 113.194 0.813 . . . . 0.0 113.194 170.821 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 49' ' ' THR . . . . . . . . . . . . . 11.5 m -131.93 85.43 2.25 Favored 'General case' 0 CA--C 1.572 1.807 2 O-C-N 112.199 -6.563 . . . . 0.0 110.057 -2.922 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 50' ' ' GLY . . . . . . . . . . . . . . . -94.87 61.97 1.61 Allowed Glycine 0 N--CA 1.503 3.116 0 O-C-N 120.15 -1.594 . . . . 0.0 113.858 159.067 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 51' ' ' TYR . . . . . . . . . . . . . 22.3 m-30 -135.34 85.86 2.2 Favored 'General case' 0 CA--C 1.569 1.71 0 CA-C-O 121.46 0.647 . . . . 0.0 109.676 -166.268 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 52' ' ' ARG . . . . . . . . . . . . . 8.0 tpm_? -141.72 127.03 18.66 Favored 'General case' 0 N--CA 1.503 2.214 0 O-C-N 120.61 -1.306 . . . . 0.0 112.201 160.347 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -178.09 176.21 1.16 Allowed 'General case' 0 N--CA 1.501 2.078 0 N-CA-C 118.034 2.605 . . . . 0.0 118.034 -147.227 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . 0.484 0.0 OUTLIER -89.81 42.7 1.11 Allowed 'General case' 0 CA--C 1.563 1.475 0 CA-C-O 127.799 3.666 . . . . 0.0 116.868 172.519 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 55' ' ' ALA . . . . . . . . . . . . 0.302 . . -67.32 -23.42 65.63 Favored 'General case' 0 CA--C 1.587 2.382 0 O-C-N 116.713 -3.742 . . . . 0.0 118.58 117.319 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -50.22 5.93 0.0 OUTLIER 'General case' 0 CA--C 1.598 2.808 0 N-CA-C 120.371 3.471 . . . . 0.0 120.371 137.144 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 57' ' ' ARG . . . . . . . . . . . . . 35.7 ttp180 -104.81 -49.79 3.43 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 119.311 -2.118 . . . . 0.0 114.433 163.894 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 58' ' ' LEU . . . . . . . . . . . . 0.558 0.0 OUTLIER -56.9 -26.18 58.6 Favored 'General case' 0 CA--C 1.586 2.339 0 CA-C-N 121.726 2.057 . . . . 0.0 114.043 169.577 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 59' ' ' ALA . . . . . . . . . . . . . . . -36.51 -96.19 0.0 OUTLIER 'General case' 0 CA--C 1.569 1.707 0 N-CA-C 121.701 3.963 . . . . 0.0 121.701 131.304 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -77.8 -4.88 48.72 Favored 'General case' 0 N--CA 1.483 1.221 0 N-CA-C 117.189 2.292 . . . . 0.0 117.189 -163.008 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 61' ' ' GLU . . . . . . . . . . . . 0.322 0.6 OUTLIER -99.64 -15.98 18.38 Favored 'General case' 0 CA--C 1.557 1.232 0 CA-C-O 114.202 -2.808 . . . . 0.0 114.834 161.392 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 62' ' ' GLN . . . . . . . . . . . . 0.327 0.0 OUTLIER -80.61 -18.94 46.65 Favored 'General case' 0 CA--C 1.583 2.214 1 CA-C-N 127.502 4.683 . . . . 0.0 113.349 161.792 . . . . . . . . 4 3 . 1 . 001 nuclear orig full ' B' B ' 63' ' ' SER . . . . . . . . . . . . 1.287 7.9 t -139.87 -8.67 1.21 Allowed 'General case' 0 CA--C 1.58 2.122 0 C-N-CA 129.794 3.238 . . . . 0.0 117.77 -159.849 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 64' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -114.53 51.07 0.91 Allowed 'General case' 0 CA--C 1.576 1.951 0 O-C-N 119.408 -2.058 . . . . 0.0 112.127 119.953 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 65' ' ' LEU . . . . . . . . . . . . 0.352 20.4 mt -113.48 -60.63 1.86 Allowed 'General case' 0 N--CA 1.514 2.763 0 O-C-N 118.663 -2.523 . . . . 0.0 112.692 127.246 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 66' ' ' VAL . . . . . . . . . . . . 0.379 0.1 OUTLIER . . . . . 0 N--CA 1.513 2.711 0 N-CA-C 121.459 3.874 . . . . 0.0 121.459 161.642 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.566 1.57 0 N-CA-C 117.64 2.459 . . . . 0.0 117.64 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . 0.275 15.2 mmp_? 57.69 44.31 20.8 Favored 'General case' 0 N--CA 1.504 2.244 0 N-CA-C 117.738 2.496 . . . . 0.0 117.738 170.406 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 6.8 p-10 -139.59 65.84 1.42 Allowed 'General case' 0 CA--C 1.564 1.501 0 N-CA-C 107.296 -1.372 . . . . 0.0 107.296 173.344 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 1.8 p30 -167.29 84.81 0.82 Allowed Pre-proline 0 CA--C 1.567 1.601 0 O-C-N 120.771 -1.205 . . . . 0.0 112.178 -161.092 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_exo -97.31 136.84 0.43 Allowed 'Trans proline' 0 CA--C 1.552 1.411 0 CA-C-N 122.296 1.856 . . . . 0.0 113.256 -161.995 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 75.2 m80 -81.1 122.01 26.81 Favored 'General case' 0 CA--C 1.573 1.841 0 CA-C-N 114.263 -1.335 . . . . 0.0 110.571 174.539 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 1.5 p90 -125.56 157.82 36.14 Favored 'General case' 0 CA--C 1.567 1.631 0 O-C-N 119.984 -1.698 . . . . 0.0 112.184 159.408 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 83.9 m-20 -68.96 103.45 1.83 Allowed 'General case' 0 CA--C 1.57 1.723 0 O-C-N 120.893 -1.129 . . . . 0.0 112.613 176.034 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 5.6 t80 -124.47 104.95 9.03 Favored 'General case' 0 CA--C 1.537 0.48 0 N-CA-C 107.328 -1.36 . . . . 0.0 107.328 162.337 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . 0.478 0.1 OUTLIER 93.93 85.55 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.781 1 O-C-N 113.686 -5.634 . . . . 0.0 110.843 -12.54 . . . . . . . . 4 3 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 15.7 mtt -157.14 134.33 6.74 Favored Pre-proline 0 CA--C 1.57 1.738 0 CA-C-O 117.777 -1.106 . . . . 0.0 111.813 -154.715 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 67.8 Cg_exo -49.4 156.35 2.76 Favored 'Trans proline' 0 CA--C 1.564 2.022 0 C-N-CA 123.106 2.537 . . . . 0.0 118.277 167.191 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 9.0 tpp -62.7 -41.65 99.24 Favored 'General case' 0 N--CA 1.488 1.443 0 N-CA-C 116.793 2.146 . . . . 0.0 116.793 -161.579 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 -61.23 -38.72 87.64 Favored 'General case' 0 CA--C 1.565 1.54 0 N-CA-C 115.991 1.848 . . . . 0.0 115.991 165.635 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 1.5 t -58.46 -43.85 87.64 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.077 0 CA-C-N 122.267 2.303 . . . . 0.0 114.983 175.943 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . 0.535 0.1 OUTLIER -117.73 22.25 12.44 Favored 'General case' 0 N--CA 1.483 1.205 0 N-CA-C 119.35 3.093 . . . . 0.0 119.35 171.922 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -66.75 -45.62 77.99 Favored 'General case' 0 CA--C 1.565 1.537 0 O-C-N 118.54 -2.6 . . . . 0.0 113.278 121.201 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . 0.256 46.2 mtmt -63.8 -52.6 59.54 Favored 'General case' 0 N--CA 1.489 1.494 0 CA-C-N 122.535 2.425 . . . . 0.0 116.079 177.454 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 11.7 tp -68.36 -35.55 77.9 Favored 'General case' 0 CA--C 1.564 1.494 0 C-N-CA 124.945 1.298 . . . . 0.0 113.556 173.078 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 2.3 ttpt -87.02 -24.02 24.79 Favored 'General case' 0 CA--C 1.572 1.813 0 CA-C-N 121.309 1.868 . . . . 0.0 114.31 178.667 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 13.9 m-85 -65.34 -68.87 0.33 Allowed 'General case' 0 N--CA 1.488 1.456 0 CA-C-O 114.365 -2.731 . . . . 0.0 111.15 154.887 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . 0.291 24.4 ttt180 -25.46 -48.53 0.02 OUTLIER 'General case' 0 CA--C 1.591 2.528 0 CA-C-N 125.363 3.71 . . . . 0.0 115.94 165.521 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -57.58 -76.56 0.04 OUTLIER 'General case' 0 CA--C 1.589 2.476 0 N-CA-C 117.523 2.416 . . . . 0.0 117.523 157.446 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 36.7 mt-10 -60.45 -49.48 77.38 Favored 'General case' 0 N--CA 1.507 2.378 0 N-CA-C 118.512 2.782 . . . . 0.0 118.512 178.201 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -40.74 -51.14 3.11 Favored 'General case' 0 CA--C 1.588 2.439 0 N-CA-C 116.777 2.14 . . . . 0.0 116.777 162.103 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 86.1 m-20 -83.36 -46.69 12.28 Favored 'General case' 0 N--CA 1.501 2.087 0 N-CA-C 116.108 1.892 . . . . 0.0 116.108 177.201 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 116.61 31.03 1.88 Allowed Glycine 0 CA--C 1.561 2.957 0 N-CA-C 118.08 1.992 . . . . 0.0 118.08 -157.066 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 37.5 mtm-85 -120.13 162.77 18.76 Favored 'General case' 0 CA--C 1.572 1.797 0 N-CA-C 106.546 -1.649 . . . . 0.0 106.546 168.881 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 33.5 m -122.77 113.34 19.05 Favored 'General case' 0 N--CA 1.503 2.206 0 O-C-N 118.457 -2.652 . . . . 0.0 104.835 -176.478 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 24.4 mtp -44.54 -41.27 6.31 Favored 'General case' 0 N--CA 1.501 2.105 0 N-CA-C 119.486 3.143 . . . . 0.0 119.486 -143.408 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -48.0 -41.53 25.63 Favored 'General case' 0 CA--C 1.595 2.682 0 CA-C-N 124.794 3.452 . . . . 0.0 115.071 165.226 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . 0.291 67.3 m -55.31 -61.34 2.4 Favored 'General case' 0 N--CA 1.503 2.201 0 N-CA-C 120.686 3.587 . . . . 0.0 120.686 145.98 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 11.5 tp10 -62.78 -60.56 3.33 Favored 'General case' 0 N--CA 1.523 3.217 0 CA-C-N 125.096 3.589 . . . . 0.0 115.731 178.709 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -41.16 -55.29 2.68 Favored 'General case' 0 CA--C 1.546 0.816 0 CA-C-O 115.587 -2.149 . . . . 0.0 108.214 170.473 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 15.9 mt -61.66 -51.19 69.46 Favored 'General case' 0 C--N 1.37 1.489 0 CA-C-N 123.074 2.67 . . . . 0.0 114.412 176.528 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -54.49 -42.28 70.56 Favored 'General case' 0 CA--C 1.567 1.632 0 N-CA-C 115.675 1.732 . . . . 0.0 115.675 175.68 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 5.3 tp -72.92 -29.16 28.46 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.958 0 CA-C-N 122.301 2.319 . . . . 0.0 116.636 166.484 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 8.1 t -80.01 -50.11 18.15 Favored 'Isoleucine or valine' 0 CA--C 1.58 2.118 0 C-N-CA 126.683 1.993 . . . . 0.0 110.042 -178.238 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 26.0 mt-30 -48.09 -40.96 24.96 Favored 'General case' 0 N--CA 1.488 1.429 0 N-CA-C 114.476 1.287 . . . . 0.0 114.476 153.836 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . 0.335 79.2 m-20 -50.5 -62.73 1.42 Allowed 'General case' 0 N--CA 1.491 1.595 0 CA-C-N 120.415 1.461 . . . . 0.0 114.142 154.029 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . 0.285 . . -52.82 -33.03 47.3 Favored 'General case' 0 CA--C 1.562 1.409 0 N-CA-C 119.184 3.031 . . . . 0.0 119.184 -171.326 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 10.7 mt -95.71 -36.92 11.01 Favored 'General case' 0 CA--C 1.571 1.77 0 C-N-CA 125.887 1.675 . . . . 0.0 114.587 174.626 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 6.0 t -92.16 4.78 52.48 Favored 'General case' 0 N--CA 1.497 1.908 0 N-CA-C 119.233 3.049 . . . . 0.0 119.233 -177.306 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . 0.716 0.7 OUTLIER 80.22 -106.59 0.0 OUTLIER Pre-proline 0 CA--C 1.599 2.853 0 N-CA-C 120.548 3.536 . . . . 0.0 120.548 147.465 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 24.3 Cg_endo -70.54 136.16 30.29 Favored 'Trans proline' 0 C--N 1.375 1.957 0 CA-C-N 127.648 3.767 . . . . 0.0 118.654 -160.845 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 8.7 t -70.68 149.74 95.33 Favored Pre-proline 0 CA--C 1.575 1.924 0 CA-C-N 114.255 -1.339 . . . . 0.0 113.004 145.269 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 85.0 Cg_endo -75.09 81.78 2.16 Favored 'Trans proline' 0 CA--C 1.571 2.33 0 CA-C-N 123.732 2.369 . . . . 0.0 112.818 167.379 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . 0.394 59.2 t -127.48 -96.5 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.506 2.326 0 CA-C-O 117.908 -1.044 . . . . 0.0 110.866 -176.56 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 1.4 p -142.07 86.15 1.96 Allowed 'General case' 0 N--CA 1.496 1.87 2 O-C-N 110.386 -7.696 . . . . 0.0 111.684 5.022 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -79.36 -23.32 63.22 Favored Glycine 0 N--CA 1.502 3.07 0 N-CA-C 117.724 1.85 . . . . 0.0 117.724 143.329 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 29.6 m-85 -58.61 116.99 4.05 Favored 'General case' 0 CA--C 1.582 2.202 0 CA-C-N 119.054 1.427 . . . . 0.0 111.586 148.48 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 76.6 mtp180 -132.43 94.78 3.49 Favored 'General case' 0 N--CA 1.509 2.486 0 CA-C-N 120.451 1.478 . . . . 0.0 113.385 170.258 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . 0.532 0.9 OUTLIER -47.77 119.46 2.82 Favored 'General case' 0 N--CA 1.494 1.751 0 N-CA-C 115.631 1.715 . . . . 0.0 115.631 -164.216 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . 1.313 4.6 p30 68.59 3.49 3.87 Favored 'General case' 0 N--CA 1.495 1.815 2 N-CA-C 123.055 4.465 . . . . 0.0 123.055 12.766 . . . . . . . . 3 2 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . 0.579 . . -116.16 12.19 15.43 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 117.367 -3.333 . . . . 0.0 119.982 124.347 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . 0.297 9.2 tt0 -34.58 -13.12 0.0 OUTLIER 'General case' 0 CA--C 1.606 3.101 1 N-CA-C 124.01 4.819 . . . . 0.0 124.01 99.557 . . . . . . . . 3 2 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 3.1 tmt_? -115.35 -35.95 4.47 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 118.616 -2.553 . . . . 0.0 113.777 170.148 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -51.11 -35.09 33.58 Favored 'General case' 0 N--CA 1.514 2.758 0 CA-C-N 122.618 2.463 . . . . 0.0 115.131 148.363 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -46.01 -80.66 0.01 OUTLIER 'General case' 0 N--CA 1.481 1.12 0 CA-C-O 115.616 -2.135 . . . . 0.0 114.071 148.0 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -63.73 -11.71 28.59 Favored 'General case' 0 N--CA 1.493 1.719 0 CA-C-N 124.132 3.151 . . . . 0.0 117.752 -169.207 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . 0.298 23.8 tt0 -70.67 -55.04 9.62 Favored 'General case' 0 CA--C 1.553 1.095 0 CA-C-O 117.042 -1.456 . . . . 0.0 113.268 162.367 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . 0.378 2.4 mm-40 -82.44 -56.35 3.94 Favored 'General case' 0 N--CA 1.495 1.798 0 CA-C-N 123.011 2.641 . . . . 0.0 112.706 170.616 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . 0.457 0.3 OUTLIER -52.79 -10.32 0.16 Allowed 'General case' 0 CA--C 1.578 2.046 0 N-CA-C 121.613 3.931 . . . . 0.0 121.613 168.277 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 12.5 tt0 -95.49 -37.76 10.75 Favored 'General case' 0 N--CA 1.499 1.986 0 CA-C-N 124.145 3.157 . . . . 0.0 114.513 151.13 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 15.2 mt -90.84 12.97 17.69 Favored 'General case' 0 N--CA 1.504 2.246 0 CA-C-N 121.322 1.874 . . . . 0.0 115.923 -175.018 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 6.8 m . . . . . 0 N--CA 1.503 2.186 0 C-N-CA 126.043 1.737 . . . . 0.0 111.941 177.602 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.564 1.517 0 N-CA-C 114.635 1.346 . . . . 0.0 114.635 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 2' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -97.83 66.38 1.9 Allowed 'General case' 0 N--CA 1.498 1.946 1 O-C-N 113.684 -5.635 . . . . 0.0 111.718 -9.404 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -126.8 79.56 1.88 Allowed 'General case' 0 N--CA 1.491 1.592 0 O-C-N 120.78 -1.2 . . . . 0.0 107.927 -179.732 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 4' ' ' ASP . . . . . . . . . . . . . 2.2 p30 -141.25 78.54 18.75 Favored Pre-proline 0 N--CA 1.487 1.422 0 O-C-N 121.223 -0.923 . . . . 0.0 112.169 171.294 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 4.8 Cg_exo -96.84 160.51 1.1 Allowed 'Trans proline' 0 CA--C 1.553 1.461 0 C-N-CA 121.955 1.77 . . . . 0.0 113.123 -160.01 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 6' ' ' HIS . . . . . . . . . . . . . 76.3 m80 -76.7 141.14 41.02 Favored 'General case' 0 CA--C 1.56 1.347 0 CA-C-N 113.517 -1.674 . . . . 0.0 113.184 -178.157 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 7' ' ' PHE . . . . . . . . . . . . 0.266 27.7 p90 -121.29 167.54 12.62 Favored 'General case' 0 CA--C 1.564 1.497 0 O-C-N 119.838 -1.789 . . . . 0.0 110.285 116.972 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 8' ' ' ASN . . . . . . . . . . . . . 16.7 m120 -84.39 94.01 8.4 Favored 'General case' 0 N--CA 1.486 1.354 0 O-C-N 119.479 -2.013 . . . . 0.0 108.062 164.211 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 9' ' ' PHE . . . . . 0.517 ' CD2' ' SD ' ' B' ' 11' ' ' MET . 5.7 t80 -68.41 162.73 24.79 Favored 'General case' 0 CA--C 1.557 1.229 0 CA-C-O 124.486 2.089 . . . . 0.0 110.824 158.957 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 10' ' ' ARG . . . . . . . . . . . . . 28.1 tpt85 177.08 97.93 0.01 OUTLIER 'General case' 0 N--CA 1.486 1.374 0 CA-C-N 113.385 -1.734 . . . . 0.0 106.713 -126.463 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 11' ' ' MET . . . . . 0.517 ' SD ' ' CD2' ' B' ' 9' ' ' PHE . 0.7 OUTLIER -122.64 120.51 27.81 Favored Pre-proline 0 CA--C 1.563 1.47 0 CA-C-O 117.049 -1.453 . . . . 0.0 110.864 -161.269 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 12' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_exo -44.91 149.78 1.08 Allowed 'Trans proline' 0 CA--C 1.566 2.123 0 CA-C-N 123.702 2.358 . . . . 0.0 116.051 159.942 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 13' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -54.14 -41.96 68.98 Favored 'General case' 0 N--CA 1.498 1.964 0 N-CA-C 117.374 2.361 . . . . 0.0 117.374 -157.501 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 9.1 pt-20 -63.46 -39.26 93.99 Favored 'General case' 0 CA--C 1.564 1.508 0 N-CA-C 116.54 2.052 . . . . 0.0 116.54 168.747 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -61.16 -46.38 96.75 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.091 0 CA-C-N 123.04 2.655 . . . . 0.0 113.421 172.259 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 2.1 ttt180 -74.7 -39.99 61.62 Favored 'General case' 0 C--O 1.218 -0.592 0 CA-C-O 116.353 -1.784 . . . . 0.0 115.027 174.419 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 17' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -58.91 -38.13 78.21 Favored 'General case' 0 CA--C 1.566 1.585 0 CA-C-N 123.386 2.812 . . . . 0.0 114.371 163.604 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . 0.309 50.5 mtmt -67.93 -50.04 58.37 Favored 'General case' 0 CA--C 1.566 1.591 0 CA-C-N 121.6 2.0 . . . . 0.0 115.227 170.347 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 19' ' ' LEU . . . . . . . . . . . . 0.322 13.3 tp -67.82 -37.77 82.39 Favored 'General case' 0 CA--C 1.574 1.872 0 CA-C-N 121.024 1.738 . . . . 0.0 114.336 174.458 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 20' ' ' LYS . . . . . . . . . . . . . 29.2 ttpt -88.5 -27.02 21.74 Favored 'General case' 0 CA--C 1.566 1.595 0 O-C-N 120.466 -1.396 . . . . 0.0 113.996 -179.988 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 19.9 m-30 -62.59 -70.5 0.2 Allowed 'General case' 0 N--CA 1.493 1.684 0 CA-C-O 113.607 -3.092 . . . . 0.0 110.27 155.326 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . 0.288 53.5 ttt180 -20.5 -53.07 0.01 OUTLIER 'General case' 0 CA--C 1.593 2.624 0 CA-C-N 125.751 3.887 . . . . 0.0 116.882 165.016 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -54.22 -75.74 0.03 OUTLIER 'General case' 0 CA--C 1.589 2.475 0 N-CA-C 119.06 2.985 . . . . 0.0 119.06 157.091 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 -68.95 -39.13 79.69 Favored 'General case' 0 N--CA 1.502 2.137 0 N-CA-C 118.897 2.925 . . . . 0.0 118.897 -179.55 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 25' ' ' ALA . . . . . . . . . . . . . . . -38.97 -48.96 1.66 Allowed 'General case' 0 CA--C 1.581 2.137 0 N-CA-C 116.92 2.193 . . . . 0.0 116.92 156.08 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 26' ' ' ASN . . . . . . . . . . . . 0.299 0.0 OUTLIER -112.19 -47.8 3.08 Favored 'General case' 0 CA--C 1.578 2.047 0 N-CA-C 115.066 1.506 . . . . 0.0 115.066 -163.036 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 27' ' ' GLY . . . . . . . . . . . . . . . 148.66 44.65 0.03 OUTLIER Glycine 0 N--CA 1.5 2.926 0 N-CA-C 118.189 2.036 . . . . 0.0 118.189 176.472 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 28' ' ' ARG . . . . . . . . . . . . 0.334 1.1 ptt180 -156.92 153.44 28.12 Favored 'General case' 0 N--CA 1.495 1.797 0 N-CA-C 105.586 -2.005 . . . . 0.0 105.586 -173.115 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 29' ' ' SER . . . . . . . . . . . . . 75.1 p -119.77 110.5 16.86 Favored 'General case' 0 N--CA 1.502 2.126 0 O-C-N 118.312 -2.743 . . . . 0.0 105.638 -168.547 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 30' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -39.85 -43.96 1.55 Allowed 'General case' 0 N--CA 1.493 1.703 0 N-CA-C 120.651 3.574 . . . . 0.0 120.651 -143.557 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 31' ' ' ASN . . . . . . . . . . . . . 12.1 t-20 -44.4 -45.77 9.13 Favored 'General case' 0 CA--C 1.594 2.639 0 CA-C-N 124.029 3.104 . . . . 0.0 114.699 164.42 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 32' ' ' SER . . . . . . . . . . . . 0.326 30.9 t -50.61 -68.54 0.16 Allowed 'General case' 0 N--CA 1.5 2.044 0 N-CA-C 119.591 3.182 . . . . 0.0 119.591 144.561 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 10.5 tm-20 -60.93 -58.44 8.41 Favored 'General case' 0 N--CA 1.515 2.793 0 N-CA-C 118.508 2.781 . . . . 0.0 118.508 -177.186 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -39.91 -54.16 2.22 Favored 'General case' 0 CA--C 1.563 1.448 0 CA-C-O 116.46 -1.733 . . . . 0.0 107.305 166.2 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 35' ' ' LEU . . . . . . . . . . . . . 9.3 mt -63.26 -61.79 2.12 Favored 'General case' 0 C--N 1.371 1.53 0 CA-C-N 123.563 2.892 . . . . 0.0 115.977 -174.627 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 36' ' ' GLN . . . . . . . . . . . . 0.489 0.0 OUTLIER -60.76 -25.08 66.23 Favored 'General case' 0 CA--C 1.571 1.757 0 N-CA-C 115.352 1.612 . . . . 0.0 115.352 177.917 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 37' ' ' ILE . . . . . . . . . . . . . 1.9 tp -77.62 -32.57 18.34 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.788 0 CA-C-N 121.788 2.085 . . . . 0.0 116.24 163.833 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 38' ' ' VAL . . . . . . . . . . . . . 4.3 t -74.38 -50.38 27.45 Favored 'Isoleucine or valine' 0 CA--C 1.572 1.79 0 C-N-CA 127.942 2.497 . . . . 0.0 110.94 178.494 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 30.2 mt-30 -40.1 -49.23 2.57 Favored 'General case' 0 CA--C 1.567 1.601 0 N-CA-C 114.97 1.47 . . . . 0.0 114.97 149.798 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 40' ' ' ASP . . . . . . . . . . . . 0.339 1.5 t0 -57.45 -38.63 74.77 Favored 'General case' 0 CA--C 1.572 1.815 0 N-CA-C 118.241 2.682 . . . . 0.0 118.241 160.903 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -72.99 -34.63 66.54 Favored 'General case' 0 CA--C 1.564 1.515 0 N-CA-C 116.914 2.19 . . . . 0.0 116.914 -176.83 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 12.8 mt -89.94 -46.97 8.16 Favored 'General case' 0 CA--C 1.56 1.334 0 C-N-CA 126.086 1.754 . . . . 0.0 113.185 176.776 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 43' ' ' SER . . . . . . . . . . . . . 8.6 t -71.12 -35.85 71.91 Favored 'General case' 0 N--CA 1.494 1.733 0 N-CA-C 116.24 1.941 . . . . 0.0 116.24 175.151 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 44' ' ' LYS . . . . . . . . . . . . 0.504 37.8 mtmm 63.46 -128.72 0.0 OUTLIER Pre-proline 0 CA--C 1.594 2.643 0 CA-C-O 114.013 -2.898 . . . . 0.0 113.406 176.844 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 76.7 Cg_endo -86.31 111.59 1.06 Allowed 'Trans proline' 0 CA--C 1.568 2.221 1 CA-C-N 128.641 4.122 . . . . 0.0 118.405 -170.155 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 46' ' ' SER . . . . . . . . . . . . . 67.5 m -75.69 124.54 88.81 Favored Pre-proline 0 CA--C 1.584 2.265 0 CA-C-O 117.225 -1.369 . . . . 0.0 110.462 131.576 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 87.8 Cg_exo -55.07 95.4 0.05 OUTLIER 'Trans proline' 0 CA--C 1.573 2.448 0 N-CA-C 119.176 2.721 . . . . 0.0 119.176 -177.333 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 48' ' ' VAL . . . . . . . . . . . . . 4.3 p -107.01 -9.43 10.66 Favored 'Isoleucine or valine' 0 N--CA 1.518 2.946 0 N-CA-C 117.772 2.508 . . . . 0.0 117.772 -176.003 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 49' ' ' THR . . . . . . . . . . . . . 3.0 t -123.25 142.75 50.6 Favored 'General case' 0 N--CA 1.494 1.752 0 N-CA-C 116.55 2.055 . . . . 0.0 116.55 -113.055 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 50' ' ' GLY . . . . . . . . . . . . . . . -106.19 31.55 8.23 Favored Glycine 0 N--CA 1.501 3.028 0 N-CA-C 118.589 2.195 . . . . 0.0 118.589 159.503 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 51' ' ' TYR . . . . . . . . . . . . 0.379 0.0 OUTLIER -164.52 -34.09 0.03 OUTLIER 'General case' 0 N--CA 1.507 2.403 0 N-CA-C 116.496 2.035 . . . . 0.0 116.496 -172.858 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 52' ' ' ARG . . . . . . . . . . . . . 1.4 tmt_? 64.53 115.83 0.02 OUTLIER 'General case' 0 N--CA 1.507 2.376 0 C-N-CA 125.934 1.693 . . . . 0.0 114.659 177.419 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . 0.391 0.1 OUTLIER -63.12 115.24 4.29 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 119.356 -2.09 . . . . 0.0 109.669 173.251 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . 1.631 0.6 OUTLIER 47.95 13.52 0.04 OUTLIER 'General case' 0 CA--C 1.597 2.769 2 O-C-N 114.553 -5.092 . . . . 0.0 123.969 14.226 . . . . . . . . 4 3 . 1 . 002 nuclear orig full ' B' B ' 55' ' ' ALA . . . . . . . . . . . . 0.278 . . -126.06 -0.58 7.17 Favored 'General case' 0 CA--C 1.561 1.404 1 O-C-N 116.031 -4.168 . . . . 0.0 118.087 143.152 . . . . . . . . 3 2 . 1 . 002 nuclear orig full ' B' B ' 56' ' ' GLU . . . . . . . . . . . . 0.29 9.5 tp10 -16.66 -30.12 0.0 OUTLIER 'General case' 0 CA--C 1.614 3.404 1 N-CA-C 125.705 5.446 . . . . 0.0 125.705 89.444 . . . . . . . . 3 2 . 1 . 002 nuclear orig full ' B' B ' 57' ' ' ARG . . . . . . . . . . . . . 2.1 ttp180 -77.65 -57.87 3.58 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 118.255 -2.778 . . . . 0.0 112.81 158.241 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 58' ' ' LEU . . . . . . . . . . . . 0.536 0.0 OUTLIER -63.37 -28.62 70.12 Favored 'General case' 0 N--CA 1.506 2.355 0 CA-C-N 121.372 1.896 . . . . 0.0 115.975 175.782 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 59' ' ' ALA . . . . . . . . . . . . . . . -37.57 -60.09 0.73 Allowed 'General case' 0 N--CA 1.49 1.556 0 N-CA-C 117.762 2.504 . . . . 0.0 117.762 144.286 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -78.99 3.88 15.93 Favored 'General case' 0 CA--C 1.555 1.172 0 N-CA-C 116.849 2.166 . . . . 0.0 116.849 172.119 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 38.4 tt0 -65.01 -75.99 0.08 Allowed 'General case' 0 N--CA 1.477 0.905 0 CA-C-O 116.216 -1.849 . . . . 0.0 109.009 153.143 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 62' ' ' GLN . . . . . . . . . . . . 0.368 0.0 OUTLIER -69.08 -55.73 9.86 Favored 'General case' 0 N--CA 1.482 1.173 0 CA-C-N 122.6 2.455 . . . . 0.0 113.177 -176.848 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 63' ' ' SER . . . . . . . . . . . . 0.349 48.2 t -86.01 41.28 0.91 Allowed 'General case' 0 CA--C 1.571 1.754 0 N-CA-C 118.25 2.685 . . . . 0.0 118.25 171.474 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 64' ' ' GLU . . . . . . . . . . . . . 27.4 tt0 -97.44 -45.03 6.6 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 119.457 -2.027 . . . . 0.0 111.676 121.565 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 13.9 mt -64.05 -24.67 67.79 Favored 'General case' 0 CA--C 1.579 2.083 0 N-CA-C 117.008 2.225 . . . . 0.0 117.008 -178.498 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 66' ' ' VAL . . . . . . . . . . . . . 1.5 m . . . . . 0 N--CA 1.505 2.317 0 N-CA-C 116.764 2.135 . . . . 0.0 116.764 174.766 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.566 1.564 0 N-CA-C 115.767 1.766 . . . . 0.0 115.767 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . 0.417 ' O ' ' SD ' ' B' ' 13' ' ' MET 0.352 55.4 ptt85 46.17 41.72 9.01 Favored 'General case' 0 N--CA 1.503 2.201 0 N-CA-C 120.324 3.453 . . . . 0.0 120.324 -177.897 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 3.8 p-10 -117.8 133.31 56.07 Favored 'General case' 0 CA--C 1.554 1.103 0 N-CA-C 104.622 -2.362 . . . . 0.0 104.622 169.371 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 21.7 p-10 -153.8 94.51 2.91 Favored Pre-proline 0 CA--C 1.572 1.823 1 O-C-N 113.459 -5.775 . . . . 0.0 111.241 39.967 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 23.6 Cg_exo -84.03 154.75 13.0 Favored 'Trans proline' 0 CA--C 1.557 1.633 0 CA-C-N 122.4 1.893 . . . . 0.0 116.374 -159.661 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 77.1 m80 -86.37 137.08 32.85 Favored 'General case' 0 CA--C 1.561 1.386 0 CA-C-N 114.04 -1.436 . . . . 0.0 113.568 -175.138 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 1.6 p90 -139.28 140.45 37.65 Favored 'General case' 0 N--CA 1.485 1.293 0 O-C-N 120.751 -1.218 . . . . 0.0 108.409 137.583 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 39.9 m-20 -73.92 100.86 3.63 Favored 'General case' 0 CA--C 1.563 1.458 0 O-C-N 120.434 -1.416 . . . . 0.0 111.469 -178.424 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 5.3 t80 -79.65 77.0 6.28 Favored 'General case' 0 CA--C 1.576 1.953 0 CA-C-O 127.683 3.611 . . . . 0.0 111.216 169.593 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . 0.283 28.8 ptt180 -47.04 138.65 6.43 Favored 'General case' 0 N--CA 1.478 0.936 0 CA-C-N 109.577 -3.465 . . . . 0.0 118.011 130.238 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 9.1 mtt -147.75 138.07 12.7 Favored Pre-proline 0 CA--C 1.572 1.791 0 CA-C-N 112.928 -1.942 . . . . 0.0 110.204 -176.326 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 87.1 Cg_exo -41.46 142.61 1.08 Allowed 'Trans proline' 0 C--N 1.375 1.944 0 C-N-CA 123.627 2.885 . . . . 0.0 116.497 167.588 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 1.7 tpt -44.3 -38.03 3.64 Favored 'General case' 0 CA--C 1.569 1.711 0 N-CA-C 119.675 3.213 . . . . 0.0 119.675 -167.001 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -61.96 -47.13 86.25 Favored 'General case' 0 N--CA 1.486 1.342 0 N-CA-C 117.548 2.425 . . . . 0.0 117.548 167.734 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -67.37 -42.44 87.43 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.911 0 CA-C-N 122.949 2.613 . . . . 0.0 112.509 173.262 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . 0.318 0.0 OUTLIER -79.15 -29.24 42.95 Favored 'General case' 0 N--CA 1.486 1.329 0 CA-C-N 123.078 2.672 . . . . 0.0 116.313 176.083 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -67.42 -44.76 77.98 Favored 'General case' 0 N--CA 1.49 1.533 0 CA-C-N 123.38 2.809 . . . . 0.0 113.254 156.926 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . 0.552 8.8 pttt -74.02 -31.73 63.05 Favored 'General case' 0 N--CA 1.484 1.25 0 N-CA-C 116.643 2.09 . . . . 0.0 116.643 179.366 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . 0.294 0.9 OUTLIER -69.07 -43.79 73.87 Favored 'General case' 0 N--CA 1.492 1.634 0 CA-C-N 122.764 2.529 . . . . 0.0 113.624 162.004 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 1.5 ttpt -77.38 -38.92 49.01 Favored 'General case' 0 CA--C 1.562 1.428 0 N-CA-C 115.158 1.54 . . . . 0.0 115.158 -177.919 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 29.4 m-85 -55.86 -77.71 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.573 0 CA-C-O 113.408 -3.187 . . . . 0.0 110.832 154.557 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . 0.331 0.0 OUTLIER -28.72 -48.73 0.06 Allowed 'General case' 0 CA--C 1.589 2.463 1 CA-C-N 126.117 4.053 . . . . 0.0 117.113 176.053 . . . . . . . . 4 3 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -47.54 -77.65 0.02 OUTLIER 'General case' 0 CA--C 1.586 2.334 0 N-CA-C 120.54 3.533 . . . . 0.0 120.54 152.254 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 54.2 mm-40 -64.58 -40.26 95.23 Favored 'General case' 0 N--CA 1.499 2.005 0 N-CA-C 118.603 2.816 . . . . 0.0 118.603 179.188 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -38.22 -48.35 1.27 Allowed 'General case' 0 CA--C 1.575 1.942 0 N-CA-C 117.961 2.578 . . . . 0.0 117.961 154.628 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . 0.259 0.0 OUTLIER -105.6 -42.86 5.08 Favored 'General case' 0 CA--C 1.575 1.92 0 N-CA-C 116.38 1.993 . . . . 0.0 116.38 -167.177 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 130.95 16.56 1.58 Allowed Glycine 0 N--CA 1.497 2.705 0 N-CA-C 119.649 2.62 . . . . 0.0 119.649 -172.559 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . 0.288 18.3 mtm-85 -121.4 143.07 49.42 Favored 'General case' 0 N--CA 1.5 2.034 0 N-CA-C 102.688 -3.079 . . . . 0.0 102.688 166.526 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 23.2 t -115.92 112.71 22.27 Favored 'General case' 0 N--CA 1.509 2.492 0 O-C-N 116.617 -3.802 . . . . 0.0 108.818 -164.8 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 25.6 mtp -42.62 -45.29 4.56 Favored 'General case' 0 N--CA 1.501 2.077 0 N-CA-C 119.474 3.139 . . . . 0.0 119.474 -134.707 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 18.7 t-20 -47.15 -43.56 21.08 Favored 'General case' 0 CA--C 1.6 2.888 1 O-C-N 115.928 -4.233 . . . . 0.0 114.816 165.088 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . 0.291 13.6 t -53.18 -72.24 0.06 Allowed 'General case' 0 N--CA 1.502 2.161 0 N-CA-C 117.306 2.336 . . . . 0.0 117.306 143.384 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 4.5 tm-20 -68.41 -45.62 72.13 Favored 'General case' 0 N--CA 1.504 2.256 0 CA-C-N 124.471 3.305 . . . . 0.0 119.338 -171.994 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -41.43 -55.99 2.64 Favored 'General case' 0 CA--C 1.557 1.245 0 CA-C-O 114.866 -2.492 . . . . 0.0 108.39 156.762 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 11.8 mt -62.21 -45.94 91.11 Favored 'General case' 0 N--CA 1.493 1.706 0 CA-C-N 125.7 3.864 . . . . 0.0 116.762 177.493 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -70.97 -40.88 71.69 Favored 'General case' 0 N--CA 1.483 1.184 0 CA-C-O 116.705 -1.617 . . . . 0.0 113.48 178.955 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 1.3 tt -61.67 -31.7 51.58 Favored 'Isoleucine or valine' 0 C--O 1.199 -1.593 0 CA-C-O 114.329 -2.748 . . . . 0.0 115.178 160.474 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 2.6 t -84.38 -51.84 13.4 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.096 0 CA-C-N 123.698 2.954 . . . . 0.0 110.884 -173.57 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 33.9 mt-30 -48.76 -41.57 32.76 Favored 'General case' 0 CA--C 1.568 1.643 0 C-N-CA 124.208 1.003 . . . . 0.0 113.656 155.014 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . 0.352 17.4 t0 -50.31 -57.91 6.83 Favored 'General case' 0 N--CA 1.49 1.526 0 N-CA-C 116.916 2.191 . . . . 0.0 116.916 153.981 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -74.96 -33.16 61.87 Favored 'General case' 0 CA--C 1.551 0.995 0 N-CA-C 116.733 2.124 . . . . 0.0 116.733 -157.496 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 2.3 pp -96.74 -19.31 19.04 Favored 'General case' 0 CA--C 1.562 1.436 0 N-CA-C 118.5 2.778 . . . . 0.0 118.5 159.245 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 94.8 p -138.26 38.91 2.29 Favored 'General case' 0 N--CA 1.493 1.706 0 CA-C-N 122.268 2.304 . . . . 0.0 116.576 -173.842 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 69.2 mmtt -120.42 129.04 25.52 Favored Pre-proline 0 N--CA 1.502 2.158 0 CA-C-N 120.249 1.386 . . . . 0.0 112.584 159.456 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 67.3 Cg_endo -96.96 173.79 0.73 Allowed 'Trans proline' 0 CA--C 1.564 2.014 0 N-CA-C 117.482 2.07 . . . . 0.0 117.482 47.987 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . 0.292 66.1 m -112.99 -124.92 0.0 OUTLIER Pre-proline 0 CA--C 1.583 2.235 0 CA-C-O 115.941 -1.98 . . . . 0.0 107.603 154.439 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 78.0 Cg_exo -67.69 67.72 0.81 Allowed 'Trans proline' 0 CA--C 1.573 2.437 0 CA-C-N 126.502 3.358 . . . . 0.0 118.111 164.441 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 14.9 p -153.37 106.95 0.23 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.889 0 C-N-CA 123.902 0.881 . . . . 0.0 110.314 172.17 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 73.1 p -123.01 53.26 1.3 Allowed 'General case' 0 N--CA 1.507 2.387 0 CA-C-O 122.807 1.289 . . . . 0.0 113.918 173.763 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -168.93 73.81 0.13 Allowed Glycine 0 CA--C 1.555 2.545 0 CA-C-N 114.748 -1.114 . . . . 0.0 112.101 158.355 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . 0.413 0.3 OUTLIER 61.85 -162.68 0.27 Allowed 'General case' 0 CA--C 1.584 2.269 2 O-C-N 114.96 -4.847 . . . . 0.0 115.052 3.209 . . . . . . . . 4 3 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . 0.317 6.7 tpm_? 75.66 136.51 0.06 Allowed 'General case' 0 N--CA 1.506 2.332 0 N-CA-C 115.113 1.523 . . . . 0.0 115.113 -172.755 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER 121.36 141.62 0.0 OUTLIER 'General case' 0 N--CA 1.505 2.312 0 CA-C-O 125.03 2.347 . . . . 0.0 106.423 -148.137 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . 1.351 0.0 OUTLIER 57.17 19.3 4.74 Favored 'General case' 0 N--CA 1.483 1.183 1 N-CA-C 123.018 4.451 . . . . 0.0 123.018 98.336 . . . . . . . . 4 3 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . 1.291 . . -90.73 19.24 5.61 Favored 'General case' 0 CA--C 1.577 1.986 1 O-C-N 115.663 -4.398 . . . . 0.0 121.784 111.451 . . . . . . . . 3 2 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.407 ' O ' ' CB ' ' A' ' 59' ' ' ALA . 34.7 mt-10 -47.88 -19.48 0.24 Allowed 'General case' 0 CA--C 1.602 2.945 0 N-CA-C 121.118 3.747 . . . . 0.0 121.118 112.076 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -98.8 -23.14 15.51 Favored 'General case' 0 N--CA 1.49 1.529 1 O-C-N 115.728 -4.358 . . . . 0.0 114.428 169.657 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . 0.815 0.4 OUTLIER -73.57 -0.93 16.71 Favored 'General case' 0 CA--C 1.626 3.883 0 O-C-N 118.694 -2.504 . . . . 0.0 114.75 143.791 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . 0.407 ' CB ' ' O ' ' A' ' 56' ' ' GLU 0.284 . . -55.39 -36.16 66.09 Favored 'General case' 0 N--CA 1.517 2.878 1 O-C-N 114.656 -5.028 . . . . 0.0 117.229 136.054 . . . . . . . . 4 3 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -66.14 -14.57 62.04 Favored 'General case' 0 CA--C 1.58 2.099 0 N-CA-C 118.164 2.653 . . . . 0.0 118.164 159.276 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . 0.436 0.0 OUTLIER -52.6 -52.26 56.12 Favored 'General case' 0 N--CA 1.513 2.693 0 O-C-N 119.296 -2.127 . . . . 0.0 112.457 145.586 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . 0.373 3.0 tp60 -55.19 -37.97 67.76 Favored 'General case' 0 CA--C 1.586 2.353 0 CA-C-O 114.586 -2.626 . . . . 0.0 116.968 162.925 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 26.3 m -36.56 -50.51 0.8 Allowed 'General case' 0 N--CA 1.53 3.535 1 CA-C-N 126.117 4.053 . . . . 0.0 115.91 159.278 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . 0.45 1.0 OUTLIER -91.86 12.64 20.87 Favored 'General case' 0 CA--C 1.573 1.841 0 N-CA-C 115.769 1.766 . . . . 0.0 115.769 179.94 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 5.0 mp -91.98 -52.06 4.9 Favored 'General case' 0 CA--C 1.588 2.41 0 C-N-CA 126.285 1.834 . . . . 0.0 114.278 141.118 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . 0.338 34.4 m . . . . . 0 N--CA 1.517 2.878 0 N-CA-C 120.615 3.561 . . . . 0.0 120.615 -149.412 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.559 1.307 0 CA-C-O 121.96 0.885 . . . . 0.0 113.301 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 2' ' ' ARG . . . . . . . . . . . . . 8.6 ptm180 -87.22 91.7 8.81 Favored 'General case' 0 CA--C 1.564 1.496 0 CA-C-O 121.745 0.783 . . . . 0.0 112.737 174.114 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 28.0 m-20 -131.18 -0.69 4.08 Favored 'General case' 0 CA--C 1.57 1.734 0 N-CA-C 115.523 1.675 . . . . 0.0 115.523 164.754 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 4' ' ' ASP . . . . . . . . . . . . 0.251 8.3 p-10 -136.73 71.21 57.98 Favored Pre-proline 0 CA--C 1.573 1.85 0 O-C-N 119.871 -1.768 . . . . 0.0 111.903 139.484 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 90.0 Cg_endo -66.54 152.51 80.62 Favored 'Trans proline' 0 CA--C 1.557 1.636 0 C-N-CA 123.424 2.749 . . . . 0.0 115.945 174.38 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 6' ' ' HIS . . . . . . . . . . . . . 54.9 m80 -75.19 154.21 37.75 Favored 'General case' 0 CA--C 1.557 1.231 0 CA-C-N 113.8 -1.546 . . . . 0.0 114.597 174.656 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 7' ' ' PHE . . . . . . . . . . . . . 17.8 p90 -131.19 162.66 29.45 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 120.197 -1.564 . . . . 0.0 112.395 120.026 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 8' ' ' ASN . . . . . . . . . . . . . 6.1 p-10 -61.73 92.47 0.04 OUTLIER 'General case' 0 CA--C 1.567 1.628 0 N-CA-C 114.422 1.267 . . . . 0.0 114.422 165.403 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 9' ' ' PHE . . . . . . . . . . . . 0.263 0.8 OUTLIER -79.53 164.77 23.62 Favored 'General case' 0 CA--C 1.563 1.476 0 CA-C-O 125.543 2.592 . . . . 0.0 109.511 153.905 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 10' ' ' ARG . . . . . 0.407 ' N ' ' SD ' ' B' ' 11' ' ' MET . 0.0 OUTLIER 162.63 103.33 0.0 OUTLIER 'General case' 0 C--N 1.308 -1.231 0 CA-C-N 111.819 -2.446 . . . . 0.0 104.658 -123.846 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 11' ' ' MET . . . . . 0.407 ' SD ' ' N ' ' B' ' 10' ' ' ARG . 0.2 OUTLIER -139.96 128.75 13.37 Favored Pre-proline 0 CA--C 1.567 1.631 0 CA-C-O 117.669 -1.158 . . . . 0.0 110.88 -158.883 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 12' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -59.46 153.42 54.52 Favored 'Trans proline' 0 CA--C 1.562 1.905 0 CA-C-N 123.779 2.385 . . . . 0.0 114.116 169.445 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 13' ' ' MET . . . . . 0.417 ' SD ' ' O ' ' A' ' 2' ' ' ARG . 0.0 OUTLIER -57.84 -36.55 72.44 Favored 'General case' 0 N--CA 1.495 1.821 0 N-CA-C 117.026 2.232 . . . . 0.0 117.026 -155.03 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -60.13 -44.23 95.07 Favored 'General case' 0 CA--C 1.563 1.458 0 N-CA-C 117.146 2.276 . . . . 0.0 117.146 165.705 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -63.06 -46.33 96.46 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.131 0 CA-C-N 123.57 2.896 . . . . 0.0 112.612 172.921 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 16' ' ' ARG . . . . . . . . . . . . 0.255 0.0 OUTLIER -76.63 -27.87 55.87 Favored 'General case' 0 N--CA 1.479 1.009 0 N-CA-C 116.261 1.949 . . . . 0.0 116.261 177.297 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 17' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -67.44 -44.46 78.65 Favored 'General case' 0 N--CA 1.49 1.573 0 CA-C-N 122.833 2.56 . . . . 0.0 113.699 156.925 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 55.4 mtmt -58.5 -54.89 41.9 Favored 'General case' 0 N--CA 1.49 1.561 0 CA-C-N 122.378 2.354 . . . . 0.0 114.93 171.316 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 19' ' ' LEU . . . . . . . . . . . . . 12.9 tp -63.57 -35.63 81.13 Favored 'General case' 0 CA--C 1.562 1.44 0 N-CA-C 115.124 1.527 . . . . 0.0 115.124 176.453 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 20' ' ' LYS . . . . . . . . . . . . . 11.8 ttpt -87.82 -23.0 24.17 Favored 'General case' 0 CA--C 1.572 1.803 0 N-CA-C 114.314 1.228 . . . . 0.0 114.314 176.185 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 11.2 m-85 -64.53 -71.71 0.17 Allowed 'General case' 0 N--CA 1.491 1.62 0 CA-C-O 115.167 -2.349 . . . . 0.0 110.635 154.678 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . 0.369 0.0 OUTLIER -18.58 -52.28 0.01 OUTLIER 'General case' 0 CA--C 1.597 2.754 0 CA-C-N 124.616 3.371 . . . . 0.0 115.106 159.794 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 23' ' ' ALA . . . . . . . . . . . . 0.331 . . -55.67 -77.96 0.02 OUTLIER 'General case' 0 CA--C 1.586 2.338 0 N-CA-C 120.202 3.408 . . . . 0.0 120.202 154.182 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 12.6 mm-40 -68.93 -36.59 78.16 Favored 'General case' 0 N--CA 1.502 2.16 0 N-CA-C 119.323 3.083 . . . . 0.0 119.323 -178.719 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 25' ' ' ALA . . . . . . . . . . . . . . . -42.79 -49.82 5.69 Favored 'General case' 0 CA--C 1.58 2.127 0 N-CA-C 116.496 2.036 . . . . 0.0 116.496 154.413 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 26' ' ' ASN . . . . . . . . . . . . . 6.8 m-20 -82.23 -54.61 5.11 Favored 'General case' 0 CA--C 1.572 1.789 0 N-CA-C 114.275 1.213 . . . . 0.0 114.275 179.131 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 27' ' ' GLY . . . . . . . . . . . . . . . 116.67 23.94 3.86 Favored Glycine 0 N--CA 1.498 2.793 0 N-CA-C 117.835 1.894 . . . . 0.0 117.835 -152.661 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 28' ' ' ARG . . . . . . . . . . . . 0.291 81.7 mtm180 -119.09 155.61 31.22 Favored 'General case' 0 CA--C 1.58 2.106 0 N-CA-C 103.738 -2.69 . . . . 0.0 103.738 170.927 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 29' ' ' SER . . . . . . . . . . . . . 87.5 p -122.98 108.13 12.59 Favored 'General case' 0 N--CA 1.507 2.387 0 O-C-N 116.852 -3.655 . . . . 0.0 107.576 -166.47 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 30' ' ' MET . . . . . . . . . . . . . 23.4 mtp -40.6 -45.93 2.43 Favored 'General case' 0 N--CA 1.5 2.033 0 N-CA-C 119.15 3.019 . . . . 0.0 119.15 -137.592 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 31' ' ' ASN . . . . . . . . . . . . 0.286 0.1 OUTLIER -48.56 -43.65 35.85 Favored 'General case' 0 CA--C 1.601 2.926 0 CA-C-N 125.178 3.626 . . . . 0.0 114.707 167.08 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 32' ' ' SER . . . . . . . . . . . . 0.296 70.0 m -53.04 -63.19 1.23 Allowed 'General case' 0 N--CA 1.508 2.473 0 N-CA-C 119.902 3.297 . . . . 0.0 119.902 145.527 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 8.5 tm-20 -70.28 -54.76 11.31 Favored 'General case' 0 N--CA 1.504 2.234 0 CA-C-N 123.668 2.94 . . . . 0.0 118.901 -178.707 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -36.39 -52.23 0.83 Allowed 'General case' 0 CA--C 1.554 1.111 0 CA-C-O 115.829 -2.034 . . . . 0.0 108.74 161.119 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 35' ' ' LEU . . . . . . . . . . . . . 19.7 mt -62.67 -47.64 82.78 Favored 'General case' 0 C--N 1.369 1.416 0 CA-C-N 123.689 2.949 . . . . 0.0 116.351 174.075 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 36' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -69.07 -31.42 70.16 Favored 'General case' 0 N--CA 1.49 1.557 0 N-CA-C 116.305 1.965 . . . . 0.0 116.305 179.491 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 37' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -73.38 -34.53 43.56 Favored 'Isoleucine or valine' 0 C--O 1.2 -1.519 0 CA-C-O 114.978 -2.439 . . . . 0.0 113.908 159.526 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 38' ' ' VAL . . . . . . . . . . . . . 2.6 t -76.05 -49.31 26.02 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.314 0 CA-C-N 123.969 3.077 . . . . 0.0 112.448 -176.639 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 31.5 mt-30 -55.06 -38.76 68.44 Favored 'General case' 0 CA--C 1.57 1.749 0 CA-C-O 117.631 -1.176 . . . . 0.0 112.908 156.43 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 40' ' ' ASP . . . . . . . . . . . . 0.42 7.1 t0 -52.41 -45.32 65.85 Favored 'General case' 0 N--CA 1.504 2.255 0 N-CA-C 116.737 2.125 . . . . 0.0 116.737 154.485 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 41' ' ' ALA . . . . . . . . . . . . 0.296 . . -84.16 -53.78 5.28 Favored 'General case' 0 CA--C 1.553 1.068 0 N-CA-C 115.807 1.78 . . . . 0.0 115.807 -161.136 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . 0.316 1.5 pp -82.48 -24.4 34.21 Favored 'General case' 0 N--CA 1.494 1.754 0 N-CA-C 117.286 2.328 . . . . 0.0 117.286 160.951 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 43' ' ' SER . . . . . . . . . . . . . 25.1 t -110.92 12.69 22.2 Favored 'General case' 0 N--CA 1.494 1.77 0 CA-C-N 122.875 2.579 . . . . 0.0 116.541 -178.893 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 44' ' ' LYS . . . . . . . . . . . . 0.434 26.4 mtmm 71.07 -99.04 0.0 OUTLIER Pre-proline 0 CA--C 1.579 2.093 0 CA-C-N 121.754 2.07 . . . . 0.0 111.426 167.51 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 71.4 Cg_endo -82.27 108.3 1.75 Allowed 'Trans proline' 0 CA--C 1.569 2.226 0 CA-C-N 126.145 3.23 . . . . 0.0 115.686 165.281 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 46' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -80.6 -158.93 0.01 OUTLIER Pre-proline 0 CA--C 1.592 2.579 0 O-C-N 121.238 -0.913 . . . . 0.0 110.949 145.27 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -64.54 83.18 0.16 Allowed 'Trans proline' 0 CA--C 1.569 2.259 0 CA-C-N 124.228 2.546 . . . . 0.0 114.182 159.553 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 48' ' ' VAL . . . . . . . . . . . . 0.288 29.8 m -130.76 -38.48 0.61 Allowed 'Isoleucine or valine' 0 N--CA 1.499 2.011 0 N-CA-C 117.516 2.413 . . . . 0.0 117.516 -169.239 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 49' ' ' THR . . . . . . . . . . . . . 6.9 m -130.97 131.52 44.46 Favored 'General case' 0 CA--C 1.578 2.049 2 O-C-N 111.806 -6.809 . . . . 0.0 112.237 2.366 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 50' ' ' GLY . . . . . . . . . . . . . . . 72.33 69.4 1.4 Allowed Glycine 0 N--CA 1.505 3.253 0 N-CA-C 118.593 2.197 . . . . 0.0 118.593 165.515 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 51' ' ' TYR . . . . . . . . . . . . 0.273 0.5 OUTLIER -144.46 -57.54 0.36 Allowed 'General case' 0 CA--C 1.578 2.023 0 N-CA-C 117.075 2.25 . . . . 0.0 117.075 -143.169 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 52' ' ' ARG . . . . . . . . . . . . 0.484 12.5 ttt180 110.2 -155.52 0.0 OUTLIER 'General case' 0 N--CA 1.534 3.731 0 N-CA-C 117.963 2.579 . . . . 0.0 117.963 -178.529 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 10.5 t-20 60.94 160.18 0.05 Allowed 'General case' 0 N--CA 1.518 2.93 0 O-C-N 118.73 -2.481 . . . . 0.0 114.338 -163.901 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 37.9 m-20 -74.89 95.06 2.89 Favored 'General case' 0 N--CA 1.477 0.923 2 O-C-N 110.787 -7.446 . . . . 0.0 109.737 -14.845 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 55' ' ' ALA . . . . . . . . . . . . . . . -94.94 -89.92 0.23 Allowed 'General case' 0 CA--C 1.566 1.575 0 CA-C-O 122.619 1.2 . . . . 0.0 113.322 -157.923 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 18.4 tt0 3.43 -60.37 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.913 0 N-CA-C 121.449 3.87 . . . . 0.0 121.449 110.631 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 57' ' ' ARG . . . . . . . . . . . . 0.526 23.0 ttm-85 -84.1 -27.84 27.93 Favored 'General case' 0 CA--C 1.574 1.896 0 O-C-N 120.039 -1.663 . . . . 0.0 112.621 -169.255 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 58' ' ' LEU . . . . . . . . . . . . 0.601 34.5 mt -84.98 1.01 49.4 Favored 'General case' 0 CA--C 1.6 2.868 0 O-C-N 118.122 -2.861 . . . . 0.0 115.133 156.638 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 59' ' ' ALA . . . . . . . . . . . . . . . -56.48 -41.81 77.22 Favored 'General case' 0 N--CA 1.5 2.059 1 O-C-N 116.249 -4.032 . . . . 0.0 116.592 135.86 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -66.09 -7.11 15.64 Favored 'General case' 0 N--CA 1.507 2.384 0 N-CA-C 118.528 2.788 . . . . 0.0 118.528 156.795 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 61' ' ' GLU . . . . . . . . . . . . 0.338 0.0 OUTLIER -58.12 -52.49 65.31 Favored 'General case' 0 N--CA 1.503 2.215 0 O-C-N 118.928 -2.358 . . . . 0.0 112.306 151.809 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 62' ' ' GLN . . . . . . . . . . . . 0.264 4.4 tp60 -52.04 -47.83 64.87 Favored 'General case' 0 CA--C 1.568 1.657 0 CA-C-O 116.409 -1.758 . . . . 0.0 115.159 168.6 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 25.4 m -35.81 -56.89 0.68 Allowed 'General case' 0 N--CA 1.513 2.699 0 N-CA-C 119.261 3.06 . . . . 0.0 119.261 161.825 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 64' ' ' GLU . . . . . . . . . . . . 0.408 26.2 mt-10 -77.61 0.84 21.63 Favored 'General case' 0 CA--C 1.583 2.249 0 CA-C-N 114.636 -1.165 . . . . 0.0 113.616 -177.035 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 65' ' ' LEU . . . . . . . . . . . . 0.299 0.2 OUTLIER -101.63 -40.34 7.05 Favored 'General case' 0 CA--C 1.576 1.955 0 C-N-CA 126.92 2.088 . . . . 0.0 115.386 158.396 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 66' ' ' VAL . . . . . . . . . . . . 0.332 21.9 m . . . . . 0 N--CA 1.513 2.691 0 N-CA-C 117.467 2.395 . . . . 0.0 117.467 -167.288 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.559 1.289 0 N-CA-C 114.034 1.124 . . . . 0.0 114.034 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 12.5 ptm180 -90.09 102.38 15.09 Favored 'General case' 0 N--CA 1.488 1.429 0 CA-C-O 122.284 1.04 . . . . 0.0 111.147 161.232 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 12.3 m-20 -98.0 68.81 2.02 Favored 'General case' 0 CA--C 1.564 1.51 0 O-C-N 121.065 -1.022 . . . . 0.0 108.572 160.612 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 7.4 p-10 -158.39 75.92 3.58 Favored Pre-proline 0 CA--C 1.57 1.737 0 C-N-CA 123.725 0.81 . . . . 0.0 112.478 179.738 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 4.4 Cg_exo -99.07 154.01 0.63 Allowed 'Trans proline' 0 C--N 1.362 1.281 0 CA-C-N 121.936 1.727 . . . . 0.0 113.889 -157.743 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 61.7 m80 -72.34 138.42 47.3 Favored 'General case' 0 CA--C 1.562 1.413 0 CA-C-N 113.546 -1.661 . . . . 0.0 113.633 177.356 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . 0.268 35.5 p90 -116.43 170.97 8.15 Favored 'General case' 0 CA--C 1.565 1.549 0 O-C-N 120.065 -1.647 . . . . 0.0 110.438 113.902 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 93.1 m-20 -89.13 94.53 9.97 Favored 'General case' 0 N--CA 1.485 1.319 0 O-C-N 119.764 -1.835 . . . . 0.0 107.556 162.364 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 8.9 t80 -66.9 162.83 20.92 Favored 'General case' 0 CA--C 1.556 1.202 0 CA-C-O 124.344 2.021 . . . . 0.0 111.345 160.904 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 38.3 tpt85 170.96 103.35 0.01 OUTLIER 'General case' 0 N--CA 1.486 1.346 0 O-C-N 119.785 -1.822 . . . . 0.0 106.881 -119.19 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 11.6 mtm -138.85 122.9 11.3 Favored Pre-proline 0 CA--C 1.561 1.375 0 CA-C-O 117.296 -1.335 . . . . 0.0 110.872 -153.763 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 75.1 Cg_exo -43.0 143.11 1.96 Allowed 'Trans proline' 0 CA--C 1.562 1.923 0 C-N-CA 122.952 2.435 . . . . 0.0 116.013 163.32 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 9.5 tpp -55.34 -28.68 55.35 Favored 'General case' 0 N--CA 1.491 1.609 0 N-CA-C 119.533 3.16 . . . . 0.0 119.533 -163.987 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . 0.268 9.2 pt-20 -62.7 -48.63 78.43 Favored 'General case' 0 CA--C 1.566 1.586 0 N-CA-C 116.411 2.004 . . . . 0.0 116.411 160.959 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -60.13 -44.19 94.61 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.288 0 CA-C-N 123.114 2.688 . . . . 0.0 113.438 174.345 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -80.84 -21.28 40.9 Favored 'General case' 0 CA--C 1.556 1.181 0 N-CA-C 116.63 2.085 . . . . 0.0 116.63 175.759 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 38.9 mt-10 -67.34 -47.61 69.97 Favored 'General case' 0 N--CA 1.49 1.555 0 CA-C-N 123.183 2.719 . . . . 0.0 113.766 151.946 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 46.7 mtmt -57.6 -57.04 14.44 Favored 'General case' 0 N--CA 1.485 1.307 0 CA-C-N 121.609 2.004 . . . . 0.0 114.353 174.157 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . 0.267 12.0 tp -64.18 -40.0 95.18 Favored 'General case' 0 CA--C 1.563 1.445 0 C-N-CA 124.812 1.245 . . . . 0.0 113.499 176.081 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 10.6 ttpt -80.26 -25.12 39.65 Favored 'General case' 0 CA--C 1.569 1.705 0 CA-C-N 120.537 1.517 . . . . 0.0 114.947 176.201 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 18.7 m-30 -70.43 -71.48 0.24 Allowed 'General case' 0 N--CA 1.488 1.468 0 CA-C-O 114.074 -2.869 . . . . 0.0 110.764 162.23 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . 0.261 7.3 tpt180 -14.09 -56.26 0.0 OUTLIER 'General case' 0 CA--C 1.595 2.683 0 CA-C-N 125.92 3.964 . . . . 0.0 116.042 159.515 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -55.77 -79.42 0.02 OUTLIER 'General case' 0 CA--C 1.586 2.329 0 N-CA-C 118.421 2.748 . . . . 0.0 118.421 157.921 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 66.5 mm-40 -74.9 -29.3 60.95 Favored 'General case' 0 CA--C 1.574 1.904 0 N-CA-C 119.34 3.089 . . . . 0.0 119.34 -175.437 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -43.22 -50.94 6.35 Favored 'General case' 0 CA--C 1.577 1.994 0 N-CA-C 116.081 1.882 . . . . 0.0 116.081 152.129 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . 0.313 0.1 OUTLIER -112.67 -46.74 3.12 Favored 'General case' 0 CA--C 1.578 2.032 0 N-CA-C 114.967 1.469 . . . . 0.0 114.967 -158.77 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 153.9 22.32 0.04 OUTLIER Glycine 0 N--CA 1.501 3.029 0 N-CA-C 119.377 2.511 . . . . 0.0 119.377 179.211 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 84.4 mtm180 -132.91 163.66 28.66 Favored 'General case' 0 CA--C 1.576 1.961 0 N-CA-C 104.748 -2.315 . . . . 0.0 104.748 -177.645 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 9.4 t -137.76 115.15 11.1 Favored 'General case' 0 N--CA 1.503 2.219 0 O-C-N 117.157 -3.465 . . . . 0.0 107.071 -171.766 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 19.9 mtp -53.05 -40.7 64.17 Favored 'General case' 0 N--CA 1.491 1.62 0 N-CA-C 118.224 2.676 . . . . 0.0 118.224 -126.724 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 13.0 t-20 -45.58 -43.58 12.24 Favored 'General case' 0 CA--C 1.598 2.793 0 CA-C-N 125.505 3.775 . . . . 0.0 114.857 165.151 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . 0.416 89.1 p -56.95 -58.29 8.79 Favored 'General case' 0 N--CA 1.503 2.214 0 N-CA-C 120.348 3.462 . . . . 0.0 120.348 149.555 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 10.5 tm-20 -64.82 -61.14 2.36 Favored 'General case' 0 N--CA 1.507 2.389 0 CA-C-N 123.127 2.694 . . . . 0.0 117.761 176.804 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -38.23 -53.44 1.45 Allowed 'General case' 0 CA--C 1.545 0.77 0 CA-C-O 115.748 -2.072 . . . . 0.0 108.126 169.019 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 11.9 mt -63.99 -56.29 16.17 Favored 'General case' 0 C--N 1.367 1.343 0 CA-C-N 123.03 2.65 . . . . 0.0 115.171 178.848 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . 0.276 0.0 OUTLIER -58.56 -31.1 67.68 Favored 'General case' 0 CA--C 1.57 1.727 0 CA-C-O 116.612 -1.661 . . . . 0.0 114.626 176.874 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 2.8 tp -79.28 -31.7 14.58 Favored 'Isoleucine or valine' 0 CA--C 1.567 1.62 0 CA-C-N 122.318 2.327 . . . . 0.0 116.414 164.393 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 3.1 t -77.19 -48.72 24.29 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.911 0 CA-C-N 122.285 2.311 . . . . 0.0 110.934 178.821 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 29.6 mt-30 -51.36 -46.21 62.66 Favored 'General case' 0 CA--C 1.551 0.987 0 CA-C-O 116.198 -1.858 . . . . 0.0 113.005 155.824 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . 0.297 42.0 t0 -44.51 -55.24 5.26 Favored 'General case' 0 N--CA 1.502 2.157 0 CA-C-N 121.763 2.074 . . . . 0.0 113.644 158.497 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . 0.283 . . -76.44 -17.98 59.04 Favored 'General case' 0 CA--C 1.544 0.721 0 N-CA-C 119.324 3.083 . . . . 0.0 119.324 -161.678 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . 0.251 1.3 pt? -131.1 26.22 4.9 Favored 'General case' 0 CA--C 1.563 1.464 0 N-CA-C 117.358 2.355 . . . . 0.0 117.358 158.042 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 94.9 p -151.91 -52.94 0.12 Allowed 'General case' 0 N--CA 1.492 1.633 0 N-CA-C 116.023 1.86 . . . . 0.0 116.023 161.895 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 44.0 tttm -60.94 96.95 0.09 OUTLIER Pre-proline 0 N--CA 1.527 3.406 0 N-CA-C 120.742 3.608 . . . . 0.0 120.742 -105.373 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 27.5 Cg_endo -89.24 64.68 2.52 Favored 'Trans proline' 0 CA--C 1.563 1.967 0 CA-C-N 124.538 2.657 . . . . 0.0 115.904 172.989 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 48.2 t -152.02 80.23 6.07 Favored Pre-proline 0 CA--C 1.574 1.893 0 N-CA-C 116.052 1.871 . . . . 0.0 116.052 -164.971 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_endo -98.66 87.34 0.08 OUTLIER 'Cis proline' 0 CA--C 1.571 2.347 0 CA-C-N 122.484 1.923 . . . . 0.0 110.963 -23.598 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 12.2 p -154.34 -51.62 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.506 2.352 0 O-C-N 120.691 -1.256 . . . . 0.0 113.162 -156.766 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . 0.374 13.1 p 88.6 126.62 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.622 0 C-N-CA 125.696 1.598 . . . . 0.0 110.008 -171.172 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -118.98 70.01 0.33 Allowed Glycine 0 CA--C 1.546 1.982 0 N-CA-C 114.635 0.614 . . . . 0.0 114.635 167.401 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -130.56 24.33 5.1 Favored 'General case' 0 N--CA 1.506 2.366 2 O-C-N 114.415 -5.168 . . . . 0.0 115.626 -10.285 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . 0.29 40.3 mmt180 58.62 -39.91 0.06 Allowed 'General case' 0 N--CA 1.509 2.514 0 N-CA-C 115.863 1.801 . . . . 0.0 115.863 -128.912 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 8.9 m120 -69.05 -152.44 0.02 OUTLIER 'General case' 0 CA--C 1.589 2.449 0 O-C-N 120.388 -1.445 . . . . 0.0 113.863 158.029 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . 0.469 0.5 OUTLIER 84.56 -93.64 0.01 OUTLIER 'General case' 0 N--CA 1.485 1.293 0 O-C-N 117.869 -3.019 . . . . 0.0 104.274 -98.81 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . 0.499 . . -91.87 -106.31 0.11 Allowed 'General case' 0 CA--C 1.569 1.698 2 O-C-N 114.137 -5.352 . . . . 0.0 113.99 9.208 . . . . . . . . 3 2 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . 0.32 15.1 mm-40 -9.05 1.82 0.0 OUTLIER 'General case' 0 C--N 1.265 -3.101 1 N-CA-C 125.24 5.274 . . . . 0.0 125.24 100.13 . . . . . . . . 3 2 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . 0.271 1.1 mpt_? -148.65 -22.79 0.32 Allowed 'General case' 0 N--CA 1.494 1.753 0 N-CA-C 118.914 2.931 . . . . 0.0 118.914 -162.813 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . 0.294 0.7 OUTLIER -66.05 -31.41 72.28 Favored 'General case' 0 N--CA 1.503 2.178 0 C-N-CA 117.243 -1.783 . . . . 0.0 115.124 126.995 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -48.33 -62.85 1.28 Allowed 'General case' 0 N--CA 1.49 1.559 0 N-CA-C 116.158 1.911 . . . . 0.0 116.158 159.587 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -98.65 -7.06 28.56 Favored 'General case' 0 CA--C 1.543 0.679 0 N-CA-C 114.071 1.137 . . . . 0.0 114.071 -167.307 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . 0.313 43.4 tp10 -67.38 -52.57 38.4 Favored 'General case' 0 CA--C 1.551 1.004 0 CA-C-O 115.147 -2.359 . . . . 0.0 112.151 149.584 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . 0.28 7.2 tp60 -72.73 -63.15 1.22 Allowed 'General case' 0 C--N 1.37 1.488 0 CA-C-N 124.884 3.493 . . . . 0.0 111.801 178.909 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 22.8 t -99.85 56.66 0.97 Allowed 'General case' 0 CA--C 1.56 1.348 0 N-CA-C 116.727 2.121 . . . . 0.0 116.727 170.882 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 8.0 tt0 -87.14 -49.52 7.24 Favored 'General case' 0 CA--C 1.57 1.737 0 O-C-N 119.311 -2.118 . . . . 0.0 112.466 101.39 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . 0.294 2.3 mp -90.64 27.31 1.78 Allowed 'General case' 0 N--CA 1.505 2.28 0 N-CA-C 117.137 2.273 . . . . 0.0 117.137 -162.491 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 24.7 m . . . . . 0 N--CA 1.503 2.178 0 C-N-CA 126.259 1.824 . . . . 0.0 113.313 161.762 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.563 1.472 0 N-CA-C 114.433 1.271 . . . . 0.0 114.433 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 2' ' ' ARG . . . . . . . . . . . . 0.502 47.5 mtp180 71.61 -147.97 0.07 Allowed 'General case' 0 N--CA 1.499 2.019 1 O-C-N 113.662 -5.649 . . . . 0.0 114.213 -10.43 . . . . . . . . 3 2 . 1 . 004 nuclear orig full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . 0.321 25.9 t70 76.99 102.65 0.07 Allowed 'General case' 0 CA--C 1.571 1.766 0 C-N-CA 124.511 1.124 . . . . 0.0 113.364 -171.957 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 4' ' ' ASP . . . . . . . . . . . . 0.419 2.9 p30 50.72 76.61 0.53 Allowed Pre-proline 0 CA--C 1.576 1.979 0 N-CA-C 120.517 3.525 . . . . 0.0 120.517 168.282 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 4.5 Cg_exo -107.83 149.36 0.08 OUTLIER 'Trans proline' 0 CA--C 1.557 1.669 0 C-N-CA 122.457 2.105 . . . . 0.0 114.011 -165.39 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 6' ' ' HIS . . . . . . . . . . . . . 77.5 m80 -85.82 135.28 33.78 Favored 'General case' 0 CA--C 1.579 2.059 0 CA-C-N 114.959 -1.019 . . . . 0.0 112.117 174.647 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 7' ' ' PHE . . . . . . . . . . . . . 3.0 p90 -135.94 161.7 34.9 Favored 'General case' 0 CA--C 1.571 1.778 0 O-C-N 119.896 -1.752 . . . . 0.0 112.345 151.058 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 8' ' ' ASN . . . . . . . . . . . . . 7.8 p-10 -62.32 102.75 0.33 Allowed 'General case' 0 CA--C 1.575 1.909 0 N-CA-C 116.001 1.852 . . . . 0.0 116.001 171.782 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 9' ' ' PHE . . . . . . . . . . . . . 4.9 t80 -126.81 105.99 9.04 Favored 'General case' 0 CA--C 1.538 0.516 0 N-CA-C 107.661 -1.237 . . . . 0.0 107.661 159.662 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 10' ' ' ARG . . . . . . . . . . . . 0.469 0.0 OUTLIER 92.79 87.45 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.566 1 O-C-N 114.162 -5.337 . . . . 0.0 109.339 -11.415 . . . . . . . . 4 3 . 1 . 004 nuclear orig full ' B' B ' 11' ' ' MET . . . . . . . . . . . . . 8.4 mtm -148.87 126.29 5.6 Favored Pre-proline 0 CA--C 1.566 1.565 0 CA-C-O 117.045 -1.455 . . . . 0.0 110.371 -160.261 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 12' ' ' PRO . . . . . . . . . . . . . 76.9 Cg_exo -42.55 140.47 2.68 Favored 'Trans proline' 0 C--N 1.371 1.72 0 C-N-CA 123.242 2.628 . . . . 0.0 116.261 161.944 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 13' ' ' MET . . . . . . . . . . . . . 23.4 tpp -54.76 -29.19 53.29 Favored 'General case' 0 N--CA 1.495 1.78 0 N-CA-C 119.006 2.965 . . . . 0.0 119.006 -163.886 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -61.95 -48.25 81.22 Favored 'General case' 0 N--CA 1.492 1.672 0 N-CA-C 117.008 2.225 . . . . 0.0 117.008 163.972 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -58.92 -50.58 79.08 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.138 0 CA-C-N 121.163 1.801 . . . . 0.0 113.001 172.123 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -73.83 -26.09 60.41 Favored 'General case' 0 CA--C 1.545 0.759 0 N-CA-C 116.7 2.111 . . . . 0.0 116.7 175.826 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 17' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -64.13 -48.2 76.98 Favored 'General case' 0 N--CA 1.49 1.565 0 CA-C-N 123.908 3.049 . . . . 0.0 112.959 156.883 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . 0.615 23.5 pttt -67.26 -40.28 86.19 Favored 'General case' 0 N--CA 1.488 1.442 0 N-CA-C 117.415 2.376 . . . . 0.0 117.415 178.963 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 19' ' ' LEU . . . . . . . . . . . . . 12.5 tp -69.75 -35.88 75.33 Favored 'General case' 0 CA--C 1.565 1.52 0 N-CA-C 115.081 1.512 . . . . 0.0 115.081 168.234 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 20' ' ' LYS . . . . . . . . . . . . . 14.3 ttpt -86.57 -30.74 21.64 Favored 'General case' 0 CA--C 1.567 1.627 0 N-CA-C 114.721 1.378 . . . . 0.0 114.721 178.814 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 24.5 m-85 -59.66 -68.56 0.27 Allowed 'General case' 0 N--CA 1.492 1.629 0 CA-C-O 114.188 -2.815 . . . . 0.0 111.514 155.23 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . 0.306 13.9 ttm-85 -25.68 -47.79 0.02 OUTLIER 'General case' 0 CA--C 1.597 2.788 0 CA-C-N 125.583 3.811 . . . . 0.0 116.979 163.411 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -61.36 -61.78 2.3 Favored 'General case' 0 CA--C 1.581 2.148 0 N-CA-C 119.936 3.31 . . . . 0.0 119.936 160.668 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 49.4 mt-10 -68.04 -51.34 47.96 Favored 'General case' 0 N--CA 1.502 2.128 0 N-CA-C 116.743 2.127 . . . . 0.0 116.743 175.041 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 25' ' ' ALA . . . . . . . . . . . . . . . -40.92 -46.57 2.81 Favored 'General case' 0 CA--C 1.586 2.357 0 N-CA-C 117.455 2.391 . . . . 0.0 117.455 162.953 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 26' ' ' ASN . . . . . . . . . . . . . 77.8 m-20 -86.07 -42.23 14.11 Favored 'General case' 0 N--CA 1.503 2.224 0 N-CA-C 117.168 2.284 . . . . 0.0 117.168 170.896 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 27' ' ' GLY . . . . . . . . . . . . . . . 99.53 57.0 0.95 Allowed Glycine 0 N--CA 1.493 2.455 0 N-CA-C 116.174 1.23 . . . . 0.0 116.174 -159.878 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 28' ' ' ARG . . . . . . . . . . . . . 10.7 ptt-85 -156.33 100.48 1.99 Allowed 'General case' 0 N--CA 1.493 1.688 0 N-CA-C 106.683 -1.599 . . . . 0.0 106.683 176.936 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 29' ' ' SER . . . . . . . . . . . . . 31.6 t -79.92 133.38 36.21 Favored 'General case' 0 N--CA 1.5 2.026 0 O-C-N 119.259 -2.151 . . . . 0.0 108.381 -156.322 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 30' ' ' MET . . . . . . . . . . . . . 25.1 mtp -47.21 -41.01 17.47 Favored 'General case' 0 N--CA 1.501 2.111 0 N-CA-C 119.089 2.996 . . . . 0.0 119.089 -143.371 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 31' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -47.91 -40.72 22.68 Favored 'General case' 0 CA--C 1.593 2.609 0 CA-C-N 125.318 3.69 . . . . 0.0 115.392 166.006 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 32' ' ' SER . . . . . . . . . . . . 0.37 37.4 t -54.25 -72.51 0.06 Allowed 'General case' 0 CA--C 1.576 1.946 0 N-CA-C 118.255 2.687 . . . . 0.0 118.255 145.57 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -57.3 -57.2 13.68 Favored 'General case' 0 N--CA 1.522 3.165 0 CA-C-N 125.382 3.719 . . . . 0.0 116.926 -177.693 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -40.59 -55.77 2.25 Favored 'General case' 0 CA--C 1.547 0.833 0 CA-C-O 115.698 -2.096 . . . . 0.0 108.382 169.054 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 35' ' ' LEU . . . . . . . . . . . . . 12.8 mt -59.78 -45.83 91.09 Favored 'General case' 0 C--N 1.367 1.365 0 CA-C-N 122.922 2.601 . . . . 0.0 116.135 175.575 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 36' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -56.12 -56.57 19.29 Favored 'General case' 0 CA--C 1.547 0.834 0 CA-C-O 117.534 -1.222 . . . . 0.0 113.276 175.27 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 37' ' ' ILE . . . . . . . . . . . . . 2.9 tp -63.8 -25.14 37.52 Favored 'Isoleucine or valine' 0 CA--C 1.563 1.461 0 CA-C-O 115.006 -2.426 . . . . 0.0 117.379 169.517 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 38' ' ' VAL . . . . . . . . . . . . . 3.5 t -83.29 -49.56 16.49 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.069 0 C-N-CA 127.311 2.244 . . . . 0.0 111.335 -177.018 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 26.6 mt-30 -49.66 -45.98 49.23 Favored 'General case' 0 CA--C 1.565 1.54 0 CA-C-O 118.286 -0.864 . . . . 0.0 112.214 154.614 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 40' ' ' ASP . . . . . . . . . . . . 0.343 0.2 OUTLIER -53.25 -41.28 65.31 Favored 'General case' 0 N--CA 1.492 1.636 0 N-CA-C 119.029 2.974 . . . . 0.0 119.029 157.759 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -68.3 -47.37 67.78 Favored 'General case' 0 N--CA 1.486 1.35 0 N-CA-C 114.715 1.376 . . . . 0.0 114.715 -165.646 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 1.4 pp -100.95 -12.34 19.0 Favored 'General case' 0 CA--C 1.567 1.63 0 N-CA-C 117.794 2.516 . . . . 0.0 117.794 171.708 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 43' ' ' SER . . . . . . . . . . . . . 6.6 m -75.19 -37.39 61.22 Favored 'General case' 0 N--CA 1.502 2.138 0 CA-C-N 122.5 2.409 . . . . 0.0 114.793 159.251 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 44' ' ' LYS . . . . . . . . . . . . 0.425 9.3 pttm 64.7 164.39 0.12 Allowed Pre-proline 0 CA--C 1.595 2.706 0 N-CA-C 117.265 2.32 . . . . 0.0 117.265 173.095 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 20.3 Cg_endo -68.23 105.6 1.24 Allowed 'Trans proline' 0 CA--C 1.568 2.195 0 N-CA-C 118.415 2.429 . . . . 0.0 118.415 -173.335 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 46' ' ' SER . . . . . . . . . . . . . 61.6 m -105.37 -70.78 0.03 OUTLIER Pre-proline 0 CA--C 1.577 1.998 0 CA-C-O 115.607 -2.139 . . . . 0.0 112.093 165.147 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 70.6 Cg_endo -77.11 56.44 5.43 Favored 'Trans proline' 0 CA--C 1.574 2.491 0 CA-C-N 126.155 3.234 . . . . 0.0 116.952 171.495 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 48' ' ' VAL . . . . . . . . . . . . . 3.3 p -99.01 -35.06 4.68 Favored 'Isoleucine or valine' 0 CA--C 1.576 1.957 0 C-N-CA 125.361 1.464 . . . . 0.0 114.621 -178.051 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 49' ' ' THR . . . . . . . . . . . . 0.467 1.9 t 69.58 70.72 0.25 Allowed 'General case' 0 N--CA 1.499 2.008 0 N-CA-C 116.462 2.023 . . . . 0.0 116.462 151.021 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 50' ' ' GLY . . . . . . . . . . . . . . . 115.95 -63.96 0.34 Allowed Glycine 0 N--CA 1.497 2.722 0 CA-C-O 122.442 1.023 . . . . 0.0 112.288 -178.503 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 51' ' ' TYR . . . . . . . . . . . . . 57.9 m-85 -32.98 73.22 0.0 OUTLIER 'General case' 0 CA--C 1.596 2.734 0 N-CA-C 120.814 3.635 . . . . 0.0 120.814 148.8 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 52' ' ' ARG . . . . . . . . . . . . . 96.8 mtt-85 -151.03 115.06 5.01 Favored 'General case' 0 N--CA 1.51 2.551 0 O-C-N 118.355 -2.716 . . . . 0.0 115.346 -170.356 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . 0.614 0.1 OUTLIER 80.71 145.77 0.08 Allowed 'General case' 0 CA--C 1.568 1.636 2 O-C-N 112.816 -6.178 . . . . 0.0 117.572 -16.249 . . . . . . . . 4 3 . 1 . 004 nuclear orig full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . 1.141 0.0 OUTLIER 107.85 24.77 0.0 OUTLIER 'General case' 0 N--CA 1.519 2.983 2 O-C-N 114.102 -5.374 . . . . 0.0 123.808 -6.143 . . . . . . . . 4 3 . 1 . 004 nuclear orig full ' B' B ' 55' ' ' ALA . . . . . . . . . . . . 0.622 . . -87.97 5.36 41.09 Favored 'General case' 0 CA--C 1.568 1.65 1 O-C-N 114.666 -5.021 . . . . 0.0 118.73 116.94 . . . . . . . . 3 2 . 1 . 004 nuclear orig full ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -53.05 -8.34 0.1 Allowed 'General case' 0 CA--C 1.585 2.289 0 N-CA-C 119.981 3.326 . . . . 0.0 119.981 123.511 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 57' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -94.71 -45.57 7.29 Favored 'General case' 0 N--CA 1.475 0.793 0 O-C-N 119.674 -1.891 . . . . 0.0 113.471 163.126 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 7.8 mp -43.55 -53.73 5.39 Favored 'General case' 0 N--CA 1.527 3.424 0 CA-C-N 123.026 2.648 . . . . 0.0 117.5 166.875 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 59' ' ' ALA . . . . . . . . . . . . 0.41 . . -13.6 -86.53 0.0 OUTLIER 'General case' 0 CA--C 1.555 1.14 1 N-CA-C 123.01 4.448 . . . . 0.0 123.01 132.982 . . . . . . . . 3 2 . 1 . 004 nuclear orig full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -68.59 0.12 4.5 Favored 'General case' 0 CA--C 1.559 1.315 0 N-CA-C 119.845 3.276 . . . . 0.0 119.845 -175.396 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 61' ' ' GLU . . . . . . . . . . . . 0.268 0.3 OUTLIER -59.56 -92.01 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.873 0 CA-C-O 115.377 -2.249 . . . . 0.0 106.62 138.137 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 62' ' ' GLN . . . . . . . . . . . . 0.517 14.0 mm-40 -88.15 88.47 7.65 Favored 'General case' 0 N--CA 1.488 1.441 0 CA-C-O 127.108 3.337 . . . . 0.0 112.028 -178.523 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 63' ' ' SER . . . . . . . . . . . . 2.11 4.6 t -123.88 8.69 8.75 Favored 'General case' 0 CA--C 1.598 2.805 2 O-C-N 114.609 -5.057 . . . . 0.0 122.063 69.084 . . . . . . . . 3 2 . 1 . 004 nuclear orig full ' B' B ' 64' ' ' GLU . . . . . . . . . . . . 2.413 23.9 tt0 84.83 -34.74 0.05 Allowed 'General case' 0 CA--C 1.583 2.224 1 O-C-N 116.154 -4.091 . . . . 0.0 110.474 -114.587 . . . . . . . . 3 2 . 1 . 004 nuclear orig full ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 4.4 mt -171.64 -62.95 0.02 OUTLIER 'General case' 0 N--CA 1.518 2.936 0 N-CA-C 121.324 3.824 . . . . 0.0 121.324 -112.642 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 66' ' ' VAL . . . . . . . . . . . . 0.582 0.1 OUTLIER . . . . . 0 N--CA 1.491 1.593 0 N-CA-C 121.411 3.856 . . . . 0.0 121.411 -160.885 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.563 1.471 0 N-CA-C 114.863 1.431 . . . . 0.0 114.863 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . 0.4 0.0 OUTLIER 72.26 -154.36 0.08 Allowed 'General case' 0 N--CA 1.499 2.002 1 O-C-N 113.68 -5.638 . . . . 0.0 114.335 -8.864 . . . . . . . . 4 3 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -115.65 62.4 0.7 Allowed 'General case' 0 CA--C 1.565 1.531 0 C-N-CA 125.011 1.325 . . . . 0.0 107.881 167.785 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 2.1 p30 -161.95 75.94 2.24 Favored Pre-proline 0 CA--C 1.568 1.64 0 O-C-N 121.285 -0.885 . . . . 0.0 112.969 -178.656 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 6.0 Cg_exo -100.2 155.35 0.5 Allowed 'Trans proline' 0 CA--C 1.553 1.472 0 C-N-CA 121.974 1.783 . . . . 0.0 113.835 -159.382 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 77.5 m80 -76.37 138.31 40.34 Favored 'General case' 0 CA--C 1.56 1.361 0 CA-C-N 113.664 -1.607 . . . . 0.0 113.479 -178.093 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . 0.274 36.2 p90 -116.03 164.56 14.26 Favored 'General case' 0 CA--C 1.561 1.381 0 CA-C-O 123.927 1.822 . . . . 0.0 110.244 117.003 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 26.6 p-10 -82.1 89.34 6.45 Favored 'General case' 0 CA--C 1.564 1.515 0 O-C-N 119.72 -1.863 . . . . 0.0 109.385 161.803 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 9.0 t80 -66.39 167.93 9.75 Favored 'General case' 0 CA--C 1.557 1.24 0 CA-C-O 123.96 1.838 . . . . 0.0 110.334 159.243 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 38.8 tpt85 159.85 110.03 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.482 0 O-C-N 119.411 -2.056 . . . . 0.0 106.128 -116.23 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 2.2 mpt? -119.26 -168.66 0.13 Allowed Pre-proline 0 CA--C 1.576 1.949 0 C-N-CA 120.0 -0.68 . . . . 0.0 112.711 -168.048 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -98.11 161.57 0.81 Allowed 'Trans proline' 0 CA--C 1.566 2.09 0 CA-C-O 123.393 1.331 . . . . 0.0 114.119 133.098 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 22.3 tpp -58.86 -33.81 70.89 Favored 'General case' 0 N--CA 1.497 1.911 0 N-CA-C 117.432 2.382 . . . . 0.0 117.432 -162.235 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . 0.25 9.1 pt-20 -62.26 -42.35 99.25 Favored 'General case' 0 N--CA 1.49 1.551 0 N-CA-C 116.39 1.996 . . . . 0.0 116.39 166.043 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -61.0 -48.84 87.26 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.211 0 CA-C-N 122.566 2.439 . . . . 0.0 112.872 173.358 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 4.8 ttt180 -71.7 -33.76 69.05 Favored 'General case' 0 CA--C 1.547 0.85 0 CA-C-O 116.153 -1.88 . . . . 0.0 115.635 174.185 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -59.44 -42.92 93.02 Favored 'General case' 0 N--CA 1.492 1.628 0 CA-C-N 123.986 3.085 . . . . 0.0 114.671 159.997 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . 0.271 39.9 mtmt -63.95 -49.57 72.05 Favored 'General case' 0 CA--C 1.566 1.582 0 CA-C-N 120.724 1.602 . . . . 0.0 115.142 172.054 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . 0.303 13.3 tp -67.35 -38.84 85.47 Favored 'General case' 0 CA--C 1.57 1.745 0 C-N-CA 125.824 1.65 . . . . 0.0 114.616 173.173 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 31.9 ttpt -88.0 -25.97 22.86 Favored 'General case' 0 CA--C 1.561 1.403 0 CA-C-O 117.261 -1.352 . . . . 0.0 113.663 -179.743 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 19.1 m-85 -64.04 -74.48 0.1 Allowed 'General case' 0 N--CA 1.489 1.492 0 CA-C-O 112.211 -3.756 . . . . 0.0 109.822 154.104 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . 0.275 6.0 tpp180 -14.31 -60.17 0.01 OUTLIER 'General case' 0 CA--C 1.589 2.468 1 CA-C-N 126.402 4.183 . . . . 0.0 115.473 165.754 . . . . . . . . 3 2 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -50.38 -78.95 0.02 OUTLIER 'General case' 0 CA--C 1.584 2.257 0 N-CA-C 120.375 3.472 . . . . 0.0 120.375 156.592 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 30.4 mt-10 -67.92 -34.47 76.67 Favored 'General case' 0 N--CA 1.503 2.201 0 N-CA-C 118.969 2.951 . . . . 0.0 118.969 -179.277 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -39.23 -47.79 1.7 Allowed 'General case' 0 CA--C 1.584 2.266 0 N-CA-C 116.119 1.896 . . . . 0.0 116.119 152.607 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -95.32 -51.99 4.36 Favored 'General case' 0 CA--C 1.577 2.015 0 N-CA-C 116.757 2.132 . . . . 0.0 116.757 -176.145 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 132.99 -13.3 5.0 Favored Glycine 0 CA--C 1.561 2.929 0 N-CA-C 120.445 2.938 . . . . 0.0 120.445 -150.089 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 75.8 mtm180 -90.61 151.32 21.34 Favored 'General case' 0 N--CA 1.497 1.907 0 CA-C-N 121.605 2.702 . . . . 0.0 105.608 172.195 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 35.3 t -121.64 106.01 10.95 Favored 'General case' 0 N--CA 1.502 2.143 0 O-C-N 118.14 -2.85 . . . . 0.0 106.477 -168.346 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -38.85 -44.89 1.09 Allowed 'General case' 0 N--CA 1.494 1.729 0 N-CA-C 120.785 3.624 . . . . 0.0 120.785 -140.156 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 6.5 t-20 -45.96 -47.05 16.57 Favored 'General case' 0 CA--C 1.599 2.854 0 O-C-N 117.459 -3.276 . . . . 0.0 114.3 165.552 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . 0.332 31.2 t -47.35 -73.43 0.04 OUTLIER 'General case' 0 N--CA 1.504 2.245 0 N-CA-C 118.069 2.618 . . . . 0.0 118.069 142.929 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 8.4 tm-20 -64.17 -55.23 23.24 Favored 'General case' 0 N--CA 1.501 2.103 0 N-CA-C 119.347 3.092 . . . . 0.0 119.347 -172.913 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -36.88 -52.8 0.94 Allowed 'General case' 0 CA--C 1.554 1.116 0 CA-C-O 115.764 -2.065 . . . . 0.0 107.341 163.691 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 14.0 mt -62.58 -51.99 65.18 Favored 'General case' 0 C--N 1.372 1.561 0 CA-C-N 122.925 2.602 . . . . 0.0 115.896 177.534 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -63.7 -36.05 82.57 Favored 'General case' 0 N--CA 1.484 1.257 0 N-CA-C 114.5 1.296 . . . . 0.0 114.5 -177.824 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 12.7 tt -73.01 -43.26 58.98 Favored 'Isoleucine or valine' 0 C--O 1.189 -2.099 0 CA-C-O 113.108 -3.33 . . . . 0.0 114.198 160.347 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 3.1 t -65.09 -50.17 75.74 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.647 1 CA-C-N 126.61 4.277 . . . . 0.0 113.888 -177.457 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 38.0 mt-30 -46.49 -57.93 4.25 Favored 'General case' 0 C--N 1.365 1.24 0 CA-C-O 114.131 -2.842 . . . . 0.0 108.949 158.377 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . 0.548 4.6 t70 -36.68 -56.2 0.84 Allowed 'General case' 0 N--CA 1.496 1.827 0 N-CA-C 118.301 2.704 . . . . 0.0 118.301 161.997 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . 0.261 . . -84.44 -20.33 31.96 Favored 'General case' 0 CA--C 1.544 0.713 0 N-CA-C 118.013 2.597 . . . . 0.0 118.013 -149.2 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . 0.304 1.1 pt? -96.51 -42.82 7.89 Favored 'General case' 0 N--CA 1.485 1.298 0 N-CA-C 117.933 2.568 . . . . 0.0 117.933 147.869 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 13.0 t -170.65 82.77 0.09 Allowed 'General case' 0 N--CA 1.483 1.223 0 CA-C-N 120.4 1.455 . . . . 0.0 107.474 -174.931 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . 0.32 4.2 tmtt? -37.54 -43.54 1.38 Allowed Pre-proline 0 N--CA 1.531 3.575 1 N-CA-C 122.308 4.188 . . . . 0.0 122.308 172.585 . . . . . . . . 3 2 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 11.5 Cg_endo -62.37 141.26 86.52 Favored 'Trans proline' 0 CA--C 1.563 1.929 0 N-CA-C 120.736 3.322 . . . . 0.0 120.736 -161.702 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 15.8 m -88.17 -40.87 0.48 Allowed Pre-proline 0 N--CA 1.502 2.164 0 O-C-N 116.587 -3.821 . . . . 0.0 119.24 35.174 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_exo -66.96 96.89 0.39 Allowed 'Trans proline' 0 C--N 1.375 1.926 0 CA-C-N 125.827 3.117 . . . . 0.0 116.279 -169.993 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 2.3 m -160.02 -66.34 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.509 2.507 0 O-C-N 116.448 -3.908 . . . . 0.0 107.496 30.423 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 9.0 t -70.06 39.21 0.04 OUTLIER 'General case' 0 CA--C 1.577 2.014 0 N-CA-C 118.394 2.739 . . . . 0.0 118.394 162.747 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 97.81 -115.83 5.37 Favored Glycine 0 N--CA 1.489 2.178 0 N-CA-C 110.551 -1.02 . . . . 0.0 110.551 -147.297 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 71.8 m-85 -87.63 105.62 17.47 Favored 'General case' 0 CA--C 1.581 2.17 2 O-C-N 113.457 -5.731 . . . . 0.0 111.593 -3.775 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . 0.325 7.6 tpt180 -81.35 -131.06 0.02 OUTLIER 'General case' 0 N--CA 1.51 2.527 0 O-C-N 118.355 -2.716 . . . . 0.0 113.072 -176.109 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . 0.401 8.9 m120 72.66 110.78 0.06 Allowed 'General case' 0 N--CA 1.509 2.519 0 N-CA-C 119.976 3.325 . . . . 0.0 119.976 131.133 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . 1.268 0.0 OUTLIER 46.62 5.34 0.0 OUTLIER 'General case' 0 N--CA 1.511 2.581 1 N-CA-C 123.486 4.624 . . . . 0.0 123.486 -173.96 . . . . . . . . 4 3 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . 0.396 . . -10.51 -71.22 0.0 OUTLIER 'General case' 0 CA--C 1.592 2.573 2 O-C-N 114.17 -5.332 . . . . 0.0 124.005 94.597 . . . . . . . . 3 2 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 31.3 mp0 -53.13 -0.78 0.02 OUTLIER 'General case' 0 CA--C 1.595 2.693 0 N-CA-C 118.935 2.939 . . . . 0.0 118.935 155.448 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 27.0 ttt180 -88.38 -42.03 12.44 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 119.834 -1.792 . . . . 0.0 113.712 163.333 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 5.7 mp -61.2 -44.65 96.95 Favored 'General case' 0 CA--C 1.578 2.049 0 CA-C-O 121.563 0.697 . . . . 0.0 112.06 171.781 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -36.7 -65.83 0.26 Allowed 'General case' 0 N--CA 1.484 1.274 0 N-CA-C 119.036 2.976 . . . . 0.0 119.036 146.149 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -78.42 1.58 21.65 Favored 'General case' 0 N--CA 1.486 1.328 0 N-CA-C 116.97 2.211 . . . . 0.0 116.97 -177.852 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 29.5 tt0 -74.77 -64.99 0.92 Allowed 'General case' 0 CA--C 1.55 0.953 0 CA-C-O 116.852 -1.546 . . . . 0.0 109.158 159.908 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 1.7 tp60 -70.06 -60.74 2.11 Favored 'General case' 0 C--N 1.363 1.187 0 CA-C-N 122.742 2.519 . . . . 0.0 111.39 176.155 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . 0.339 29.9 t -84.89 45.12 1.13 Allowed 'General case' 0 CA--C 1.566 1.578 0 N-CA-C 116.968 2.211 . . . . 0.0 116.968 172.242 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 -94.4 -52.44 4.34 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 119.369 -2.082 . . . . 0.0 113.374 110.645 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 20.7 mt -68.15 -19.57 64.81 Favored 'General case' 0 CA--C 1.576 1.974 0 N-CA-C 117.145 2.276 . . . . 0.0 117.145 -164.374 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 26.4 m . . . . . 0 N--CA 1.51 2.533 0 N-CA-C 117.439 2.385 . . . . 0.0 117.439 159.487 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.559 1.289 0 N-CA-C 113.649 0.981 . . . . 0.0 113.649 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 2' ' ' ARG . . . . . . . . . . . . . 25.6 ptt180 -81.01 88.13 5.96 Favored 'General case' 0 CA--C 1.567 1.624 0 CA-C-O 122.243 1.02 . . . . 0.0 112.405 171.928 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -117.66 74.89 0.96 Allowed 'General case' 0 CA--C 1.567 1.62 0 O-C-N 120.239 -1.538 . . . . 0.0 107.009 160.793 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 4' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -104.55 152.42 39.38 Favored Pre-proline 0 CA--C 1.56 1.358 1 O-C-N 115.861 -4.275 . . . . 0.0 111.341 42.678 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 21.7 Cg_exo -64.77 -172.25 0.19 Allowed 'Trans proline' 0 CA--C 1.572 2.412 0 C-N-CA 122.714 2.276 . . . . 0.0 115.921 158.51 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 6' ' ' HIS . . . . . . . . . . . . . 80.1 m80 -96.02 145.52 25.38 Favored 'General case' 0 CA--C 1.581 2.153 0 CA-C-N 113.154 -1.839 . . . . 0.0 111.287 177.978 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 7' ' ' PHE . . . . . . . . . . . . . 2.3 p90 -128.93 162.46 27.51 Favored 'General case' 0 CA--C 1.574 1.868 0 O-C-N 119.188 -2.195 . . . . 0.0 112.838 144.108 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 8' ' ' ASN . . . . . . . . . . . . . 7.9 p-10 -64.05 103.54 0.61 Allowed 'General case' 0 CA--C 1.572 1.789 0 O-C-N 120.153 -1.592 . . . . 0.0 115.134 171.646 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 9' ' ' PHE . . . . . . . . . . . . . 3.7 t80 -126.02 105.72 9.1 Favored 'General case' 0 CA--C 1.539 0.543 0 O-C-N 120.971 -1.08 . . . . 0.0 108.135 160.88 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 10' ' ' ARG . . . . . . . . . . . . 0.467 0.1 OUTLIER 94.64 87.39 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.596 1 O-C-N 114.081 -5.387 . . . . 0.0 109.519 -12.543 . . . . . . . . 4 3 . 1 . 005 nuclear orig full ' B' B ' 11' ' ' MET . . . . . . . . . . . . . 8.5 mtm -148.84 123.85 4.94 Favored Pre-proline 0 CA--C 1.566 1.568 0 CA-C-O 117.152 -1.404 . . . . 0.0 110.201 -159.133 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 12' ' ' PRO . . . . . . . . . . . . . 77.9 Cg_exo -40.76 143.16 0.62 Allowed 'Trans proline' 0 C--N 1.371 1.76 0 C-N-CA 123.467 2.778 . . . . 0.0 116.935 162.688 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 13' ' ' MET . . . . . . . . . . . . . 15.4 tpp -56.35 -32.47 64.74 Favored 'General case' 0 N--CA 1.493 1.691 0 N-CA-C 118.449 2.759 . . . . 0.0 118.449 -160.712 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 14' ' ' GLU . . . . . . . . . . . . 0.281 10.3 pt-20 -60.47 -50.92 71.64 Favored 'General case' 0 N--CA 1.49 1.534 0 N-CA-C 115.87 1.804 . . . . 0.0 115.87 162.36 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -58.35 -45.21 89.57 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.265 0 CA-C-N 122.924 2.602 . . . . 0.0 113.972 177.854 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 1.1 ttt180 -74.98 -34.4 61.99 Favored 'General case' 0 CA--C 1.544 0.727 0 CA-C-O 115.912 -1.994 . . . . 0.0 116.099 173.709 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 17' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -63.61 -39.37 94.2 Favored 'General case' 0 N--CA 1.497 1.886 0 CA-C-N 124.206 3.185 . . . . 0.0 114.052 161.632 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 44.5 mtmt -61.52 -60.55 3.52 Favored 'General case' 0 CA--C 1.568 1.641 0 CA-C-N 120.572 1.533 . . . . 0.0 114.199 169.913 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 19' ' ' LEU . . . . . . . . . . . . . 13.9 tp -60.86 -37.72 83.1 Favored 'General case' 0 N--CA 1.488 1.469 0 N-CA-C 115.249 1.574 . . . . 0.0 115.249 175.324 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 20' ' ' LYS . . . . . . . . . . . . . 19.8 ttpt -85.51 -30.87 23.09 Favored 'General case' 0 CA--C 1.561 1.366 0 CA-C-O 117.242 -1.361 . . . . 0.0 114.252 179.949 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 20.9 m-30 -64.91 -77.04 0.06 Allowed 'General case' 0 N--CA 1.491 1.598 0 CA-C-O 113.193 -3.289 . . . . 0.0 109.668 157.62 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . 0.316 0.0 OUTLIER -19.89 -53.44 0.01 OUTLIER 'General case' 0 CA--C 1.585 2.327 0 CA-C-N 125.776 3.898 . . . . 0.0 116.39 171.022 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -51.85 -80.63 0.01 OUTLIER 'General case' 0 CA--C 1.587 2.395 0 N-CA-C 118.978 2.955 . . . . 0.0 118.978 154.966 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 64.3 mm-40 -65.34 -35.28 80.5 Favored 'General case' 0 N--CA 1.501 2.099 0 N-CA-C 119.123 3.009 . . . . 0.0 119.123 -179.546 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 25' ' ' ALA . . . . . . . . . . . . . . . -39.25 -50.25 1.95 Allowed 'General case' 0 CA--C 1.588 2.43 0 N-CA-C 116.288 1.958 . . . . 0.0 116.288 153.38 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 26' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -95.65 -47.14 6.33 Favored 'General case' 0 CA--C 1.576 1.951 0 N-CA-C 116.592 2.071 . . . . 0.0 116.592 -174.059 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 27' ' ' GLY . . . . . . . . . . . . . . . 128.29 14.86 2.35 Favored Glycine 0 N--CA 1.498 2.822 0 N-CA-C 119.024 2.37 . . . . 0.0 119.024 -161.227 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 28' ' ' ARG . . . . . . . . . . . . . 79.0 mtm-85 -112.26 149.23 32.63 Favored 'General case' 0 N--CA 1.492 1.643 0 N-CA-C 104.779 -2.304 . . . . 0.0 104.779 168.766 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 29' ' ' SER . . . . . . . . . . . . . 92.3 p -117.93 109.58 16.68 Favored 'General case' 0 N--CA 1.503 2.185 0 O-C-N 118.053 -2.905 . . . . 0.0 105.786 -167.89 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 30' ' ' MET . . . . . . . . . . . . . 18.5 mtp -42.35 -42.73 3.27 Favored 'General case' 0 N--CA 1.499 1.985 0 N-CA-C 118.8 2.889 . . . . 0.0 118.8 -140.457 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 31' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -47.02 -42.63 18.53 Favored 'General case' 0 CA--C 1.592 2.586 0 CA-C-N 125.727 3.876 . . . . 0.0 115.556 165.444 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 32' ' ' SER . . . . . . . . . . . . 0.294 32.1 t -53.33 -67.8 0.23 Allowed 'General case' 0 N--CA 1.499 2.002 0 N-CA-C 119.048 2.981 . . . . 0.0 119.048 144.829 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -62.36 -59.85 4.4 Favored 'General case' 0 N--CA 1.513 2.687 0 CA-C-N 124.112 3.142 . . . . 0.0 117.066 -178.569 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -34.74 -56.96 0.54 Allowed 'General case' 0 CA--C 1.547 0.832 0 CA-C-O 115.413 -2.232 . . . . 0.0 109.61 164.426 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 35' ' ' LEU . . . . . . . . . . . . . 10.1 mt -61.55 -49.28 77.31 Favored 'General case' 0 C--N 1.367 1.359 0 CA-C-N 123.145 2.702 . . . . 0.0 116.164 177.055 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 36' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -54.92 -52.88 61.58 Favored 'General case' 0 CA--C 1.574 1.901 0 CA-C-O 116.874 -1.536 . . . . 0.0 114.026 173.95 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 37' ' ' ILE . . . . . . . . . . . . . 4.3 tt -64.29 -30.71 50.88 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.861 0 CA-C-N 122.546 2.43 . . . . 0.0 115.957 168.821 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 38' ' ' VAL . . . . . . . . . . . . . 3.5 t -73.96 -46.75 45.19 Favored 'Isoleucine or valine' 0 CA--C 1.575 1.923 0 CA-C-N 121.441 1.928 . . . . 0.0 110.967 -179.71 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 31.2 mt-30 -52.08 -43.07 63.68 Favored 'General case' 0 CA--C 1.572 1.801 0 N-CA-C 114.13 1.159 . . . . 0.0 114.13 155.413 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 40' ' ' ASP . . . . . . . . . . . . 0.385 15.6 m-20 -53.53 -42.01 66.99 Favored 'General case' 0 N--CA 1.495 1.817 0 N-CA-C 116.782 2.141 . . . . 0.0 116.782 156.055 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -70.34 -38.2 74.82 Favored 'General case' 0 CA--C 1.562 1.427 0 N-CA-C 115.27 1.581 . . . . 0.0 115.27 -171.609 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 3.8 mt -85.52 -35.88 20.85 Favored 'General case' 0 CA--C 1.565 1.535 0 C-N-CA 125.635 1.574 . . . . 0.0 114.258 174.066 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 43' ' ' SER . . . . . . . . . . . . . 47.6 t -61.53 -61.76 2.3 Favored 'General case' 0 N--CA 1.497 1.875 0 N-CA-C 114.673 1.36 . . . . 0.0 114.673 164.742 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 44' ' ' LYS . . . . . . . . . . . . 0.533 6.8 mtmp? 96.8 -72.42 0.0 OUTLIER Pre-proline 0 CA--C 1.582 2.198 0 N-CA-C 116.327 1.973 . . . . 0.0 116.327 179.871 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 79.8 Cg_endo -88.75 139.46 3.92 Favored 'Trans proline' 0 CA--C 1.563 1.975 0 CA-C-N 125.253 2.912 . . . . 0.0 116.775 -163.538 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 46' ' ' SER . . . . . . . . . . . . . 26.5 t -85.25 147.78 48.28 Favored Pre-proline 0 CA--C 1.582 2.206 0 O-C-N 120.177 -1.577 . . . . 0.0 110.756 114.112 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 84.9 Cg_endo -73.98 71.07 4.32 Favored 'Trans proline' 0 CA--C 1.573 2.428 0 CA-C-N 123.844 2.409 . . . . 0.0 115.72 -179.325 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 48' ' ' VAL . . . . . . . . . . . . . 8.2 p -165.97 120.17 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.644 0 N-CA-C 108.162 -1.051 . . . . 0.0 108.162 -169.513 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 49' ' ' THR . . . . . . . . . . . . . 76.7 p -129.02 57.13 1.65 Allowed 'General case' 0 N--CA 1.505 2.281 0 CA-C-O 122.22 1.009 . . . . 0.0 113.164 -179.207 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 50' ' ' GLY . . . . . . . . . . . . . . . -99.53 36.33 4.14 Favored Glycine 0 N--CA 1.497 2.764 0 N-CA-C 117.723 1.849 . . . . 0.0 117.723 173.144 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 51' ' ' TYR . . . . . . . . . . . . 0.25 0.0 OUTLIER -135.85 13.95 3.38 Favored 'General case' 0 CA--C 1.584 2.286 0 N-CA-C 115.884 1.809 . . . . 0.0 115.884 -172.907 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 52' ' ' ARG . . . . . . . . . . . . 0.779 11.6 mpt_? 102.22 -23.06 0.02 OUTLIER 'General case' 0 CA--C 1.621 3.689 1 N-CA-C 128.49 6.478 . . . . 0.0 128.49 169.76 . . . . . . . . 3 2 . 1 . 005 nuclear orig full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . 0.596 0.0 OUTLIER -176.23 -161.1 0.07 Allowed 'General case' 0 N--CA 1.503 2.213 2 O-C-N 106.107 -10.371 . . . . 0.0 121.428 -12.276 . . . . . . . . 4 3 . 1 . 005 nuclear orig full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . 0.585 0.0 OUTLIER -64.9 -4.86 4.95 Favored 'General case' 0 N--CA 1.506 2.339 1 CA-C-N 126.205 4.093 . . . . 0.0 117.386 175.22 . . . . . . . . 4 3 . 1 . 005 nuclear orig full ' B' B ' 55' ' ' ALA . . . . . . . . . . . . 0.347 . . -0.59 -131.0 0.0 OUTLIER 'General case' 0 CA--C 1.566 1.582 1 N-CA-C 124.543 5.016 . . . . 0.0 124.543 108.752 . . . . . . . . 3 2 . 1 . 005 nuclear orig full ' B' B ' 56' ' ' GLU . . . . . . . . . . . . 0.299 6.6 tp10 -38.79 -25.69 0.01 OUTLIER 'General case' 0 CA--C 1.583 2.247 0 N-CA-C 119.582 3.179 . . . . 0.0 119.582 155.641 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 57' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -94.46 -31.62 13.88 Favored 'General case' 0 CA--C 1.564 1.481 0 O-C-N 119.047 -2.283 . . . . 0.0 110.165 -176.788 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 58' ' ' LEU . . . . . . . . . . . . 0.626 89.5 mt -89.09 0.37 56.76 Favored 'General case' 0 CA--C 1.592 2.594 0 O-C-N 118.051 -2.905 . . . . 0.0 115.751 157.496 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 59' ' ' ALA . . . . . . . . . . . . . . . -56.17 -39.02 71.7 Favored 'General case' 0 N--CA 1.485 1.295 0 O-C-N 117.422 -3.299 . . . . 0.0 117.762 133.003 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -56.57 -27.8 58.72 Favored 'General case' 0 N--CA 1.508 2.472 0 CA-C-N 123.532 2.878 . . . . 0.0 117.22 158.389 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 61' ' ' GLU . . . . . . . . . . . . 0.42 0.5 OUTLIER -53.8 -65.62 0.54 Allowed 'General case' 0 N--CA 1.494 1.737 0 CA-C-O 116.305 -1.807 . . . . 0.0 111.251 154.782 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 4.6 tp60 -60.22 -55.59 31.94 Favored 'General case' 0 CA--C 1.57 1.726 0 CA-C-N 122.798 2.545 . . . . 0.0 112.906 -174.662 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 23.8 m -9.69 -64.51 0.0 OUTLIER 'General case' 0 N--CA 1.506 2.354 1 N-CA-C 124.262 4.912 . . . . 0.0 124.262 150.829 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 64' ' ' GLU . . . . . . . . . . . . 0.399 66.8 mt-10 -93.85 8.44 41.17 Favored 'General case' 0 CA--C 1.591 2.548 0 CA-C-N 115.625 -0.716 . . . . 0.0 111.62 -179.883 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -105.69 22.37 15.66 Favored 'General case' 0 CA--C 1.61 3.287 0 C-N-CA 127.398 2.279 . . . . 0.0 112.634 144.53 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 66' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.507 2.384 0 C-N-CA 127.743 2.417 . . . . 0.0 108.033 -171.336 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.564 1.505 0 N-CA-C 114.031 1.122 . . . . 0.0 114.031 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 1.1 mpm_? -84.51 69.38 10.56 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 120.614 -1.304 . . . . 0.0 114.074 -168.627 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 9.1 p-10 -148.38 63.09 1.09 Allowed 'General case' 0 N--CA 1.491 1.589 0 O-C-N 120.944 -1.097 . . . . 0.0 109.495 -178.597 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 6.7 p-10 -144.89 81.18 10.9 Favored Pre-proline 0 CA--C 1.567 1.601 0 O-C-N 121.078 -1.014 . . . . 0.0 111.155 176.078 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 5.5 Cg_exo -100.19 146.1 0.39 Allowed 'Trans proline' 0 C--N 1.366 1.476 0 C-N-CA 122.065 1.844 . . . . 0.0 112.618 -160.58 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 66.1 m80 -68.31 146.79 52.96 Favored 'General case' 0 N--CA 1.485 1.294 0 N-CA-C 114.415 1.265 . . . . 0.0 114.415 -179.971 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 20.2 p90 -138.62 160.12 40.4 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 120.918 -1.114 . . . . 0.0 112.336 135.275 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 21.1 m120 -55.22 100.81 0.04 OUTLIER 'General case' 0 CA--C 1.572 1.808 0 N-CA-C 114.869 1.433 . . . . 0.0 114.869 174.168 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 10.1 t80 -130.97 103.78 6.74 Favored 'General case' 0 C--N 1.34 0.179 0 N-CA-C 106.685 -1.598 . . . . 0.0 106.685 165.479 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . 0.495 0.0 OUTLIER 88.42 68.66 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.691 1 O-C-N 114.367 -5.208 . . . . 0.0 112.533 -9.774 . . . . . . . . 4 3 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 8.4 ptp -144.02 116.77 5.71 Favored Pre-proline 0 CA--C 1.571 1.779 0 CA-C-O 115.114 -2.374 . . . . 0.0 109.27 -164.545 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 63.3 Cg_exo -34.69 143.94 0.06 OUTLIER 'Trans proline' 0 C--N 1.379 2.176 0 C-N-CA 124.667 3.578 . . . . 0.0 119.631 -172.564 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 4.4 tpp -44.35 -41.59 6.2 Favored 'General case' 0 CA--C 1.581 2.141 0 N-CA-C 116.598 2.073 . . . . 0.0 116.598 -161.042 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -63.43 -44.29 95.01 Favored 'General case' 0 CA--C 1.571 1.788 0 N-CA-C 117.379 2.363 . . . . 0.0 117.379 167.979 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 1.6 t -54.56 -45.15 71.21 Favored 'Isoleucine or valine' 0 N--CA 1.513 2.705 0 CA-C-N 122.935 2.607 . . . . 0.0 113.301 169.63 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 7.1 ttt180 -74.87 -43.25 55.43 Favored 'General case' 0 C--O 1.212 -0.918 0 CA-C-O 116.107 -1.902 . . . . 0.0 115.093 174.908 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 47.9 mt-10 -58.26 -32.1 68.05 Favored 'General case' 0 N--CA 1.493 1.681 0 CA-C-N 124.126 3.148 . . . . 0.0 115.266 163.296 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . 0.292 54.1 mtmt -67.82 -54.0 22.52 Favored 'General case' 0 CA--C 1.564 1.516 0 CA-C-N 121.112 1.778 . . . . 0.0 114.737 166.182 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . 0.288 14.9 tp -67.08 -33.84 76.37 Favored 'General case' 0 CA--C 1.574 1.874 0 N-CA-C 115.254 1.576 . . . . 0.0 115.254 175.632 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 15.0 ttpt -91.71 -28.58 17.34 Favored 'General case' 0 CA--C 1.555 1.162 0 C-N-CA 126.788 2.035 . . . . 0.0 114.143 -178.671 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 22.1 m-30 -63.18 -71.21 0.17 Allowed 'General case' 0 N--CA 1.49 1.526 0 CA-C-O 113.265 -3.255 . . . . 0.0 109.383 153.841 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . 0.304 0.0 OUTLIER -25.09 -53.35 0.04 OUTLIER 'General case' 0 CA--C 1.587 2.399 0 CA-C-N 125.71 3.868 . . . . 0.0 116.158 171.393 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -50.61 -79.22 0.02 OUTLIER 'General case' 0 CA--C 1.585 2.296 0 N-CA-C 119.806 3.261 . . . . 0.0 119.806 154.557 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 75.2 mm-40 -69.67 -33.86 73.17 Favored 'General case' 0 N--CA 1.499 2.007 0 N-CA-C 118.809 2.892 . . . . 0.0 118.809 -177.251 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -40.72 -48.73 3.02 Favored 'General case' 0 CA--C 1.584 2.257 0 N-CA-C 116.307 1.965 . . . . 0.0 116.307 152.72 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . 0.254 0.0 OUTLIER -98.51 -40.04 8.44 Favored 'General case' 0 CA--C 1.577 1.988 0 N-CA-C 117.416 2.376 . . . . 0.0 117.416 -172.097 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 137.83 6.22 1.55 Allowed Glycine 0 N--CA 1.5 2.919 0 N-CA-C 120.368 2.907 . . . . 0.0 120.368 -168.595 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 32.4 mtm-85 -116.83 165.78 12.91 Favored 'General case' 0 N--CA 1.492 1.653 0 CA-C-N 120.989 2.394 . . . . 0.0 108.17 173.885 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 8.6 t -123.76 116.78 23.57 Favored 'General case' 0 N--CA 1.496 1.841 0 N-CA-C 105.206 -2.146 . . . . 0.0 105.206 -177.952 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 13.2 mtp -43.38 -42.57 4.7 Favored 'General case' 0 N--CA 1.497 1.908 0 N-CA-C 119.101 3.0 . . . . 0.0 119.101 -143.886 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . 0.258 0.1 OUTLIER -48.09 -41.97 27.65 Favored 'General case' 0 CA--C 1.592 2.594 0 CA-C-N 125.255 3.661 . . . . 0.0 114.957 166.522 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . 0.333 34.8 t -52.6 -64.04 0.95 Allowed 'General case' 0 N--CA 1.499 2.005 0 N-CA-C 120.507 3.521 . . . . 0.0 120.507 145.569 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 2.8 tp10 -72.48 -53.24 12.66 Favored 'General case' 0 N--CA 1.512 2.639 0 CA-C-N 123.461 2.846 . . . . 0.0 117.852 -177.523 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -38.47 -54.18 1.5 Allowed 'General case' 0 CA--C 1.554 1.133 0 CA-C-O 115.773 -2.06 . . . . 0.0 109.429 162.097 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 15.1 mt -63.38 -54.96 28.66 Favored 'General case' 0 C--N 1.37 1.481 0 CA-C-N 123.51 2.868 . . . . 0.0 114.935 176.398 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -52.4 -44.32 65.29 Favored 'General case' 0 CA--C 1.564 1.512 0 CA-C-O 116.818 -1.563 . . . . 0.0 115.04 175.868 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -68.58 -41.08 82.71 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.533 0 CA-C-N 121.946 2.157 . . . . 0.0 114.532 169.928 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 3.8 t -71.76 -46.24 62.37 Favored 'Isoleucine or valine' 0 CA--C 1.583 2.218 0 CA-C-N 121.393 1.906 . . . . 0.0 111.241 -178.108 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 26.5 mt-30 -51.8 -43.05 62.92 Favored 'General case' 0 N--CA 1.488 1.465 0 C-N-CA 124.65 1.18 . . . . 0.0 114.134 156.261 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . 0.459 24.2 m-20 -46.5 -56.47 5.93 Favored 'General case' 0 N--CA 1.488 1.461 0 N-CA-C 114.225 1.195 . . . . 0.0 114.225 155.622 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . 0.362 . . -83.35 -39.71 20.38 Favored 'General case' 0 CA--C 1.543 0.704 0 N-CA-C 118.526 2.787 . . . . 0.0 118.526 -154.634 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 1.4 pp -102.08 -0.8 32.88 Favored 'General case' 0 CA--C 1.563 1.457 0 N-CA-C 117.841 2.534 . . . . 0.0 117.841 159.706 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 26.8 t -126.39 -7.15 6.39 Favored 'General case' 0 N--CA 1.496 1.842 0 CA-C-N 123.521 2.873 . . . . 0.0 118.697 178.873 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . 0.334 4.2 tmmm? -93.01 -53.04 0.26 Allowed Pre-proline 0 N--CA 1.506 2.359 0 CA-C-N 123.833 3.015 . . . . 0.0 118.91 -168.346 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -89.42 147.86 5.23 Favored 'Trans proline' 0 CA--C 1.567 2.139 0 CA-C-N 124.894 2.783 . . . . 0.0 118.99 -157.613 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 86.8 p -74.83 128.89 84.5 Favored Pre-proline 0 N--CA 1.5 2.029 0 O-C-N 117.407 -3.308 . . . . 0.0 115.306 48.707 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 84.8 Cg_endo -76.61 -72.6 0.01 OUTLIER 'Trans proline' 0 CA--C 1.555 1.573 0 CA-C-N 122.943 2.087 . . . . 0.0 115.02 -167.976 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 6.8 p -161.48 -68.26 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.496 1.867 0 CA-C-N 110.017 -3.265 . . . . 0.0 108.016 166.829 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 11.2 t -80.04 26.04 0.36 Allowed 'General case' 0 CA--C 1.567 1.631 0 N-CA-C 119.204 3.039 . . . . 0.0 119.204 -179.63 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 67.8 -49.51 0.34 Allowed Glycine 0 CA--C 1.562 2.997 0 N-CA-C 118.782 2.273 . . . . 0.0 118.782 -167.802 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . 0.549 7.9 m-85 78.25 -35.17 0.19 Allowed 'General case' 0 N--CA 1.496 1.842 0 N-CA-C 120.954 3.687 . . . . 0.0 120.954 -177.715 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . 0.403 39.1 ttt180 112.3 -58.5 0.0 OUTLIER 'General case' 0 N--CA 1.508 2.458 0 C-N-CA 127.251 2.22 . . . . 0.0 116.515 -169.248 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . 0.399 58.3 m-80 -87.81 -59.02 2.36 Favored 'General case' 0 CA--C 1.564 1.513 2 O-C-N 112.497 -6.377 . . . . 0.0 118.191 22.555 . . . . . . . . 3 2 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 21.2 m-20 -92.67 60.36 3.46 Favored 'General case' 0 CA--C 1.556 1.188 2 O-C-N 109.575 -8.203 . . . . 0.0 114.693 6.067 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . 0.431 . . -74.68 -2.85 28.07 Favored 'General case' 0 CA--C 1.589 2.461 0 O-C-N 116.398 -3.939 . . . . 0.0 119.999 125.061 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -53.05 -26.78 17.02 Favored 'General case' 0 CA--C 1.591 2.545 0 O-C-N 118.158 -2.839 . . . . 0.0 116.546 129.969 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . 0.383 4.8 mpt_? -79.38 -13.31 59.7 Favored 'General case' 0 CA--C 1.572 1.792 0 O-C-N 116.595 -3.815 . . . . 0.0 114.873 158.303 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . 0.34 3.4 mp -75.06 3.1 9.08 Favored 'General case' 0 CA--C 1.609 3.223 0 O-C-N 116.536 -3.853 . . . . 0.0 115.51 144.401 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -71.49 -12.95 61.65 Favored 'General case' 0 N--CA 1.507 2.392 1 O-C-N 115.954 -4.216 . . . . 0.0 119.854 135.454 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -65.59 -26.14 67.71 Favored 'General case' 0 N--CA 1.524 3.228 0 O-C-N 118.231 -2.793 . . . . 0.0 118.513 138.111 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . 0.606 42.3 mm-40 -58.73 -21.97 56.48 Favored 'General case' 0 CA--C 1.569 1.705 0 C-N-CA 116.889 -1.924 . . . . 0.0 113.998 150.119 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . 0.356 0.0 OUTLIER -68.35 -36.24 78.94 Favored 'General case' 0 N--CA 1.491 1.604 0 CA-C-N 123.667 2.939 . . . . 0.0 114.62 151.308 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 75.6 m -42.65 -54.06 4.18 Favored 'General case' 0 N--CA 1.532 3.671 1 CA-C-N 127.336 4.607 . . . . 0.0 117.465 168.677 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . 0.475 0.4 OUTLIER -31.95 -102.78 0.0 OUTLIER 'General case' 0 CA--C 1.587 2.388 0 N-CA-C 117.267 2.321 . . . . 0.0 117.267 133.969 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . 0.251 0.7 OUTLIER -76.71 49.39 0.62 Allowed 'General case' 0 CA--C 1.588 2.437 0 CA-C-N 124.153 3.16 . . . . 0.0 118.852 -174.021 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.5 2.029 0 C-N-CA 125.589 1.556 . . . . 0.0 107.636 173.347 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.557 1.224 0 N-CA-C 113.674 0.99 . . . . 0.0 113.674 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 2' ' ' ARG . . . . . . . . . . . . . 88.5 mtt180 -94.94 81.73 3.76 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.566 -0.709 . . . . 0.0 110.6 169.7 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . 0.292 5.2 p-10 -168.72 -39.96 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.611 0 N-CA-C 114.982 1.475 . . . . 0.0 114.982 178.162 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 4' ' ' ASP . . . . . . . . . . . . . 23.4 m-20 -109.14 113.87 58.53 Favored Pre-proline 0 CA--C 1.582 2.192 0 N-CA-C 115.684 1.735 . . . . 0.0 115.684 178.744 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 5' ' ' PRO . . . . . . . . . . . . 0.619 7.6 Cg_exo 52.93 -84.55 0.0 OUTLIER 'Trans proline' 0 N--CA 1.492 1.407 1 N-CA-C 126.262 5.447 . . . . 0.0 126.262 89.797 . . . . . . . . 3 2 . 1 . 006 nuclear orig full ' B' B ' 6' ' ' HIS . . . . . . . . . . . . . 64.9 m80 -75.17 111.73 10.71 Favored 'General case' 0 CA--C 1.564 1.503 0 N-CA-C 115.508 1.67 . . . . 0.0 115.508 -149.396 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 7' ' ' PHE . . . . . . . . . . . . 0.292 30.7 p90 -122.09 -166.22 1.37 Allowed 'General case' 0 CA--C 1.563 1.462 0 O-C-N 120.35 -1.469 . . . . 0.0 108.919 128.772 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 8' ' ' ASN . . . . . . . . . . . . . 34.6 m-20 -116.09 105.65 12.85 Favored 'General case' 0 CA--C 1.555 1.166 0 O-C-N 120.102 -1.624 . . . . 0.0 107.37 166.598 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 9' ' ' PHE . . . . . . . . . . . . 0.25 5.0 t80 -71.75 92.72 1.22 Allowed 'General case' 0 CA--C 1.576 1.977 0 CA-C-O 126.676 3.131 . . . . 0.0 113.256 176.126 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 10' ' ' ARG . . . . . . . . . . . . . 28.5 ptt85 -81.9 130.14 34.98 Favored 'General case' 0 N--CA 1.48 1.05 1 CA-C-N 108.291 -4.05 . . . . 0.0 111.256 168.498 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 11' ' ' MET . . . . . . . . . . . . . 28.3 mtm -136.44 121.91 13.31 Favored Pre-proline 0 CA--C 1.565 1.527 0 CA-C-O 117.509 -1.234 . . . . 0.0 111.7 -163.703 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 12' ' ' PRO . . . . . . . . . . . . . 80.3 Cg_exo -43.66 145.03 1.95 Allowed 'Trans proline' 0 C--N 1.378 2.123 0 C-N-CA 123.913 3.076 . . . . 0.0 116.02 169.23 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 13' ' ' MET . . . . . . . . . . . . . 15.7 tpp -60.8 -34.06 73.93 Favored 'General case' 0 N--CA 1.492 1.655 0 N-CA-C 117.083 2.253 . . . . 0.0 117.083 -150.559 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -59.7 -49.31 78.23 Favored 'General case' 0 CA--C 1.573 1.861 0 N-CA-C 117.688 2.477 . . . . 0.0 117.688 161.335 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -58.28 -48.06 85.91 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.453 0 CA-C-N 123.369 2.804 . . . . 0.0 113.331 174.253 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 4.2 ttt180 -71.21 -37.23 72.08 Favored 'General case' 0 C--O 1.216 -0.703 0 CA-C-O 115.951 -1.976 . . . . 0.0 115.519 173.024 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 17' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -60.6 -35.81 77.02 Favored 'General case' 0 CA--C 1.569 1.709 0 CA-C-N 124.119 3.145 . . . . 0.0 114.185 161.578 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . 0.291 44.1 mtmt -67.79 -48.71 65.54 Favored 'General case' 0 CA--C 1.566 1.574 0 CA-C-N 121.443 1.929 . . . . 0.0 115.483 169.55 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 19' ' ' LEU . . . . . . . . . . . . 0.278 0.4 OUTLIER -70.49 -36.29 73.73 Favored 'General case' 0 CA--C 1.574 1.891 0 CA-C-N 120.904 1.684 . . . . 0.0 115.06 173.604 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 20' ' ' LYS . . . . . . . . . . . . . 15.8 ttpt -88.34 -27.89 21.35 Favored 'General case' 0 CA--C 1.555 1.168 0 C-N-CA 125.822 1.649 . . . . 0.0 113.682 178.729 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 22.1 m-30 -64.09 -72.89 0.13 Allowed 'General case' 0 N--CA 1.49 1.545 1 CA-C-O 111.469 -4.11 . . . . 0.0 109.598 156.052 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . 0.253 12.0 tpp180 -13.19 -61.04 0.01 OUTLIER 'General case' 0 CA--C 1.592 2.558 1 CA-C-N 127.07 4.487 . . . . 0.0 116.34 164.519 . . . . . . . . 3 2 . 1 . 006 nuclear orig full ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -54.96 -75.86 0.03 OUTLIER 'General case' 0 CA--C 1.59 2.486 0 N-CA-C 119.29 3.07 . . . . 0.0 119.29 160.561 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 52.6 mt-10 -68.46 -34.77 76.54 Favored 'General case' 0 N--CA 1.504 2.263 0 N-CA-C 118.819 2.896 . . . . 0.0 118.819 -179.345 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 25' ' ' ALA . . . . . . . . . . . . . . . -38.31 -46.87 1.15 Allowed 'General case' 0 CA--C 1.579 2.062 0 N-CA-C 115.973 1.842 . . . . 0.0 115.973 152.321 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 26' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -98.66 -51.21 3.99 Favored 'General case' 0 CA--C 1.577 1.984 0 N-CA-C 117.458 2.392 . . . . 0.0 117.458 -173.651 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 27' ' ' GLY . . . . . . . . . . . . . . . 117.69 23.47 3.68 Favored Glycine 0 CA--C 1.563 3.082 0 N-CA-C 119.575 2.59 . . . . 0.0 119.575 -151.251 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 28' ' ' ARG . . . . . . . . . . . . . 16.8 mtt85 -112.47 147.44 36.52 Favored 'General case' 0 CA--C 1.572 1.821 0 N-CA-C 103.769 -2.678 . . . . 0.0 103.769 158.984 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 29' ' ' SER . . . . . . . . . . . . . 35.6 t -113.42 112.18 23.2 Favored 'General case' 0 N--CA 1.505 2.302 0 O-C-N 117.793 -3.067 . . . . 0.0 105.67 -172.884 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 30' ' ' MET . . . . . . . . . . . . . 22.7 mtp -40.65 -45.61 2.4 Favored 'General case' 0 N--CA 1.5 2.038 0 N-CA-C 118.822 2.897 . . . . 0.0 118.822 -144.364 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 31' ' ' ASN . . . . . . . . . . . . . 20.0 t-20 -44.44 -44.03 8.18 Favored 'General case' 0 CA--C 1.594 2.673 0 CA-C-N 125.494 3.77 . . . . 0.0 115.576 165.045 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 32' ' ' SER . . . . . . . . . . . . 0.279 56.3 m -57.36 -60.42 3.67 Favored 'General case' 0 N--CA 1.5 2.034 0 N-CA-C 120.7 3.593 . . . . 0.0 120.7 148.464 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -67.49 -61.64 1.8 Allowed 'General case' 0 N--CA 1.51 2.542 0 CA-C-N 123.666 2.939 . . . . 0.0 115.293 177.667 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -32.17 -53.78 0.3 Allowed 'General case' 0 N--CA 1.481 1.091 0 CA-C-O 115.289 -2.291 . . . . 0.0 109.266 163.967 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 35' ' ' LEU . . . . . . . . . . . . . 11.8 mt -62.28 -54.42 41.01 Favored 'General case' 0 C--N 1.368 1.382 0 CA-C-N 123.528 2.876 . . . . 0.0 115.053 176.275 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 36' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -59.86 -39.46 85.29 Favored 'General case' 0 CA--C 1.569 1.679 0 CA-C-O 116.302 -1.809 . . . . 0.0 115.582 175.479 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 37' ' ' ILE . . . . . . . . . . . . . 10.4 tt -68.55 -26.3 33.02 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.622 0 CA-C-N 123.452 2.842 . . . . 0.0 115.253 162.668 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 38' ' ' VAL . . . . . . . . . . . . . 4.3 t -86.68 -47.05 16.36 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.094 0 CA-C-N 125.037 3.562 . . . . 0.0 112.77 -178.891 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 27.8 mt-30 -46.07 -49.37 16.5 Favored 'General case' 0 N--CA 1.484 1.269 0 CA-C-O 116.119 -1.896 . . . . 0.0 113.068 150.961 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 40' ' ' ASP . . . . . . . . . . . . 0.374 50.1 t0 -44.01 -61.3 1.5 Allowed 'General case' 0 N--CA 1.494 1.76 0 CA-C-N 120.892 1.678 . . . . 0.0 114.638 154.533 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -82.62 19.21 1.33 Allowed 'General case' 0 CA--C 1.55 0.98 0 N-CA-C 120.556 3.539 . . . . 0.0 120.556 -162.39 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -147.78 -9.54 0.41 Allowed 'General case' 0 N--CA 1.484 1.232 0 N-CA-C 116.358 1.985 . . . . 0.0 116.358 143.772 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 43' ' ' SER . . . . . . . . . . . . . 86.7 p -149.56 10.62 0.75 Allowed 'General case' 0 N--CA 1.486 1.37 0 N-CA-C 118.144 2.646 . . . . 0.0 118.144 -163.071 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 44' ' ' LYS . . . . . . . . . . . . 0.313 7.6 tmtt? -32.36 -61.49 0.32 Allowed Pre-proline 0 N--CA 1.523 3.18 1 N-CA-C 125.042 5.201 . . . . 0.0 125.042 -159.05 . . . . . . . . 3 2 . 1 . 006 nuclear orig full ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 12.4 Cg_endo -66.49 101.21 0.52 Allowed 'Trans proline' 0 CA--C 1.567 2.145 0 N-CA-C 120.709 3.311 . . . . 0.0 120.709 -136.881 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 46' ' ' SER . . . . . . . . . . . . . 69.7 m -69.2 140.52 90.7 Favored Pre-proline 0 CA--C 1.585 2.323 0 O-C-N 120.602 -1.311 . . . . 0.0 112.187 120.504 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -75.0 90.6 1.07 Allowed 'Trans proline' 0 CA--C 1.569 2.255 0 C-N-CA 122.545 2.163 . . . . 0.0 116.267 -166.491 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 48' ' ' VAL . . . . . . . . . . . . . 34.8 m -133.93 17.84 1.31 Allowed 'Isoleucine or valine' 0 N--CA 1.502 2.127 0 N-CA-C 118.4 2.741 . . . . 0.0 118.4 -178.246 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 49' ' ' THR . . . . . . . . . . . . . 61.2 p -145.3 96.9 2.91 Favored 'General case' 0 N--CA 1.496 1.858 2 O-C-N 109.269 -8.394 . . . . 0.0 109.846 11.844 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 50' ' ' GLY . . . . . . . . . . . . . . . -170.14 -93.0 0.09 OUTLIER Glycine 0 N--CA 1.488 2.151 0 CA-C-O 119.534 -0.592 . . . . 0.0 112.286 176.957 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 51' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -156.69 38.11 0.32 Allowed 'General case' 0 CA--C 1.586 2.329 2 O-C-N 115.237 -4.684 . . . . 0.0 113.498 -12.895 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 52' ' ' ARG . . . . . . . . . . . . . 33.1 ptt85 -84.8 141.54 30.42 Favored 'General case' 0 N--CA 1.505 2.28 0 O-C-N 119.72 -1.862 . . . . 0.0 115.081 -177.561 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . 0.77 0.0 OUTLIER -56.54 128.29 35.44 Favored 'General case' 0 N--CA 1.496 1.871 0 CA-C-N 122.211 2.278 . . . . 0.0 114.828 172.324 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . 0.341 3.4 m-20 -101.11 48.03 0.9 Allowed 'General case' 0 CA--C 1.583 2.226 0 CA-C-O 126.984 3.278 . . . . 0.0 110.718 135.95 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 55' ' ' ALA . . . . . . . . . . . . 0.331 . . -87.01 -9.03 56.54 Favored 'General case' 0 CA--C 1.555 1.166 1 O-C-N 116.212 -4.055 . . . . 0.0 117.822 136.302 . . . . . . . . 3 2 . 1 . 006 nuclear orig full ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 -37.64 -14.65 0.0 OUTLIER 'General case' 0 CA--C 1.584 2.264 1 N-CA-C 124.572 5.027 . . . . 0.0 124.572 113.901 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 57' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -90.59 -44.17 9.72 Favored 'General case' 0 CA--C 1.565 1.536 0 O-C-N 119.297 -2.127 . . . . 0.0 114.798 155.618 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -42.2 -62.7 0.88 Allowed 'General case' 0 N--CA 1.527 3.394 0 CA-C-N 122.024 2.193 . . . . 0.0 115.708 164.984 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 59' ' ' ALA . . . . . . . . . . . . 0.374 . . -5.09 -76.92 0.0 OUTLIER 'General case' 0 CA--C 1.547 0.862 1 N-CA-C 124.717 5.08 . . . . 0.0 124.717 131.946 . . . . . . . . 3 2 . 1 . 006 nuclear orig full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 6.0 t0 -60.32 -9.32 3.34 Favored 'General case' 0 CA--C 1.573 1.844 0 CA-C-N 124.744 3.429 . . . . 0.0 116.854 170.741 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 61.4 tt0 -70.75 -45.74 64.24 Favored 'General case' 0 N--CA 1.499 2.014 0 CA-C-N 122.984 2.629 . . . . 0.0 113.609 155.926 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 62' ' ' GLN . . . . . . . . . . . . 0.289 0.3 OUTLIER -75.18 -66.17 0.79 Allowed 'General case' 0 N--CA 1.492 1.647 0 CA-C-N 122.316 2.325 . . . . 0.0 111.953 170.904 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 63' ' ' SER . . . . . . . . . . . . 0.374 46.7 p -54.17 -5.02 0.06 Allowed 'General case' 0 CA--C 1.578 2.056 1 N-CA-C 122.081 4.104 . . . . 0.0 122.081 168.944 . . . . . . . . 3 2 . 1 . 006 nuclear orig full ' B' B ' 64' ' ' GLU . . . . . . . . . . . . . 21.7 tt0 -95.16 -40.4 9.62 Favored 'General case' 0 N--CA 1.496 1.855 0 CA-C-N 124.409 3.277 . . . . 0.0 113.831 144.269 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 3.0 mp -105.88 46.22 0.93 Allowed 'General case' 0 N--CA 1.502 2.135 0 CA-C-N 122.14 2.246 . . . . 0.0 113.575 -173.655 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 66' ' ' VAL . . . . . . . . . . . . . 2.6 m . . . . . 0 N--CA 1.505 2.318 0 C-N-CA 125.636 1.574 . . . . 0.0 111.795 173.916 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.562 1.421 0 N-CA-C 113.497 0.925 . . . . 0.0 113.497 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 89.5 mtm180 -80.3 74.48 7.13 Favored 'General case' 0 N--CA 1.496 1.87 0 CA-C-O 122.546 1.165 . . . . 0.0 113.49 -177.896 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 13.8 t70 -159.15 -41.56 0.06 Allowed 'General case' 0 N--CA 1.489 1.492 0 O-C-N 120.901 -1.124 . . . . 0.0 112.976 174.671 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -145.15 82.74 9.66 Favored Pre-proline 0 CA--C 1.57 1.717 0 O-C-N 120.531 -1.355 . . . . 0.0 108.12 162.594 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 5.7 Cg_exo -99.74 146.61 0.45 Allowed 'Trans proline' 0 C--N 1.366 1.473 0 CA-C-N 122.688 1.996 . . . . 0.0 113.782 -154.049 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 73.5 m80 -67.56 137.35 55.64 Favored 'General case' 0 CA--C 1.564 1.508 0 CA-C-N 114.377 -1.283 . . . . 0.0 113.383 173.031 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . 0.267 27.5 p90 -120.52 167.74 12.08 Favored 'General case' 0 CA--C 1.562 1.415 0 O-C-N 119.557 -1.965 . . . . 0.0 110.576 115.314 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 98.5 m-20 -89.99 90.87 8.34 Favored 'General case' 0 N--CA 1.487 1.411 0 O-C-N 119.695 -1.878 . . . . 0.0 108.059 166.365 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . 0.504 ' CD2' ' SD ' ' A' ' 11' ' ' MET . 8.5 t80 -63.67 150.77 43.57 Favored 'General case' 0 CA--C 1.557 1.217 0 CA-C-O 125.457 2.551 . . . . 0.0 112.344 168.749 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -154.32 94.55 1.73 Allowed 'General case' 0 C--N 1.307 -1.28 0 CA-C-N 111.616 -2.538 . . . . 0.0 107.825 -139.539 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' MET . . . . . 0.504 ' SD ' ' CD2' ' A' ' 9' ' ' PHE . 0.8 OUTLIER -114.77 115.59 43.71 Favored Pre-proline 0 CA--C 1.56 1.352 0 CA-C-O 117.219 -1.372 . . . . 0.0 111.785 -158.796 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 80.8 Cg_exo -42.47 140.61 2.55 Favored 'Trans proline' 0 CA--C 1.56 1.81 0 C-N-CA 122.79 2.327 . . . . 0.0 115.772 161.233 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 22.9 tpp -55.68 -32.36 63.19 Favored 'General case' 0 N--CA 1.492 1.668 0 N-CA-C 118.376 2.732 . . . . 0.0 118.376 -157.671 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . 0.256 9.4 pt-20 -60.9 -46.49 90.45 Favored 'General case' 0 CA--C 1.568 1.66 0 N-CA-C 116.568 2.062 . . . . 0.0 116.568 162.186 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -57.24 -49.6 79.35 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.234 0 CA-C-N 122.925 2.602 . . . . 0.0 112.82 172.7 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 1.4 ttt180 -72.39 -33.95 67.56 Favored 'General case' 0 C--O 1.216 -0.703 0 CA-C-O 116.086 -1.911 . . . . 0.0 115.433 175.39 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -61.89 -40.32 95.01 Favored 'General case' 0 CA--C 1.566 1.563 0 CA-C-N 124.062 3.119 . . . . 0.0 114.53 161.093 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . 0.255 46.3 mtmt -67.92 -48.5 65.79 Favored 'General case' 0 CA--C 1.564 1.484 0 CA-C-N 121.577 1.989 . . . . 0.0 115.366 173.024 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . 0.365 0.2 OUTLIER -68.16 -37.3 80.86 Favored 'General case' 0 CA--C 1.574 1.876 0 C-N-CA 124.791 1.236 . . . . 0.0 112.461 172.362 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 27.8 ttpt -90.17 -22.83 21.52 Favored 'General case' 0 CA--C 1.567 1.612 0 O-C-N 119.155 -2.216 . . . . 0.0 115.382 179.534 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 14.8 m-85 -62.8 -68.02 0.37 Allowed 'General case' 0 N--CA 1.492 1.657 0 CA-C-O 114.009 -2.901 . . . . 0.0 110.511 151.88 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . 0.349 32.2 ttt85 -28.45 -45.19 0.03 OUTLIER 'General case' 0 CA--C 1.601 2.933 0 CA-C-N 125.682 3.856 . . . . 0.0 116.917 166.635 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . 0.288 . . -54.2 -80.29 0.02 OUTLIER 'General case' 0 CA--C 1.58 2.103 0 N-CA-C 118.111 2.634 . . . . 0.0 118.111 153.796 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 51.8 mm-40 -66.6 -36.93 83.79 Favored 'General case' 0 CA--C 1.578 2.049 0 N-CA-C 118.742 2.867 . . . . 0.0 118.742 -178.3 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -42.6 -51.55 5.13 Favored 'General case' 0 CA--C 1.59 2.483 0 N-CA-C 116.399 2.0 . . . . 0.0 116.399 156.308 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 91.8 m-20 -79.04 -47.12 16.78 Favored 'General case' 0 N--CA 1.501 2.104 0 N-CA-C 116.15 1.907 . . . . 0.0 116.15 173.749 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 113.52 35.61 1.56 Allowed Glycine 0 N--CA 1.499 2.884 0 N-CA-C 117.132 1.613 . . . . 0.0 117.132 -154.476 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 75.7 mtm180 -131.27 155.44 47.14 Favored 'General case' 0 CA--C 1.576 1.975 0 N-CA-C 104.308 -2.479 . . . . 0.0 104.308 177.721 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 77.3 p -126.03 109.85 12.88 Favored 'General case' 0 N--CA 1.509 2.508 0 O-C-N 117.47 -3.269 . . . . 0.0 107.654 -171.822 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -45.56 -38.52 6.53 Favored 'General case' 0 N--CA 1.496 1.863 0 N-CA-C 120.265 3.432 . . . . 0.0 120.265 -137.739 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 11.0 t-20 -47.3 -46.51 25.14 Favored 'General case' 0 CA--C 1.597 2.771 0 CA-C-N 124.931 3.514 . . . . 0.0 114.411 163.808 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . 0.314 17.5 t -48.77 -76.22 0.02 OUTLIER 'General case' 0 N--CA 1.5 2.05 0 N-CA-C 117.582 2.438 . . . . 0.0 117.582 143.923 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 10.6 tm-20 -60.74 -53.58 55.66 Favored 'General case' 0 N--CA 1.506 2.351 0 CA-C-N 123.559 2.89 . . . . 0.0 118.745 -172.104 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -42.99 -53.98 4.49 Favored 'General case' 0 CA--C 1.567 1.618 0 CA-C-O 115.699 -2.096 . . . . 0.0 106.244 167.52 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 19.7 mt -62.93 -44.56 95.75 Favored 'General case' 0 C--N 1.375 1.701 0 CA-C-N 124.093 3.133 . . . . 0.0 115.759 177.545 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.47 -44.46 97.06 Favored 'General case' 0 N--CA 1.48 1.046 0 CA-C-O 115.632 -2.128 . . . . 0.0 113.8 177.892 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -69.79 -35.12 63.74 Favored 'Isoleucine or valine' 0 CA--C 1.564 1.504 0 CA-C-N 121.278 1.853 . . . . 0.0 115.027 165.95 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 6.6 t -76.51 -46.56 31.55 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.839 0 CA-C-N 121.93 2.15 . . . . 0.0 111.641 -173.147 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 14.0 tp60 -62.61 -36.77 83.82 Favored 'General case' 0 CA--C 1.567 1.613 0 O-C-N 121.142 -0.974 . . . . 0.0 112.957 160.58 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . 0.446 0.3 OUTLIER -41.35 -53.4 3.3 Favored 'General case' 0 N--CA 1.502 2.164 0 N-CA-C 116.467 2.025 . . . . 0.0 116.467 149.101 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -77.85 -33.73 52.08 Favored 'General case' 0 CA--C 1.553 1.092 0 N-CA-C 118.031 2.604 . . . . 0.0 118.031 -164.722 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . 0.304 0.5 OUTLIER -125.81 22.61 7.43 Favored 'General case' 0 N--CA 1.488 1.466 0 N-CA-C 115.45 1.648 . . . . 0.0 115.45 172.452 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 57.9 p -126.99 -50.58 1.45 Allowed 'General case' 0 N--CA 1.495 1.817 0 N-CA-C 117.098 2.258 . . . . 0.0 117.098 148.198 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . 0.296 80.3 tttt -69.55 -51.25 16.72 Favored Pre-proline 0 N--CA 1.505 2.303 0 N-CA-C 120.312 3.449 . . . . 0.0 120.312 -117.979 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -81.69 108.82 1.94 Allowed 'Trans proline' 0 CA--C 1.563 1.966 0 N-CA-C 119.186 2.725 . . . . 0.0 119.186 -155.728 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . 0.256 50.7 m -124.15 -80.75 0.0 OUTLIER Pre-proline 0 CA--C 1.571 1.76 0 CA-C-O 114.964 -2.446 . . . . 0.0 109.997 153.982 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 43.9 Cg_endo -79.55 63.47 8.73 Favored 'Trans proline' 0 CA--C 1.573 2.459 0 CA-C-N 126.788 3.46 . . . . 0.0 114.511 169.235 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 75.2 t -142.01 -52.15 0.22 Allowed 'Isoleucine or valine' 0 N--CA 1.499 1.982 0 CA-C-N 114.841 -1.072 . . . . 0.0 113.342 -157.78 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 12.2 t -150.13 149.13 29.82 Favored 'General case' 0 N--CA 1.497 1.875 2 O-C-N 112.751 -6.218 . . . . 0.0 114.264 18.54 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 96.39 -50.38 1.64 Allowed Glycine 0 N--CA 1.495 2.601 0 N-CA-C 119.261 2.465 . . . . 0.0 119.261 154.21 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -70.63 72.06 0.5 Allowed 'General case' 0 CA--C 1.576 1.945 0 N-CA-C 115.984 1.846 . . . . 0.0 115.984 -177.091 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -114.54 76.01 0.96 Allowed 'General case' 0 CA--C 1.587 2.375 0 N-CA-C 114.253 1.205 . . . . 0.0 114.253 -170.766 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -147.8 155.45 41.68 Favored 'General case' 0 N--CA 1.487 1.378 1 O-C-N 112.579 -6.326 . . . . 0.0 117.967 -18.678 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . 2.253 1.1 p30 -73.0 27.77 0.06 Allowed 'General case' 0 N--CA 1.504 2.264 0 CA-C-N 121.7 2.046 . . . . 0.0 111.593 169.795 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . 0.307 . . -104.45 9.46 35.61 Favored 'General case' 0 CA--C 1.553 1.071 0 O-C-N 117.58 -3.2 . . . . 0.0 118.496 144.779 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -48.92 -26.68 2.61 Favored 'General case' 0 CA--C 1.595 2.684 0 N-CA-C 118.986 2.958 . . . . 0.0 118.986 113.191 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . 0.316 2.5 tmt_? -83.16 -60.8 2.04 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 118.741 -2.474 . . . . 0.0 114.395 170.473 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . 0.35 4.2 pp -56.24 -27.54 55.35 Favored 'General case' 0 CA--C 1.577 1.994 0 N-CA-C 115.784 1.772 . . . . 0.0 115.784 169.751 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -43.6 -64.12 0.71 Allowed 'General case' 0 N--CA 1.484 1.252 0 N-CA-C 117.641 2.46 . . . . 0.0 117.641 145.354 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -68.27 -11.26 59.1 Favored 'General case' 0 N--CA 1.493 1.724 0 CA-C-N 122.733 2.515 . . . . 0.0 117.465 178.091 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 9.3 mm-40 -74.68 -56.72 4.5 Favored 'General case' 0 N--CA 1.483 1.196 0 O-C-N 120.876 -1.14 . . . . 0.0 111.201 170.623 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . 0.273 0.0 OUTLIER -73.1 -62.16 1.56 Allowed 'General case' 0 C--N 1.355 0.828 0 CA-C-N 120.845 1.657 . . . . 0.0 112.972 169.427 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . 0.375 41.7 t -79.68 39.16 0.4 Allowed 'General case' 0 CA--C 1.581 2.163 0 N-CA-C 118.739 2.866 . . . . 0.0 118.739 172.341 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 8.0 mt-10 -98.37 -57.43 2.2 Favored 'General case' 0 N--CA 1.5 2.056 0 O-C-N 118.316 -2.74 . . . . 0.0 113.273 111.391 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.92 -39.21 93.65 Favored 'General case' 0 CA--C 1.568 1.664 0 N-CA-C 117.801 2.519 . . . . 0.0 117.801 -160.227 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . 0.396 12.0 m . . . . . 0 N--CA 1.511 2.609 0 N-CA-C 120.073 3.361 . . . . 0.0 120.073 164.613 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.566 1.582 0 N-CA-C 116.263 1.949 . . . . 0.0 116.263 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 2' ' ' ARG . . . . . . . . . . . . 0.378 39.9 ptt180 44.7 46.98 8.75 Favored 'General case' 0 N--CA 1.502 2.14 0 N-CA-C 120.488 3.514 . . . . 0.0 120.488 -179.076 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -155.18 -51.39 0.09 Allowed 'General case' 0 N--CA 1.488 1.446 0 O-C-N 120.982 -1.074 . . . . 0.0 111.764 171.913 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 4' ' ' ASP . . . . . . . . . . . . 0.272 4.7 p-10 -137.66 87.33 17.46 Favored Pre-proline 0 CA--C 1.573 1.853 0 O-C-N 121.44 -0.788 . . . . 0.0 111.904 157.21 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 7.3 Cg_exo -95.41 145.9 1.38 Allowed 'Trans proline' 0 C--N 1.37 1.709 0 CA-C-N 122.636 1.977 . . . . 0.0 115.514 -161.254 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 6' ' ' HIS . . . . . . . . . . . . . 80.3 m80 -79.51 126.19 30.55 Favored 'General case' 0 CA--C 1.566 1.575 0 CA-C-N 113.99 -1.459 . . . . 0.0 112.277 175.278 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 7' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -128.93 155.61 45.04 Favored 'General case' 0 CA--C 1.567 1.609 0 O-C-N 120.655 -1.278 . . . . 0.0 111.067 154.322 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 8' ' ' ASN . . . . . . . . . . . . . 6.7 p-10 -59.18 103.27 0.17 Allowed 'General case' 0 CA--C 1.575 1.904 0 N-CA-C 115.709 1.744 . . . . 0.0 115.709 171.15 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 9' ' ' PHE . . . . . . . . . . . . . 2.6 t80 -126.49 104.95 8.42 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 124.515 1.126 . . . . 0.0 108.557 158.365 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 10' ' ' ARG . . . . . . . . . . . . 0.472 34.8 tpt85 97.66 83.55 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.784 1 O-C-N 113.746 -5.596 . . . . 0.0 111.297 -19.161 . . . . . . . . 3 2 . 1 . 007 nuclear orig full ' B' B ' 11' ' ' MET . . . . . . . . . . . . . 16.1 mtt -151.5 130.13 6.25 Favored Pre-proline 0 CA--C 1.567 1.621 0 CA-C-O 117.26 -1.352 . . . . 0.0 110.46 -155.842 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 12' ' ' PRO . . . . . . . . . . . . . 83.8 Cg_exo -43.92 147.87 1.16 Allowed 'Trans proline' 0 CA--C 1.559 1.734 0 C-N-CA 123.172 2.582 . . . . 0.0 117.971 168.101 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 13' ' ' MET . . . . . . . . . . . . . 2.0 tpt -47.27 -39.84 15.4 Favored 'General case' 0 CA--C 1.575 1.917 0 N-CA-C 117.867 2.543 . . . . 0.0 117.867 -166.393 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -63.85 -50.92 66.97 Favored 'General case' 0 N--CA 1.487 1.421 0 N-CA-C 116.722 2.119 . . . . 0.0 116.722 171.15 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -59.35 -51.15 76.04 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.612 0 CA-C-N 121.145 1.793 . . . . 0.0 113.65 176.522 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -67.0 -31.63 72.32 Favored 'General case' 0 CA--C 1.547 0.847 0 CA-C-O 115.987 -1.959 . . . . 0.0 116.266 170.811 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 17' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -60.23 -47.47 85.82 Favored 'General case' 0 N--CA 1.492 1.629 0 CA-C-N 123.775 2.989 . . . . 0.0 113.822 160.691 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . 0.671 3.9 pttt -72.13 -35.43 69.1 Favored 'General case' 0 CA--C 1.568 1.641 0 N-CA-C 118.359 2.726 . . . . 0.0 118.359 177.459 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 19' ' ' LEU . . . . . . . . . . . . 0.361 0.4 OUTLIER -68.81 -40.13 79.7 Favored 'General case' 0 CA--C 1.587 2.37 0 O-C-N 120.753 -1.217 . . . . 0.0 113.637 164.568 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 20' ' ' LYS . . . . . . . . . . . . . 28.8 ttpt -88.75 -30.39 19.09 Favored 'General case' 0 CA--C 1.56 1.358 0 O-C-N 120.135 -1.603 . . . . 0.0 115.09 -177.368 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 35.5 m-85 -58.52 -69.61 0.18 Allowed 'General case' 0 N--CA 1.49 1.526 0 CA-C-O 112.211 -3.757 . . . . 0.0 110.387 153.708 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . 0.295 23.5 ttt180 -21.99 -56.76 0.03 OUTLIER 'General case' 0 CA--C 1.589 2.46 1 CA-C-N 126.717 4.326 . . . . 0.0 116.579 168.219 . . . . . . . . 3 2 . 1 . 007 nuclear orig full ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -51.99 -71.94 0.06 Allowed 'General case' 0 CA--C 1.575 1.927 0 N-CA-C 121.199 3.778 . . . . 0.0 121.199 157.544 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 66.7 mm-40 -73.25 -32.11 64.52 Favored 'General case' 0 N--CA 1.497 1.917 0 N-CA-C 118.019 2.6 . . . . 0.0 118.019 -177.996 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 25' ' ' ALA . . . . . . . . . . . . . . . -41.71 -48.36 4.17 Favored 'General case' 0 CA--C 1.578 2.023 0 N-CA-C 116.775 2.139 . . . . 0.0 116.775 151.462 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 26' ' ' ASN . . . . . . . . . . . . 0.253 0.1 OUTLIER -93.82 -41.2 9.77 Favored 'General case' 0 CA--C 1.581 2.169 0 N-CA-C 116.862 2.171 . . . . 0.0 116.862 -179.349 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 27' ' ' GLY . . . . . . . . . . . . . . . 113.94 49.98 0.52 Allowed Glycine 0 N--CA 1.497 2.72 0 N-CA-C 116.152 1.221 . . . . 0.0 116.152 -167.218 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 28' ' ' ARG . . . . . . . . . . . . . 5.2 ttt85 -156.24 86.95 1.03 Allowed 'General case' 0 N--CA 1.496 1.837 0 N-CA-C 106.817 -1.549 . . . . 0.0 106.817 -164.826 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 29' ' ' SER . . . . . . . . . . . . . 12.3 t -81.9 129.57 34.8 Favored 'General case' 0 N--CA 1.5 2.027 0 O-C-N 118.58 -2.575 . . . . 0.0 107.747 -150.95 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 30' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -46.62 -39.79 11.84 Favored 'General case' 0 N--CA 1.496 1.871 0 N-CA-C 119.546 3.165 . . . . 0.0 119.546 -143.349 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 31' ' ' ASN . . . . . . . . . . . . 0.261 0.1 OUTLIER -48.55 -39.38 23.37 Favored 'General case' 0 CA--C 1.589 2.456 0 CA-C-N 125.781 3.9 . . . . 0.0 114.997 166.332 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 32' ' ' SER . . . . . . . . . . . . 0.319 33.5 t -56.77 -67.19 0.33 Allowed 'General case' 0 CA--C 1.576 1.952 0 N-CA-C 119.39 3.108 . . . . 0.0 119.39 147.385 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . 0.25 6.2 tp10 -66.23 -55.1 17.83 Favored 'General case' 0 N--CA 1.52 3.068 0 CA-C-N 124.963 3.529 . . . . 0.0 115.809 -178.298 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -39.71 -54.91 2.0 Favored 'General case' 0 CA--C 1.553 1.086 0 CA-C-O 115.057 -2.401 . . . . 0.0 108.086 167.239 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 35' ' ' LEU . . . . . . . . . . . . . 11.6 mt -63.08 -54.66 34.5 Favored 'General case' 0 C--N 1.373 1.622 0 CA-C-N 124.485 3.312 . . . . 0.0 115.124 177.533 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 36' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -56.59 -38.13 71.59 Favored 'General case' 0 CA--C 1.566 1.592 0 N-CA-C 115.484 1.661 . . . . 0.0 115.484 177.858 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 37' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -69.66 -38.05 75.48 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.474 0 N-CA-C 115.658 1.725 . . . . 0.0 115.658 164.885 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 38' ' ' VAL . . . . . . . . . . . . . 3.1 t -73.83 -48.07 40.87 Favored 'Isoleucine or valine' 0 CA--C 1.577 1.989 0 C-N-CA 127.14 2.176 . . . . 0.0 111.732 -178.849 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -47.17 -51.44 18.28 Favored 'General case' 0 CA--C 1.556 1.208 0 CA-C-O 117.508 -1.234 . . . . 0.0 113.427 153.416 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 40' ' ' ASP . . . . . . . . . . . . 0.936 0.5 OUTLIER -52.14 -37.41 54.32 Favored 'General case' 0 CA--C 1.573 1.833 0 N-CA-C 118.879 2.918 . . . . 0.0 118.879 160.706 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -68.86 -49.01 61.94 Favored 'General case' 0 CA--C 1.554 1.126 0 N-CA-C 115.892 1.812 . . . . 0.0 115.892 -170.263 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 1.4 pp -117.74 -0.8 11.71 Favored 'General case' 0 CA--C 1.566 1.585 0 N-CA-C 117.534 2.42 . . . . 0.0 117.534 178.364 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 43' ' ' SER . . . . . . . . . . . . . 6.8 m -75.34 -26.82 58.91 Favored 'General case' 0 N--CA 1.497 1.913 0 CA-C-N 120.945 1.702 . . . . 0.0 115.028 148.298 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 44' ' ' LYS . . . . . . . . . . . . 0.677 45.0 pttt 67.48 -110.55 0.0 OUTLIER Pre-proline 0 CA--C 1.588 2.44 0 CA-C-O 114.582 -2.628 . . . . 0.0 116.056 173.064 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -74.55 148.87 38.11 Favored 'Trans proline' 0 CA--C 1.562 1.877 0 CA-C-N 127.423 3.687 . . . . 0.0 117.508 -171.813 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 46' ' ' SER . . . . . . . . . . . . . 73.0 m -115.71 177.8 1.12 Allowed Pre-proline 0 CA--C 1.584 2.265 0 CA-C-N 113.853 -1.522 . . . . 0.0 110.259 138.623 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_exo -67.31 85.92 0.34 Allowed 'Trans proline' 0 CA--C 1.571 2.356 0 CA-C-N 123.866 2.416 . . . . 0.0 116.658 179.253 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 48' ' ' VAL . . . . . . . . . . . . 0.375 48.7 t -106.38 -88.08 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.507 2.415 0 CA-C-O 118.292 -0.861 . . . . 0.0 110.907 -179.241 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 49' ' ' THR . . . . . . . . . . . . . 2.6 m -149.42 140.1 22.63 Favored 'General case' 0 CA--C 1.575 1.923 2 O-C-N 110.979 -7.326 . . . . 0.0 110.354 -12.251 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 50' ' ' GLY . . . . . . . . . . . . . . . 143.34 93.14 0.17 Allowed Glycine 0 N--CA 1.493 2.447 0 CA-C-O 118.396 -1.224 . . . . 0.0 112.71 173.144 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 51' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -29.77 149.86 0.0 OUTLIER 'General case' 0 N--CA 1.501 2.097 3 CA-C-N 128.263 6.032 . . . . 0.0 124.554 4.62 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 52' ' ' ARG . . . . . . . . . . . . . 1.2 tpt180 -95.04 167.35 11.44 Favored 'General case' 0 CA--C 1.586 2.34 0 C-N-CA 124.831 1.253 . . . . 0.0 111.69 156.52 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . 0.763 52.2 p30 -71.86 85.19 0.95 Allowed 'General case' 0 N--CA 1.501 2.111 0 O-C-N 118.791 -2.443 . . . . 0.0 111.372 169.411 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . 0.538 4.2 p30 -76.72 31.18 0.13 Allowed 'General case' 0 C--N 1.36 1.024 0 N-CA-C 119.261 3.059 . . . . 0.0 119.261 145.278 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 55' ' ' ALA . . . . . . . . . . . . . . . -112.45 -15.88 13.01 Favored 'General case' 0 CA--C 1.548 0.891 0 N-CA-C 119.388 3.107 . . . . 0.0 119.388 141.664 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 45.5 mm-40 -66.98 -1.49 4.15 Favored 'General case' 0 N--CA 1.498 1.97 0 N-CA-C 118.154 2.65 . . . . 0.0 118.154 137.137 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 57' ' ' ARG . . . . . . . . . . . . 0.375 0.0 OUTLIER -105.13 -24.37 12.77 Favored 'General case' 0 CA--C 1.596 2.737 0 O-C-N 119.944 -1.722 . . . . 0.0 115.418 160.16 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 58' ' ' LEU . . . . . . . . . . . . 0.486 0.0 OUTLIER -65.33 -43.68 90.19 Favored 'General case' 0 N--CA 1.52 3.064 0 O-C-N 117.809 -3.057 . . . . 0.0 118.802 161.396 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 59' ' ' ALA . . . . . . . . . . . . 0.374 . . -8.64 -83.78 0.0 OUTLIER 'General case' 0 N--CA 1.477 0.902 1 N-CA-C 123.265 4.543 . . . . 0.0 123.265 120.617 . . . . . . . . 3 2 . 1 . 007 nuclear orig full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 64.2 m-20 -51.19 -12.83 0.14 Allowed 'General case' 0 CA--C 1.572 1.824 0 CA-C-N 123.979 3.081 . . . . 0.0 119.137 170.233 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 5.9 tm-20 -64.42 -60.2 3.44 Favored 'General case' 0 N--CA 1.496 1.84 0 CA-C-N 122.546 2.43 . . . . 0.0 114.545 152.435 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -70.83 -63.51 1.08 Allowed 'General case' 0 CA--C 1.558 1.271 0 CA-C-N 121.058 1.754 . . . . 0.0 114.179 173.529 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 63' ' ' SER . . . . . . . . . . . . 0.287 5.3 p -70.51 31.18 0.04 OUTLIER 'General case' 0 CA--C 1.571 1.751 0 N-CA-C 120.225 3.417 . . . . 0.0 120.225 165.487 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 64' ' ' GLU . . . . . . . . . . . . . 81.1 mt-10 -104.38 -47.95 3.97 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 119.585 -1.947 . . . . 0.0 111.627 123.171 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 3.6 mp -85.41 42.52 0.96 Allowed 'General case' 0 N--CA 1.502 2.162 0 N-CA-C 116.666 2.099 . . . . 0.0 116.666 -174.884 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 66' ' ' VAL . . . . . . . . . . . . . 8.4 m . . . . . 0 N--CA 1.496 1.837 0 C-N-CA 126.657 1.983 . . . . 0.0 109.362 172.549 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 1.437 0 N-CA-C 116.032 1.864 . . . . 0.0 116.032 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 70.2 mtm-85 59.15 42.21 19.16 Favored 'General case' 0 N--CA 1.5 2.044 0 N-CA-C 116.634 2.087 . . . . 0.0 116.634 173.719 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 5.8 p-10 -120.62 115.42 23.34 Favored 'General case' 0 CA--C 1.553 1.088 0 N-CA-C 106.0 -1.852 . . . . 0.0 106.0 -177.858 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 23.8 p-10 -145.02 86.87 7.47 Favored Pre-proline 0 CA--C 1.57 1.745 1 O-C-N 113.557 -5.714 . . . . 0.0 113.18 27.768 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 65.2 Cg_endo -67.5 157.7 60.54 Favored 'Trans proline' 0 CA--C 1.564 2.024 0 C-N-CA 123.044 2.496 . . . . 0.0 117.566 175.949 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 76.0 m80 -85.1 145.13 27.81 Favored 'General case' 0 CA--C 1.565 1.538 0 N-CA-C 115.296 1.591 . . . . 0.0 115.296 -171.28 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 1.3 p90 -128.31 136.78 51.46 Favored 'General case' 0 N--CA 1.487 1.407 0 O-C-N 120.094 -1.629 . . . . 0.0 109.351 135.987 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 58.5 m-20 -73.53 92.47 1.91 Allowed 'General case' 0 CA--C 1.558 1.257 0 O-C-N 120.953 -1.092 . . . . 0.0 110.748 175.75 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 3.9 t80 -68.87 163.35 24.51 Favored 'General case' 0 CA--C 1.562 1.423 0 CA-C-O 124.69 2.186 . . . . 0.0 110.466 164.347 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 173.18 98.74 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.783 0 CA-C-N 113.114 -1.857 . . . . 0.0 107.135 -124.304 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 7.3 mtt -145.75 131.74 9.54 Favored Pre-proline 0 N--CA 1.496 1.852 0 CA-C-O 116.751 -1.595 . . . . 0.0 112.275 -153.125 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 79.9 Cg_exo -43.27 150.16 0.43 Allowed 'Trans proline' 0 CA--C 1.561 1.846 0 C-N-CA 123.113 2.542 . . . . 0.0 116.936 170.585 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 21.2 tpp -64.38 -28.72 69.89 Favored 'General case' 0 N--CA 1.491 1.619 0 N-CA-C 116.987 2.217 . . . . 0.0 116.987 -164.192 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 9.1 pm0 -57.54 -48.01 80.46 Favored 'General case' 0 CA--C 1.566 1.571 0 N-CA-C 116.973 2.212 . . . . 0.0 116.973 156.365 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 2.0 t -60.97 -47.28 94.26 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.047 0 CA-C-N 122.019 2.19 . . . . 0.0 115.25 -179.747 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . 0.509 0.1 OUTLIER -114.87 27.43 9.43 Favored 'General case' 0 N--CA 1.485 1.314 0 N-CA-C 118.376 2.732 . . . . 0.0 118.376 170.979 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 5.5 pt-20 -71.61 -45.96 60.62 Favored 'General case' 0 N--CA 1.483 1.222 0 O-C-N 119.141 -2.224 . . . . 0.0 113.517 119.856 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . 0.297 56.0 mtmt -60.98 -52.26 65.77 Favored 'General case' 0 CA--C 1.563 1.469 0 N-CA-C 116.338 1.977 . . . . 0.0 116.338 177.986 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 6.9 mt -65.67 -43.93 87.79 Favored 'General case' 0 CA--C 1.576 1.946 0 CA-C-N 120.291 1.405 . . . . 0.0 114.326 166.898 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 5.7 ttpt -77.7 -29.36 51.33 Favored 'General case' 0 CA--C 1.572 1.806 0 CA-C-N 123.296 2.771 . . . . 0.0 113.69 -178.499 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 17.3 m-30 -63.71 -67.86 0.39 Allowed 'General case' 0 N--CA 1.485 1.317 0 CA-C-O 115.627 -2.13 . . . . 0.0 111.725 159.792 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . 0.307 14.1 ttt180 -26.06 -49.19 0.03 OUTLIER 'General case' 0 CA--C 1.595 2.697 0 CA-C-N 124.626 3.376 . . . . 0.0 115.889 164.782 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . 0.293 . . -55.26 -76.53 0.03 OUTLIER 'General case' 0 CA--C 1.591 2.52 0 O-C-N 117.174 -3.454 . . . . 0.0 118.225 156.278 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 38.8 mt-10 -69.01 -46.87 66.89 Favored 'General case' 0 N--CA 1.504 2.238 0 N-CA-C 119.342 3.09 . . . . 0.0 119.342 -179.182 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -41.08 -47.27 3.12 Favored 'General case' 0 CA--C 1.577 2.003 0 N-CA-C 117.611 2.448 . . . . 0.0 117.611 158.724 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . 0.329 0.0 OUTLIER -124.6 -43.21 2.04 Favored 'General case' 0 CA--C 1.571 1.776 0 CA-C-O 117.884 -1.055 . . . . 0.0 113.439 -146.713 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 173.26 -27.92 0.09 OUTLIER Glycine 0 N--CA 1.498 2.77 0 N-CA-C 120.78 3.072 . . . . 0.0 120.78 173.802 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . 0.396 36.6 mtm105 -110.3 179.96 3.94 Favored 'General case' 0 N--CA 1.498 1.945 0 CA-C-N 119.635 1.717 . . . . 0.0 107.39 -169.816 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 80.2 p -131.4 105.81 7.84 Favored 'General case' 0 N--CA 1.502 2.171 0 O-C-N 117.487 -3.258 . . . . 0.0 105.757 -172.0 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -38.26 -45.65 1.0 Allowed 'General case' 0 N--CA 1.495 1.81 0 N-CA-C 120.336 3.458 . . . . 0.0 120.336 -139.947 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 15.0 t-20 -42.63 -47.59 5.3 Favored 'General case' 0 CA--C 1.597 2.763 0 O-C-N 117.758 -3.089 . . . . 0.0 115.293 162.788 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . 0.277 42.8 t -54.0 -63.94 0.99 Allowed 'General case' 0 N--CA 1.501 2.119 0 N-CA-C 120.073 3.36 . . . . 0.0 120.073 147.052 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 5.9 tm-20 -69.35 -51.77 33.65 Favored 'General case' 0 N--CA 1.515 2.79 0 CA-C-N 123.042 2.655 . . . . 0.0 116.986 -175.598 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -44.08 -54.8 5.21 Favored 'General case' 0 CA--C 1.561 1.387 0 CA-C-O 115.535 -2.174 . . . . 0.0 107.59 162.793 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 10.9 mt -64.3 -56.2 16.1 Favored 'General case' 0 N--CA 1.491 1.622 0 CA-C-N 124.759 3.436 . . . . 0.0 115.099 -176.598 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -57.73 -38.59 75.58 Favored 'General case' 0 CA--C 1.563 1.45 0 CA-C-O 115.928 -1.987 . . . . 0.0 113.366 177.206 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -69.59 -33.3 56.19 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.668 0 CA-C-N 122.485 2.402 . . . . 0.0 115.441 166.972 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 2.3 t -74.98 -49.49 28.35 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.544 0 C-N-CA 128.535 2.734 . . . . 0.0 112.974 178.906 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 34.3 mt-30 -43.34 -55.13 4.25 Favored 'General case' 0 N--CA 1.484 1.254 0 CA-C-O 116.695 -1.622 . . . . 0.0 112.294 151.531 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . 0.429 0.9 OUTLIER -41.6 -49.81 4.1 Favored 'General case' 0 N--CA 1.495 1.812 0 N-CA-C 118.072 2.619 . . . . 0.0 118.072 158.789 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . 0.331 . . -87.75 -17.67 31.15 Favored 'General case' 0 CA--C 1.548 0.875 0 N-CA-C 117.784 2.513 . . . . 0.0 117.784 -159.361 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -108.64 -15.0 14.52 Favored 'General case' 0 N--CA 1.495 1.775 0 N-CA-C 118.625 2.824 . . . . 0.0 118.625 153.079 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 75.7 p -135.85 -32.94 0.87 Allowed 'General case' 0 N--CA 1.496 1.838 0 N-CA-C 116.905 2.187 . . . . 0.0 116.905 -173.138 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . 0.703 6.5 tmtt? 56.34 -87.61 0.0 OUTLIER Pre-proline 0 CA--C 1.596 2.724 1 N-CA-C 123.134 4.494 . . . . 0.0 123.134 -125.999 . . . . . . . . 3 2 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 47.2 Cg_endo -81.53 143.74 13.78 Favored 'Trans proline' 0 CA--C 1.557 1.658 0 CA-C-N 126.282 3.279 . . . . 0.0 119.296 -132.0 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 19.4 m -140.01 -58.17 0.02 OUTLIER Pre-proline 0 CA--C 1.573 1.842 0 CA-C-O 116.06 -1.924 . . . . 0.0 112.408 133.499 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 41.8 Cg_endo -90.11 36.51 0.34 Allowed 'Trans proline' 0 C--N 1.375 1.965 0 N-CA-C 121.125 3.471 . . . . 0.0 121.125 -157.022 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . 0.429 10.2 t -142.23 -87.01 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.515 2.787 0 N-CA-C 108.144 -1.058 . . . . 0.0 108.144 154.65 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 4.4 t -169.84 150.94 4.02 Favored 'General case' 0 CA--C 1.58 2.104 2 O-C-N 111.677 -6.89 . . . . 0.0 113.389 -14.655 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -102.33 41.27 2.17 Favored Glycine 0 N--CA 1.508 3.466 0 N-CA-C 116.998 1.559 . . . . 0.0 116.998 147.995 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 10.1 m-30 -99.7 106.78 18.74 Favored 'General case' 0 CA--C 1.572 1.807 0 C-N-CA 124.28 1.032 . . . . 0.0 109.406 176.704 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 38.9 ttp180 -135.37 136.78 41.75 Favored 'General case' 0 N--CA 1.51 2.571 0 N-CA-C 115.08 1.511 . . . . 0.0 115.08 179.767 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . 0.357 3.3 m120 111.68 176.6 0.0 OUTLIER 'General case' 0 N--CA 1.525 3.322 0 C-N-CA 129.122 2.969 . . . . 0.0 110.689 -179.048 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 6.7 p30 -86.19 123.93 32.02 Favored 'General case' 0 C--N 1.359 1.02 2 O-C-N 108.316 -8.99 . . . . 0.0 105.934 -14.916 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . 0.458 . . -129.89 -125.98 0.21 Allowed 'General case' 0 C--N 1.292 -1.91 0 CA-C-N 111.796 -2.456 . . . . 0.0 106.981 -108.286 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 20.7 mm-40 -6.17 -17.37 0.0 OUTLIER 'General case' 0 CA--C 1.601 2.932 1 N-CA-C 125.789 5.478 . . . . 0.0 125.789 90.241 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . 0.323 0.0 OUTLIER -120.96 -37.87 2.91 Favored 'General case' 0 CA--C 1.564 1.494 0 O-C-N 118.305 -2.747 . . . . 0.0 111.593 -169.286 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 4.2 tp -75.18 -13.03 60.42 Favored 'General case' 0 CA--C 1.58 2.115 0 N-CA-C 115.627 1.714 . . . . 0.0 115.627 144.056 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -54.55 -51.31 65.63 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 119.451 -2.031 . . . . 0.0 114.734 148.652 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 2.6 t70 -71.36 -14.52 62.21 Favored 'General case' 0 N--CA 1.482 1.143 0 N-CA-C 116.868 2.173 . . . . 0.0 116.868 171.186 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . 0.278 13.4 tp10 -73.15 -59.72 2.58 Favored 'General case' 0 N--CA 1.484 1.273 0 CA-C-N 119.602 1.092 . . . . 0.0 112.642 167.946 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 8.0 tp60 -67.62 -59.61 3.21 Favored 'General case' 0 CA--C 1.555 1.144 0 CA-C-N 121.75 2.068 . . . . 0.0 110.703 172.734 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . 0.297 46.0 t -92.72 52.07 1.81 Allowed 'General case' 0 CA--C 1.562 1.42 0 N-CA-C 118.497 2.777 . . . . 0.0 118.497 172.928 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -110.25 -21.07 12.41 Favored 'General case' 0 CA--C 1.577 1.995 0 O-C-N 119.81 -1.806 . . . . 0.0 115.643 109.197 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 20.8 mt -91.37 -7.31 51.2 Favored 'General case' 0 N--CA 1.509 2.476 0 CA-C-N 122.84 2.564 . . . . 0.0 116.452 -174.161 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 13.8 m . . . . . 0 N--CA 1.503 2.218 0 N-CA-C 118.28 2.696 . . . . 0.0 118.28 164.497 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.565 1.544 0 N-CA-C 113.837 1.051 . . . . 0.0 113.837 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 2' ' ' ARG . . . . . . . . . . . . . 36.4 ptt180 -62.15 -41.97 98.8 Favored 'General case' 0 N--CA 1.506 2.346 1 N-CA-C 121.854 4.02 . . . . 0.0 121.854 -177.429 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . 0.389 15.7 t70 69.54 106.23 0.06 Allowed 'General case' 0 CA--C 1.568 1.649 0 CA-C-N 111.902 -2.408 . . . . 0.0 116.156 -171.886 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 4' ' ' ASP . . . . . . . . . . . . 0.519 2.7 p30 66.19 67.27 0.71 Allowed Pre-proline 0 CA--C 1.569 1.694 0 N-CA-C 120.419 3.488 . . . . 0.0 120.419 166.893 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -62.3 165.07 15.83 Favored 'Trans proline' 0 CA--C 1.568 2.196 0 C-N-CA 122.276 1.984 . . . . 0.0 116.991 150.205 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 6' ' ' HIS . . . . . . . . . . . . . 76.6 m80 -88.27 153.46 21.2 Favored 'General case' 0 CA--C 1.569 1.711 0 CA-C-N 111.723 -2.49 . . . . 0.0 112.429 169.544 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 7' ' ' PHE . . . . . . . . . . . . . 10.0 p90 -130.43 159.69 36.29 Favored 'General case' 0 CA--C 1.568 1.647 0 O-C-N 119.491 -2.006 . . . . 0.0 112.047 129.782 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 8' ' ' ASN . . . . . . . . . . . . . 14.6 p-10 -65.74 87.69 0.09 Allowed 'General case' 0 CA--C 1.567 1.626 0 N-CA-C 114.279 1.214 . . . . 0.0 114.279 168.937 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 9' ' ' PHE . . . . . 0.523 ' CD2' ' SD ' ' B' ' 11' ' ' MET 0.254 1.9 t80 -79.76 179.44 7.53 Favored 'General case' 0 CA--C 1.556 1.177 0 CA-C-O 123.724 1.726 . . . . 0.0 110.361 158.932 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 10' ' ' ARG . . . . . . . . . . . . 0.425 67.4 mtt180 -127.16 -136.94 0.25 Allowed 'General case' 0 N--CA 1.477 0.886 0 CA-C-N 114.246 -1.343 . . . . 0.0 110.832 -164.418 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 11' ' ' MET . . . . . 0.523 ' SD ' ' CD2' ' B' ' 9' ' ' PHE . 5.1 mmt -146.12 171.14 6.8 Favored Pre-proline 0 CA--C 1.579 2.071 0 O-C-N 117.301 -3.375 . . . . 0.0 110.683 63.331 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 12' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -45.76 131.92 13.31 Favored 'Trans proline' 0 C--N 1.371 1.721 0 O-C-N 117.103 -2.104 . . . . 0.0 113.328 147.882 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 13' ' ' MET . . . . . . . . . . . . . 22.5 tpp -60.17 -27.12 66.86 Favored 'General case' 0 CA--C 1.568 1.637 0 N-CA-C 118.14 2.644 . . . . 0.0 118.14 -154.335 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 14' ' ' GLU . . . . . . . . . . . . 0.271 11.1 pt-20 -57.14 -50.07 73.96 Favored 'General case' 0 CA--C 1.565 1.546 0 N-CA-C 117.001 2.223 . . . . 0.0 117.001 162.309 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -63.52 -43.06 98.17 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.884 0 CA-C-N 121.037 1.744 . . . . 0.0 114.375 173.756 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 16' ' ' ARG . . . . . . . . . . . . 0.261 4.8 ttt180 -78.97 -32.22 45.26 Favored 'General case' 0 N--CA 1.478 0.943 0 CA-C-O 116.058 -1.925 . . . . 0.0 114.518 175.404 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 17' ' ' GLU . . . . . . . . . . . . . 5.3 pt-20 -64.77 -43.97 91.53 Favored 'General case' 0 N--CA 1.484 1.26 0 CA-C-N 124.0 3.091 . . . . 0.0 113.305 163.209 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . 0.615 16.5 pttt -70.14 -33.25 71.57 Favored 'General case' 0 CA--C 1.565 1.551 0 N-CA-C 117.858 2.54 . . . . 0.0 117.858 173.712 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 19' ' ' LEU . . . . . . . . . . . . 0.367 0.7 OUTLIER -76.59 -40.27 50.01 Favored 'General case' 0 CA--C 1.567 1.617 0 CA-C-N 121.016 1.735 . . . . 0.0 114.021 166.689 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 20' ' ' LYS . . . . . . . . . . . . . 3.0 ttpt -79.71 -32.77 41.32 Favored 'General case' 0 CA--C 1.563 1.458 0 O-C-N 119.861 -1.774 . . . . 0.0 114.556 179.174 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 18.9 m-85 -60.78 -73.86 0.09 Allowed 'General case' 0 N--CA 1.491 1.619 1 CA-C-O 111.613 -4.042 . . . . 0.0 109.951 155.213 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . 0.276 17.9 ttt180 -22.81 -54.82 0.03 OUTLIER 'General case' 0 N--CA 1.506 2.334 1 CA-C-N 127.601 4.728 . . . . 0.0 117.066 170.655 . . . . . . . . 3 2 . 1 . 008 nuclear orig full ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -48.63 -79.8 0.01 OUTLIER 'General case' 0 CA--C 1.58 2.102 0 N-CA-C 118.489 2.774 . . . . 0.0 118.489 156.592 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 46.4 mm-40 -65.82 -34.22 77.65 Favored 'General case' 0 N--CA 1.498 1.93 0 N-CA-C 118.978 2.955 . . . . 0.0 118.978 -178.429 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 25' ' ' ALA . . . . . . . . . . . . . . . -41.96 -48.1 4.47 Favored 'General case' 0 CA--C 1.578 2.052 0 N-CA-C 117.536 2.421 . . . . 0.0 117.536 153.712 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 26' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -97.97 -44.52 6.63 Favored 'General case' 0 CA--C 1.576 1.951 0 N-CA-C 116.64 2.089 . . . . 0.0 116.64 -173.614 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 27' ' ' GLY . . . . . . . . . . . . . . . 122.62 13.7 4.58 Favored Glycine 0 N--CA 1.498 2.798 0 N-CA-C 119.05 2.38 . . . . 0.0 119.05 -159.584 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 28' ' ' ARG . . . . . . . . . . . . . 61.8 mtm-85 -109.54 154.72 22.31 Favored 'General case' 0 CA--C 1.575 1.924 0 N-CA-C 103.981 -2.6 . . . . 0.0 103.981 167.302 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 29' ' ' SER . . . . . . . . . . . . . 79.1 p -129.35 112.35 13.76 Favored 'General case' 0 N--CA 1.505 2.311 0 O-C-N 117.049 -3.532 . . . . 0.0 106.001 -169.737 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 30' ' ' MET . . . . . . . . . . . . . 24.1 mtp -47.15 -38.58 11.95 Favored 'General case' 0 N--CA 1.497 1.915 0 N-CA-C 118.772 2.878 . . . . 0.0 118.772 -135.198 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 31' ' ' ASN . . . . . . . . . . . . 0.26 0.1 OUTLIER -48.21 -43.27 31.85 Favored 'General case' 0 CA--C 1.598 2.816 0 O-C-N 116.906 -3.622 . . . . 0.0 115.315 164.425 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 32' ' ' SER . . . . . . . . . . . . 0.461 75.4 p -54.84 -63.5 1.13 Allowed 'General case' 0 N--CA 1.505 2.319 0 N-CA-C 118.755 2.872 . . . . 0.0 118.755 145.262 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 3.0 tm-20 -67.18 -50.15 62.11 Favored 'General case' 0 N--CA 1.511 2.624 0 N-CA-C 120.35 3.463 . . . . 0.0 120.35 -177.052 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -42.07 -54.69 3.48 Favored 'General case' 0 CA--C 1.554 1.126 0 CA-C-O 114.881 -2.485 . . . . 0.0 107.756 159.807 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 35' ' ' LEU . . . . . . . . . . . . . 12.2 mt -60.38 -40.11 89.71 Favored 'General case' 0 N--CA 1.492 1.633 0 CA-C-N 124.75 3.432 . . . . 0.0 116.766 176.028 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 36' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.22 -46.07 74.94 Favored 'General case' 0 N--CA 1.488 1.438 0 N-CA-C 115.017 1.488 . . . . 0.0 115.017 176.145 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 37' ' ' ILE . . . . . . . . . . . . . 5.3 tt -63.12 -30.2 49.11 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.408 0 CA-C-O 114.858 -2.496 . . . . 0.0 116.101 161.89 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 38' ' ' VAL . . . . . . . . . . . . . 2.2 t -83.63 -46.21 18.4 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.923 0 CA-C-N 121.893 2.133 . . . . 0.0 112.704 -172.301 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 33.5 mt-30 -57.28 -38.89 74.63 Favored 'General case' 0 CA--C 1.572 1.82 0 O-C-N 121.148 -0.97 . . . . 0.0 112.497 157.291 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 40' ' ' ASP . . . . . . . . . . . . 0.528 5.2 m-20 -52.93 -41.45 64.46 Favored 'General case' 0 CA--C 1.58 2.103 0 N-CA-C 119.264 3.061 . . . . 0.0 119.264 151.168 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -75.68 -20.62 58.3 Favored 'General case' 0 N--CA 1.493 1.715 0 N-CA-C 116.695 2.109 . . . . 0.0 116.695 -175.663 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 22.4 mt -96.14 -36.35 11.0 Favored 'General case' 0 N--CA 1.488 1.464 0 C-N-CA 125.057 1.343 . . . . 0.0 113.673 170.743 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 43' ' ' SER . . . . . . . . . . . . . 22.8 t -64.0 -41.64 97.42 Favored 'General case' 0 N--CA 1.497 1.891 0 N-CA-C 117.334 2.346 . . . . 0.0 117.334 169.898 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 44' ' ' LYS . . . . . . . . . . . . 0.32 7.4 mmpt? 70.41 150.47 0.13 Allowed Pre-proline 0 CA--C 1.582 2.185 0 N-CA-C 118.135 2.643 . . . . 0.0 118.135 179.304 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 28.2 Cg_endo -99.44 138.31 0.3 Allowed 'Trans proline' 0 C--N 1.377 2.076 0 N-CA-C 118.515 2.467 . . . . 0.0 118.515 -168.197 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 46' ' ' SER . . . . . . . . . . . . . 74.5 m -97.22 -47.96 0.23 Allowed Pre-proline 0 CA--C 1.576 1.963 0 CA-C-O 115.627 -2.13 . . . . 0.0 113.256 141.823 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 67.5 Cg_exo -61.04 76.85 0.08 OUTLIER 'Trans proline' 0 CA--C 1.57 2.31 0 CA-C-N 124.979 2.814 . . . . 0.0 117.679 166.789 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 48' ' ' VAL . . . . . . . . . . . . 0.251 27.9 m -88.9 -27.19 5.39 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.137 0 N-CA-C 118.756 2.873 . . . . 0.0 118.756 -179.223 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 49' ' ' THR . . . . . . . . . . . . . 87.0 m -117.95 100.51 7.61 Favored 'General case' 0 CA--C 1.568 1.662 2 O-C-N 113.148 -5.97 . . . . 0.0 106.938 -22.041 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 50' ' ' GLY . . . . . . . . . . . . . . . 78.84 6.05 88.61 Favored Glycine 0 N--CA 1.497 2.758 0 N-CA-C 120.706 3.042 . . . . 0.0 120.706 -171.316 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 51' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -75.17 -36.66 61.48 Favored 'General case' 0 CA--C 1.584 2.263 0 CA-C-N 121.43 2.615 . . . . 0.0 117.27 -170.902 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 52' ' ' ARG . . . . . . . . . . . . 0.304 48.2 ttt180 -162.1 -88.28 0.03 OUTLIER 'General case' 0 CA--C 1.591 2.555 0 C-N-CA 125.488 1.515 . . . . 0.0 112.129 169.784 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -169.12 -167.47 0.73 Allowed 'General case' 0 N--CA 1.503 2.194 2 O-C-N 111.373 -7.079 . . . . 0.0 116.739 3.512 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . 0.63 1.2 m-20 -132.45 48.42 2.42 Favored 'General case' 0 CA--C 1.575 1.928 0 CA-C-O 127.207 3.384 . . . . 0.0 118.225 -148.355 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 55' ' ' ALA . . . . . . . . . . . . 0.527 . . 47.29 -88.2 0.01 OUTLIER 'General case' 0 CA--C 1.571 1.759 2 O-C-N 109.157 -8.464 . . . . 0.0 122.205 41.741 . . . . . . . . 3 2 . 1 . 008 nuclear orig full ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -41.47 -22.15 0.02 OUTLIER 'General case' 0 N--CA 1.51 2.536 0 N-CA-C 119.339 3.088 . . . . 0.0 119.339 139.441 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 57' ' ' ARG . . . . . . . . . . . . 0.396 1.2 mpt_? -101.28 -8.53 22.05 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 117.069 -3.519 . . . . 0.0 113.203 177.782 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 58' ' ' LEU . . . . . . . . . . . . 0.556 4.0 mp -83.18 -5.35 59.09 Favored 'General case' 0 CA--C 1.603 3.005 0 O-C-N 119.289 -2.132 . . . . 0.0 116.555 144.987 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 59' ' ' ALA . . . . . . . . . . . . . . . -45.28 -46.72 12.84 Favored 'General case' 0 N--CA 1.518 2.947 0 O-C-N 117.074 -3.517 . . . . 0.0 115.033 131.193 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -79.4 -8.27 58.98 Favored 'General case' 0 N--CA 1.496 1.874 0 N-CA-C 119.163 3.024 . . . . 0.0 119.163 175.915 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 10.4 tm-20 -56.15 -55.58 31.32 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.027 -1.046 . . . . 0.0 111.782 145.538 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 62' ' ' GLN . . . . . . . . . . . . 0.311 4.8 tp60 -54.46 -46.86 73.43 Favored 'General case' 0 CA--C 1.574 1.867 0 N-CA-C 116.074 1.879 . . . . 0.0 116.074 167.479 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 21.6 m -36.32 -59.09 0.66 Allowed 'General case' 0 N--CA 1.511 2.584 0 N-CA-C 118.483 2.772 . . . . 0.0 118.483 166.106 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 64' ' ' GLU . . . . . . . . . . . . 0.416 8.9 mt-10 -87.23 10.28 17.54 Favored 'General case' 0 CA--C 1.573 1.865 0 N-CA-C 113.099 0.777 . . . . 0.0 113.099 -175.171 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -88.08 -55.01 3.93 Favored 'General case' 0 CA--C 1.58 2.123 0 C-N-CA 125.151 1.38 . . . . 0.0 113.844 143.218 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 66' ' ' VAL . . . . . . . . . . . . 0.427 11.2 m . . . . . 0 N--CA 1.515 2.788 0 N-CA-C 118.435 2.754 . . . . 0.0 118.435 -161.344 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.561 1.404 0 N-CA-C 113.703 1.001 . . . . 0.0 113.703 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 18.5 mmm180 -89.06 80.87 6.91 Favored 'General case' 0 N--CA 1.493 1.715 0 CA-C-O 122.668 1.223 . . . . 0.0 113.373 -179.927 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 13.2 p-10 -111.24 47.46 1.0 Allowed 'General case' 0 CA--C 1.572 1.813 0 O-C-N 121.463 -0.773 . . . . 0.0 110.259 158.424 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 26.3 p-10 -139.99 67.98 34.72 Favored Pre-proline 0 CA--C 1.57 1.736 0 O-C-N 120.566 -1.334 . . . . 0.0 113.715 166.918 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 1.9 Cg_endo -109.55 173.51 0.07 OUTLIER 'Trans proline' 0 CA--C 1.556 1.619 0 C-N-CA 121.94 1.76 . . . . 0.0 112.964 -157.554 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . 0.268 1.8 p-80 -143.61 148.35 35.73 Favored 'General case' 0 N--CA 1.486 1.347 0 N-CA-C 118.173 2.657 . . . . 0.0 118.173 -144.581 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 25.5 p90 -131.71 166.18 22.08 Favored 'General case' 0 CA--C 1.561 1.393 0 CA-C-N 113.806 -1.543 . . . . 0.0 109.033 168.91 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 14.1 m120 -74.39 98.39 3.26 Favored 'General case' 0 CA--C 1.563 1.467 0 O-C-N 119.641 -1.912 . . . . 0.0 110.872 162.67 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 3.6 t80 -69.97 157.61 37.15 Favored 'General case' 0 CA--C 1.568 1.662 0 CA-C-O 124.26 1.981 . . . . 0.0 109.873 147.283 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 12.3 tpt180 169.27 87.34 0.0 OUTLIER 'General case' 0 N--CA 1.502 2.137 0 O-C-N 119.264 -2.147 . . . . 0.0 106.904 -124.283 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -136.79 121.7 12.79 Favored Pre-proline 0 CA--C 1.575 1.909 0 CA-C-O 117.248 -1.358 . . . . 0.0 112.886 -149.172 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 98.9 Cg_exo -43.26 150.91 0.35 Allowed 'Trans proline' 0 C--N 1.379 2.142 0 C-N-CA 123.875 3.05 . . . . 0.0 118.969 -179.904 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -50.94 -40.19 56.72 Favored 'General case' 0 N--CA 1.499 1.994 0 N-CA-C 117.983 2.586 . . . . 0.0 117.983 -165.805 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 9.6 pt-20 -63.37 -43.25 98.15 Favored 'General case' 0 CA--C 1.564 1.492 0 N-CA-C 116.287 1.958 . . . . 0.0 116.287 165.428 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 1.2 t -59.96 -48.91 86.0 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.064 0 CA-C-N 123.002 2.637 . . . . 0.0 112.637 172.457 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 3.4 ttt180 -69.7 -41.29 75.59 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-N 121.13 1.786 . . . . 0.0 115.797 174.111 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -60.91 -37.68 83.08 Favored 'General case' 0 CA--C 1.565 1.543 0 CA-C-N 123.289 2.768 . . . . 0.0 114.378 166.237 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 48.4 mtmt -62.47 -62.76 1.53 Allowed 'General case' 0 CA--C 1.564 1.488 0 CA-C-N 121.229 1.832 . . . . 0.0 114.481 166.7 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 12.5 tp -56.89 -36.19 69.84 Favored 'General case' 0 N--CA 1.491 1.578 0 N-CA-C 115.855 1.798 . . . . 0.0 115.855 176.319 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 12.1 ttpt -89.29 -27.85 20.28 Favored 'General case' 0 CA--C 1.568 1.656 0 C-N-CA 125.143 1.377 . . . . 0.0 114.046 179.081 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 13.2 m-30 -65.31 -70.67 0.22 Allowed 'General case' 0 N--CA 1.493 1.681 0 CA-C-O 115.103 -2.38 . . . . 0.0 110.926 156.887 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . 0.35 0.0 OUTLIER -23.55 -47.71 0.01 OUTLIER 'General case' 0 CA--C 1.6 2.869 0 CA-C-N 124.631 3.378 . . . . 0.0 115.102 163.794 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -57.94 -76.96 0.03 OUTLIER 'General case' 0 CA--C 1.587 2.377 0 N-CA-C 117.61 2.448 . . . . 0.0 117.61 156.726 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -63.45 -45.62 90.02 Favored 'General case' 0 N--CA 1.503 2.198 0 N-CA-C 118.948 2.944 . . . . 0.0 118.948 179.102 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -40.02 -51.67 2.53 Favored 'General case' 0 CA--C 1.589 2.449 0 N-CA-C 116.523 2.045 . . . . 0.0 116.523 159.055 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 91.0 m-20 -82.02 -47.61 12.43 Favored 'General case' 0 N--CA 1.499 2.019 0 N-CA-C 116.238 1.94 . . . . 0.0 116.238 176.356 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 116.23 37.03 1.05 Allowed Glycine 0 CA--C 1.56 2.853 0 N-CA-C 117.776 1.87 . . . . 0.0 117.776 -156.834 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 29.1 mtm-85 -126.3 161.02 28.74 Favored 'General case' 0 CA--C 1.569 1.689 0 N-CA-C 106.532 -1.655 . . . . 0.0 106.532 168.211 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 38.1 t -119.6 115.0 23.09 Favored 'General case' 0 N--CA 1.501 2.105 0 O-C-N 118.842 -2.411 . . . . 0.0 105.411 -177.681 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 22.7 mtp -43.72 -40.93 4.54 Favored 'General case' 0 N--CA 1.5 2.068 0 N-CA-C 119.109 3.003 . . . . 0.0 119.109 -146.175 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -46.17 -44.63 16.14 Favored 'General case' 0 CA--C 1.601 2.906 0 CA-C-N 125.683 3.856 . . . . 0.0 115.371 163.721 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . 0.356 28.7 t -49.07 -75.59 0.03 OUTLIER 'General case' 0 N--CA 1.503 2.191 0 N-CA-C 118.338 2.718 . . . . 0.0 118.338 143.608 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 10.4 tp10 -60.6 -55.01 38.45 Favored 'General case' 0 N--CA 1.516 2.87 0 CA-C-N 124.217 3.19 . . . . 0.0 116.191 -173.208 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -39.88 -53.9 2.23 Favored 'General case' 0 CA--C 1.55 0.972 0 CA-C-O 115.805 -2.045 . . . . 0.0 108.3 167.481 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 13.1 mt -61.1 -47.24 87.21 Favored 'General case' 0 N--CA 1.486 1.348 0 CA-C-N 123.263 2.756 . . . . 0.0 115.913 174.75 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.56 -44.71 93.21 Favored 'General case' 0 N--CA 1.479 0.989 0 CA-C-O 116.748 -1.596 . . . . 0.0 114.269 177.472 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 3.8 tt -69.94 -32.68 52.46 Favored 'Isoleucine or valine' 0 C--O 1.199 -1.598 0 CA-C-O 114.989 -2.434 . . . . 0.0 114.719 166.168 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 3.0 t -78.21 -48.36 23.09 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.179 0 CA-C-N 123.581 2.9 . . . . 0.0 112.156 -174.435 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 27.2 mt-30 -49.4 -46.15 47.03 Favored 'General case' 0 CA--C 1.563 1.462 0 C-N-CA 123.77 0.828 . . . . 0.0 112.153 154.507 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . 0.422 3.9 t0 -51.55 -41.65 61.25 Favored 'General case' 0 N--CA 1.488 1.439 0 N-CA-C 118.913 2.931 . . . . 0.0 118.913 158.444 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . 0.275 . . -87.24 -40.73 14.27 Favored 'General case' 0 N--CA 1.479 0.978 0 N-CA-C 115.465 1.654 . . . . 0.0 115.465 -155.494 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 2.1 pp -94.79 -25.4 16.67 Favored 'General case' 0 CA--C 1.565 1.526 0 N-CA-C 117.471 2.397 . . . . 0.0 117.471 160.632 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 16.2 t -106.8 -13.29 15.29 Favored 'General case' 0 N--CA 1.495 1.781 0 CA-C-N 122.754 2.525 . . . . 0.0 116.208 -177.734 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 42.6 mttt -119.93 61.47 7.35 Favored Pre-proline 0 N--CA 1.489 1.504 0 CA-C-N 120.921 1.691 . . . . 0.0 108.34 163.067 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 64.8 Cg_endo -88.26 100.9 0.42 Allowed 'Trans proline' 0 CA--C 1.572 2.385 0 N-CA-C 120.18 3.108 . . . . 0.0 120.18 75.414 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 58.0 m -107.78 116.56 57.18 Favored Pre-proline 0 CA--C 1.577 2.018 0 CA-C-O 117.662 -1.161 . . . . 0.0 108.292 152.037 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . 0.271 4.7 Cg_exo -17.6 74.23 0.0 OUTLIER 'Trans proline' 0 CA--C 1.573 2.446 1 N-CA-C 126.164 5.409 . . . . 0.0 126.164 -156.977 . . . . . . . . 3 2 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . 0.42 29.2 t 76.84 -67.02 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.504 2.262 0 N-CA-C 115.427 1.64 . . . . 0.0 115.427 167.794 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . 0.339 5.5 p 74.85 58.85 0.07 Allowed 'General case' 0 CA--C 1.58 2.101 0 CA-C-O 122.469 1.128 . . . . 0.0 112.172 -172.401 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 79.19 -63.59 3.87 Favored Glycine 0 N--CA 1.498 2.824 0 N-CA-C 119.21 2.444 . . . . 0.0 119.21 -172.874 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -94.09 53.98 1.84 Allowed 'General case' 0 CA--C 1.583 2.239 0 N-CA-C 119.002 2.964 . . . . 0.0 119.002 -156.15 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 81.9 mtt85 50.37 93.13 0.02 OUTLIER 'General case' 0 N--CA 1.509 2.519 0 N-CA-C 118.529 2.789 . . . . 0.0 118.529 160.304 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . 0.308 3.1 p-10 -170.15 -92.86 0.01 OUTLIER 'General case' 0 N--CA 1.511 2.588 0 CA-C-O 116.311 -1.805 . . . . 0.0 112.975 -161.541 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . 1.832 56.3 m-20 65.23 2.14 1.79 Allowed 'General case' 0 N--CA 1.521 3.107 1 N-CA-C 123.205 4.521 . . . . 0.0 123.205 -129.834 . . . . . . . . 3 2 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . 0.521 ' O ' ' N ' ' A' ' 58' ' ' LEU . . . 25.1 85.55 0.01 OUTLIER 'General case' 0 CA--C 1.502 -0.88 0 CA-C-N 111.333 -2.667 . . . . 0.0 118.198 -134.212 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.423 ' O ' ' C ' ' A' ' 57' ' ' ARG 1.321 1.8 pt-20 109.47 3.49 0.01 OUTLIER 'General case' 0 CA--C 1.591 2.541 3 N-CA-C 129.523 6.86 . . . . 0.0 129.523 155.826 . . . . . . . . 4 3 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.423 ' C ' ' O ' ' A' ' 56' ' ' GLU 2.457 0.0 OUTLIER 9.8 73.16 0.01 OUTLIER 'General case' 0 CA--C 1.609 3.218 2 CA-C-N 102.222 -6.808 . . . . 0.0 113.326 -95.579 . . . . . . . . 5 4 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.521 ' N ' ' O ' ' A' ' 55' ' ' ALA . 0.3 OUTLIER -53.01 -41.24 64.46 Favored 'General case' 0 N--CA 1.536 3.83 1 O-C-N 114.921 -4.862 . . . . 0.0 109.918 172.083 . . . . . . . . 4 4 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . 0.271 . . -18.75 -77.08 0.01 OUTLIER 'General case' 0 CA--C 1.575 1.935 2 CA-C-N 105.998 -5.092 . . . . 0.0 123.59 132.212 . . . . . . . . 3 2 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -124.12 -6.32 7.79 Favored 'General case' 0 CA--C 1.559 1.293 0 CA-C-N 121.872 2.124 . . . . 0.0 113.026 -159.46 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . 2.012 36.9 mt-10 -25.85 -83.06 0.01 OUTLIER 'General case' 0 CA--C 1.55 0.967 0 N-CA-C 120.409 3.485 . . . . 0.0 120.409 116.116 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 9.5 tp60 -88.09 -55.69 3.64 Favored 'General case' 0 C--N 1.36 1.023 0 C-N-CA 119.269 -0.972 . . . . 0.0 110.575 -161.158 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . 0.272 66.0 p -82.04 52.54 2.0 Allowed 'General case' 0 CA--C 1.56 1.343 0 N-CA-C 115.023 1.49 . . . . 0.0 115.023 152.878 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 30.0 tt0 -97.42 -59.43 1.78 Allowed 'General case' 0 CA--C 1.562 1.427 0 O-C-N 118.842 -2.411 . . . . 0.0 111.709 104.91 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . 0.288 2.2 mp -94.22 49.64 1.32 Allowed 'General case' 0 N--CA 1.502 2.142 0 CA-C-O 124.02 1.867 . . . . 0.0 114.974 -162.965 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 2.2 m . . . . . 0 N--CA 1.5 2.065 0 CA-C-N 112.737 -2.028 . . . . 0.0 113.203 173.414 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 1.525 0 N-CA-C 117.616 2.45 . . . . 0.0 117.616 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 2' ' ' ARG . . . . . . . . . . . . 0.336 79.3 mtt180 67.8 52.04 0.75 Allowed 'General case' 0 N--CA 1.494 1.744 0 N-CA-C 117.131 2.271 . . . . 0.0 117.131 174.056 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 43.4 m-20 -95.49 63.95 2.55 Favored 'General case' 0 CA--C 1.571 1.768 0 O-C-N 120.787 -1.195 . . . . 0.0 108.177 147.567 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 4' ' ' ASP . . . . . . . . . . . . . 3.6 p-10 -162.6 90.07 1.32 Allowed Pre-proline 0 CA--C 1.57 1.73 0 C-N-CA 124.851 1.26 . . . . 0.0 108.13 -176.522 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 7.2 Cg_exo -91.58 140.43 2.5 Favored 'Trans proline' 0 CA--C 1.552 1.379 0 CA-C-N 123.533 2.298 . . . . 0.0 113.183 -159.981 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 6' ' ' HIS . . . . . . . . . . . . . 67.5 m80 -72.29 128.13 34.69 Favored 'General case' 0 CA--C 1.575 1.923 0 CA-C-N 114.852 -1.067 . . . . 0.0 111.784 173.008 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 7' ' ' PHE . . . . . . . . . . . . 0.252 2.5 p90 -131.92 149.47 52.43 Favored 'General case' 0 CA--C 1.565 1.529 0 O-C-N 119.882 -1.761 . . . . 0.0 111.036 147.877 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 8' ' ' ASN . . . . . . . . . . . . . 12.9 m120 -71.86 84.69 0.94 Allowed 'General case' 0 N--CA 1.491 1.606 0 O-C-N 120.521 -1.362 . . . . 0.0 112.234 176.727 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 9' ' ' PHE . . . . . 0.408 ' CD2' ' SD ' ' B' ' 11' ' ' MET . 9.0 t80 -81.23 149.75 28.9 Favored 'General case' 0 CA--C 1.561 1.374 0 CA-C-O 126.151 2.881 . . . . 0.0 111.306 171.033 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 10' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -172.6 112.5 0.26 Allowed 'General case' 0 C--N 1.307 -1.243 0 CA-C-N 111.5 -2.591 . . . . 0.0 105.54 -129.351 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 11' ' ' MET . . . . . 0.408 ' SD ' ' CD2' ' B' ' 9' ' ' PHE . 0.9 OUTLIER -133.71 117.91 14.31 Favored Pre-proline 0 CA--C 1.564 1.487 0 CA-C-O 117.375 -1.298 . . . . 0.0 110.032 -153.176 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 12' ' ' PRO . . . . . . . . . . . . . 76.1 Cg_exo -42.92 145.59 1.09 Allowed 'Trans proline' 0 C--N 1.374 1.869 0 C-N-CA 123.249 2.633 . . . . 0.0 116.1 163.886 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 13' ' ' MET . . . . . . . . . . . . . 3.5 tpt -51.56 -41.18 60.94 Favored 'General case' 0 N--CA 1.494 1.736 0 N-CA-C 118.551 2.797 . . . . 0.0 118.551 -154.632 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -63.39 -43.29 98.0 Favored 'General case' 0 CA--C 1.563 1.457 0 N-CA-C 116.722 2.119 . . . . 0.0 116.722 166.708 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -57.43 -47.25 85.22 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.39 0 CA-C-N 124.394 3.27 . . . . 0.0 112.951 172.576 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 1.9 ttt180 -75.13 -37.84 61.26 Favored 'General case' 0 N--CA 1.475 0.818 0 CA-C-O 116.6 -1.666 . . . . 0.0 115.236 176.381 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 17' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -61.74 -37.37 83.99 Favored 'General case' 0 CA--C 1.569 1.676 0 CA-C-N 123.12 2.691 . . . . 0.0 114.056 163.405 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . 0.269 43.2 mtmt -66.3 -49.93 65.36 Favored 'General case' 0 CA--C 1.563 1.461 0 CA-C-N 122.018 2.19 . . . . 0.0 115.112 170.416 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 19' ' ' LEU . . . . . . . . . . . . 0.27 11.8 tp -70.12 -39.22 75.59 Favored 'General case' 0 N--CA 1.487 1.391 0 C-N-CA 124.98 1.312 . . . . 0.0 114.526 176.374 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 20' ' ' LYS . . . . . . . . . . . . . 13.4 ttpt -84.92 -28.6 25.81 Favored 'General case' 0 CA--C 1.565 1.525 0 CA-C-O 117.423 -1.275 . . . . 0.0 114.271 177.597 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 18.5 m-30 -67.03 -70.72 0.23 Allowed 'General case' 0 N--CA 1.492 1.644 0 CA-C-O 113.093 -3.337 . . . . 0.0 109.945 160.337 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . 0.275 37.2 ttt85 -20.26 -53.78 0.02 OUTLIER 'General case' 0 CA--C 1.587 2.391 1 CA-C-N 126.284 4.129 . . . . 0.0 116.372 165.399 . . . . . . . . 3 2 . 1 . 009 nuclear orig full ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -54.32 -79.53 0.02 OUTLIER 'General case' 0 CA--C 1.588 2.438 0 N-CA-C 117.288 2.329 . . . . 0.0 117.288 159.023 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 66.7 mm-40 -71.49 -32.58 68.4 Favored 'General case' 0 CA--C 1.575 1.934 0 N-CA-C 119.361 3.097 . . . . 0.0 119.361 -176.41 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 25' ' ' ALA . . . . . . . . . . . . . . . -41.56 -49.99 4.05 Favored 'General case' 0 CA--C 1.58 2.1 0 N-CA-C 116.549 2.055 . . . . 0.0 116.549 153.131 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 26' ' ' ASN . . . . . . . . . . . . 0.264 0.0 OUTLIER -107.6 -42.27 4.81 Favored 'General case' 0 CA--C 1.576 1.972 0 N-CA-C 116.09 1.885 . . . . 0.0 116.09 -163.975 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 27' ' ' GLY . . . . . . . . . . . . . . . 134.27 12.24 1.46 Allowed Glycine 0 N--CA 1.498 2.824 0 N-CA-C 119.232 2.453 . . . . 0.0 119.232 -167.097 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 28' ' ' ARG . . . . . . . . . . . . . 72.4 mtm-85 -111.35 165.75 11.69 Favored 'General case' 0 CA--C 1.575 1.922 0 CA-C-N 120.39 2.095 . . . . 0.0 105.424 168.087 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 29' ' ' SER . . . . . . . . . . . . . 8.8 t -133.7 113.62 12.54 Favored 'General case' 0 N--CA 1.506 2.361 0 O-C-N 117.103 -3.498 . . . . 0.0 107.129 -177.247 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 30' ' ' MET . . . . . . . . . . . . . 25.6 mtp -44.8 -34.46 2.32 Favored 'General case' 0 N--CA 1.5 2.029 0 N-CA-C 121.338 3.829 . . . . 0.0 121.338 -139.533 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 31' ' ' ASN . . . . . . . . . . . . 0.26 8.8 t-20 -49.75 -49.64 47.42 Favored 'General case' 0 CA--C 1.591 2.543 0 O-C-N 118.572 -2.58 . . . . 0.0 113.882 161.318 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 32' ' ' SER . . . . . . . . . . . . 0.29 27.6 t -49.43 -64.26 0.86 Allowed 'General case' 0 N--CA 1.501 2.115 0 N-CA-C 119.649 3.203 . . . . 0.0 119.649 146.955 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -67.55 -60.47 2.53 Favored 'General case' 0 N--CA 1.516 2.863 0 CA-C-N 123.45 2.841 . . . . 0.0 116.156 -176.449 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . 0.543 0.1 OUTLIER -49.06 -37.06 19.83 Favored 'General case' 0 CA--C 1.563 1.48 0 CA-C-O 114.184 -2.817 . . . . 0.0 108.207 172.009 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 35' ' ' LEU . . . . . . . . . . . . . 13.9 mt -64.67 -56.73 11.92 Favored 'General case' 0 N--CA 1.491 1.613 1 CA-C-N 126.158 4.072 . . . . 0.0 115.725 167.559 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 36' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -50.64 -40.26 52.78 Favored 'General case' 0 CA--C 1.58 2.101 0 N-CA-C 115.784 1.772 . . . . 0.0 115.784 175.734 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 37' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -74.03 -35.62 42.28 Favored 'Isoleucine or valine' 0 CA--C 1.571 1.762 0 N-CA-C 116.164 1.913 . . . . 0.0 116.164 166.47 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 38' ' ' VAL . . . . . . . . . . . . . 3.3 t -72.5 -46.76 54.47 Favored 'Isoleucine or valine' 0 CA--C 1.575 1.941 0 O-C-N 119.041 -2.287 . . . . 0.0 110.796 177.699 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 23.7 mt-30 -51.38 -40.85 60.06 Favored 'General case' 0 CA--C 1.562 1.427 0 N-CA-C 114.539 1.311 . . . . 0.0 114.539 155.517 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 40' ' ' ASP . . . . . . . . . . . . . 44.8 t0 -53.32 -47.71 69.07 Favored 'General case' 0 N--CA 1.492 1.634 0 N-CA-C 116.518 2.044 . . . . 0.0 116.518 156.102 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 41' ' ' ALA . . . . . . . . . . . . 0.263 . . -69.6 -26.86 64.65 Favored 'General case' 0 CA--C 1.564 1.514 0 N-CA-C 117.462 2.393 . . . . 0.0 117.462 -174.618 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -110.31 -34.06 6.46 Favored 'General case' 0 CA--C 1.573 1.856 0 C-N-CA 124.687 1.195 . . . . 0.0 112.993 175.356 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 43' ' ' SER . . . . . . . . . . . . . 7.5 t -84.49 32.93 0.5 Allowed 'General case' 0 N--CA 1.505 2.323 0 N-CA-C 116.783 2.142 . . . . 0.0 116.783 164.134 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 44' ' ' LYS . . . . . . . . . . . . . 30.8 mtpp -41.35 -24.87 0.15 Allowed Pre-proline 0 CA--C 1.599 2.836 1 N-CA-C 127.404 6.076 . . . . 0.0 127.404 145.325 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 0.3 OUTLIER -44.25 169.4 0.03 OUTLIER 'Trans proline' 0 CA--C 1.564 1.994 1 N-CA-C 125.751 5.25 . . . . 0.0 125.751 -162.731 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 46' ' ' SER . . . . . . . . . . . . . 86.4 p -84.94 118.09 70.19 Favored Pre-proline 0 CA--C 1.58 2.101 0 CA-C-O 116.585 -1.674 . . . . 0.0 112.777 162.408 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_endo -103.57 115.24 0.42 Allowed 'Cis proline' 0 CA--C 1.571 2.355 0 CA-C-N 124.766 2.738 . . . . 0.0 116.088 -0.974 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 48' ' ' VAL . . . . . . . . . . . . . 7.7 p -74.81 -37.55 42.44 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.26 0 O-C-N 120.409 -1.432 . . . . 0.0 113.988 143.453 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 49' ' ' THR . . . . . . . . . . . . . 5.4 t -159.69 -174.97 4.89 Favored 'General case' 0 CA--C 1.572 1.823 0 CA-C-O 124.086 1.898 . . . . 0.0 115.178 -143.649 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 50' ' ' GLY . . . . . . . . . . . . . . . -92.5 -47.48 3.23 Favored Glycine 0 N--CA 1.495 2.632 0 CA-C-N 112.748 -2.024 . . . . 0.0 117.368 163.526 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 51' ' ' TYR . . . . . . . . . . . . 0.3 0.0 OUTLIER -65.7 88.25 0.1 Allowed 'General case' 0 CA--C 1.584 2.265 0 CA-C-N 119.339 1.569 . . . . 0.0 113.768 170.281 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 52' ' ' ARG . . . . . . . . . . . . . 4.0 tpm_? -87.3 94.0 9.55 Favored 'General case' 0 CA--C 1.576 1.945 0 N-CA-C 114.758 1.392 . . . . 0.0 114.758 -166.714 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -154.04 -149.22 0.27 Allowed 'General case' 0 CA--C 1.61 3.258 0 N-CA-C 107.238 -1.393 . . . . 0.0 107.238 -158.073 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 53.61 -71.84 0.01 OUTLIER 'General case' 0 N--CA 1.497 1.901 2 O-C-N 111.184 -7.198 . . . . 0.0 113.909 -66.912 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 55' ' ' ALA . . . . . . . . . . . . 2.367 . . 111.12 -150.94 0.0 OUTLIER 'General case' 0 N--CA 1.384 -3.726 2 CA-C-O 130.374 4.892 . . . . 0.0 99.549 -156.152 . . . . . . . . 3 2 . 1 . 009 nuclear orig full ' B' B ' 56' ' ' GLU . . . . . . . . . . . . 0.373 22.4 mt-10 64.54 -53.43 0.29 Allowed 'General case' 0 C--N 1.249 -3.782 1 O-C-N 98.075 -15.391 . . . . 0.0 118.614 24.049 . . . . . . . . 3 2 . 1 . 009 nuclear orig full ' B' B ' 57' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -103.81 -54.96 2.47 Favored 'General case' 0 N--CA 1.485 1.311 0 CA-C-N 124.159 3.163 . . . . 0.0 118.151 -176.156 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 58' ' ' LEU . . . . . . . . . . . . 0.403 0.2 OUTLIER -66.88 -16.96 64.66 Favored 'General case' 0 CA--C 1.577 2.003 0 CA-C-O 115.81 -2.043 . . . . 0.0 113.328 157.526 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 59' ' ' ALA . . . . . . . . . . . . . . . -48.82 -60.56 2.64 Favored 'General case' 0 C--N 1.379 1.861 0 CA-C-N 123.54 2.882 . . . . 0.0 118.104 147.041 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -125.23 -16.97 5.81 Favored 'General case' 0 N--CA 1.486 1.359 0 N-CA-C 114.947 1.462 . . . . 0.0 114.947 -151.943 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 61' ' ' GLU . . . . . . . . . . . . 0.286 0.5 OUTLIER -68.47 -21.3 64.63 Favored 'General case' 0 CA--C 1.559 1.299 0 CA-C-O 112.293 -3.717 . . . . 0.0 113.699 138.143 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 62' ' ' GLN . . . . . . . . . . . . 0.271 4.0 tp60 -75.36 -89.16 0.03 OUTLIER 'General case' 0 C--N 1.394 2.519 1 CA-C-N 127.552 4.706 . . . . 0.0 110.445 161.115 . . . . . . . . 3 2 . 1 . 009 nuclear orig full ' B' B ' 63' ' ' SER . . . . . . . . . . . . 0.406 35.9 t -88.0 49.18 1.75 Allowed 'General case' 0 CA--C 1.557 1.219 0 N-CA-C 116.591 2.071 . . . . 0.0 116.591 179.412 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 64' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -119.01 -21.33 7.73 Favored 'General case' 0 CA--C 1.575 1.924 0 CA-C-O 114.476 -2.678 . . . . 0.0 115.491 112.442 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 65' ' ' LEU . . . . . . . . . . . . 0.319 3.5 mt -109.49 50.06 0.8 Allowed 'General case' 0 N--CA 1.512 2.673 1 CA-C-N 126.8 4.363 . . . . 0.0 113.522 -178.872 . . . . . . . . 3 2 . 1 . 009 nuclear orig full ' B' B ' 66' ' ' VAL . . . . . . . . . . . . . 2.4 m . . . . . 0 N--CA 1.495 1.776 0 CA-C-N 111.59 -2.55 . . . . 0.0 112.961 175.359 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.56 1.344 0 N-CA-C 113.627 0.973 . . . . 0.0 113.627 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -79.87 77.73 6.51 Favored 'General case' 0 N--CA 1.496 1.834 0 CA-C-O 122.764 1.268 . . . . 0.0 112.696 178.515 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -92.02 77.67 5.35 Favored 'General case' 0 N--CA 1.49 1.56 0 N-CA-C 107.068 -1.456 . . . . 0.0 107.068 171.053 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 2.1 p30 -159.6 78.97 2.75 Favored Pre-proline 0 CA--C 1.568 1.67 0 CA-C-N 115.371 -0.831 . . . . 0.0 112.1 -172.341 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 3.7 Cg_exo -98.06 148.74 0.75 Allowed 'Trans proline' 0 CA--C 1.551 1.343 0 CA-C-N 122.363 1.88 . . . . 0.0 114.131 -155.246 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 80.8 m80 -84.9 130.42 34.65 Favored 'General case' 0 CA--C 1.566 1.577 0 CA-C-N 113.946 -1.479 . . . . 0.0 112.369 178.476 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 3.2 p90 -132.45 159.56 38.99 Favored 'General case' 0 CA--C 1.567 1.625 0 CA-C-O 122.704 1.24 . . . . 0.0 111.048 153.896 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 70.7 m-80 -66.18 101.73 0.75 Allowed 'General case' 0 CA--C 1.573 1.847 0 O-C-N 120.877 -1.14 . . . . 0.0 112.68 173.999 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 5.2 t80 -120.18 110.08 16.19 Favored 'General case' 0 CA--C 1.547 0.838 0 N-CA-C 106.372 -1.714 . . . . 0.0 106.372 157.839 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . 0.383 0.0 OUTLIER 98.66 89.05 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.633 1 O-C-N 113.897 -5.502 . . . . 0.0 110.098 -17.654 . . . . . . . . 4 3 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 1.6 mpt? -147.74 149.57 33.91 Favored Pre-proline 0 CA--C 1.567 1.632 0 CA-C-O 118.086 -0.959 . . . . 0.0 111.976 -170.237 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_exo -44.85 141.94 5.56 Favored 'Trans proline' 0 CA--C 1.567 2.155 0 C-N-CA 122.436 2.091 . . . . 0.0 115.989 154.783 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 13.7 tpp -56.07 -27.79 54.96 Favored 'General case' 0 N--CA 1.496 1.847 0 N-CA-C 118.934 2.939 . . . . 0.0 118.934 -169.811 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 7.6 pt-20 -65.93 -47.62 74.12 Favored 'General case' 0 CA--C 1.57 1.712 0 N-CA-C 115.957 1.836 . . . . 0.0 115.957 165.304 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -60.37 -49.07 85.72 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.216 0 CA-C-N 122.263 2.301 . . . . 0.0 112.513 174.402 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 5.8 ttt180 -69.8 -33.11 71.91 Favored 'General case' 0 CA--C 1.548 0.894 0 CA-C-O 116.047 -1.93 . . . . 0.0 115.562 173.8 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 37.1 mt-10 -60.19 -48.1 83.16 Favored 'General case' 0 N--CA 1.491 1.615 0 CA-C-N 123.941 3.064 . . . . 0.0 114.197 160.312 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 53.0 mtmt -61.89 -45.66 92.79 Favored 'General case' 0 CA--C 1.562 1.436 0 N-CA-C 116.134 1.902 . . . . 0.0 116.134 174.529 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . 0.258 14.0 tp -69.0 -40.55 78.65 Favored 'General case' 0 CA--C 1.565 1.544 0 N-CA-C 115.01 1.485 . . . . 0.0 115.01 172.195 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 16.1 ttpt -85.22 -26.2 26.87 Favored 'General case' 0 CA--C 1.567 1.603 0 N-CA-C 114.259 1.207 . . . . 0.0 114.259 179.757 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 13.1 m-85 -61.94 -69.31 0.26 Allowed 'General case' 0 N--CA 1.49 1.554 0 CA-C-O 114.05 -2.881 . . . . 0.0 110.722 155.224 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . 0.304 1.9 ttt85 -23.22 -49.21 0.02 OUTLIER 'General case' 0 CA--C 1.598 2.8 0 CA-C-N 125.363 3.711 . . . . 0.0 116.53 163.406 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . 0.268 . . -58.13 -77.43 0.03 OUTLIER 'General case' 0 CA--C 1.59 2.502 0 N-CA-C 117.301 2.334 . . . . 0.0 117.301 158.482 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 87.9 mt-10 -61.01 -45.74 93.58 Favored 'General case' 0 N--CA 1.503 2.193 0 N-CA-C 118.774 2.879 . . . . 0.0 118.774 178.606 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -40.87 -50.96 3.22 Favored 'General case' 0 CA--C 1.587 2.377 0 N-CA-C 116.429 2.011 . . . . 0.0 116.429 160.04 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 88.4 m-20 -84.02 -43.44 15.14 Favored 'General case' 0 N--CA 1.5 2.039 0 N-CA-C 116.63 2.085 . . . . 0.0 116.63 177.46 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 108.67 32.44 3.14 Favored Glycine 0 CA--C 1.56 2.864 0 N-CA-C 117.738 1.855 . . . . 0.0 117.738 -153.568 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 12.0 mtt85 -116.66 158.77 23.24 Favored 'General case' 0 CA--C 1.57 1.746 0 N-CA-C 106.03 -1.841 . . . . 0.0 106.03 166.243 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 41.3 t -119.71 115.14 23.32 Favored 'General case' 0 N--CA 1.503 2.184 0 O-C-N 118.377 -2.702 . . . . 0.0 105.096 -178.948 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 8.3 mtp -43.22 -36.71 1.86 Allowed 'General case' 0 N--CA 1.502 2.145 0 N-CA-C 121.405 3.854 . . . . 0.0 121.405 -148.282 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 11.5 t-20 -48.71 -46.36 40.63 Favored 'General case' 0 CA--C 1.592 2.586 0 O-C-N 118.572 -2.58 . . . . 0.0 114.457 162.0 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . 0.287 46.6 t -51.78 -66.41 0.39 Allowed 'General case' 0 N--CA 1.499 2.004 0 N-CA-C 119.908 3.299 . . . . 0.0 119.908 146.918 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 -64.49 -59.92 3.76 Favored 'General case' 0 N--CA 1.515 2.801 0 CA-C-N 123.895 3.043 . . . . 0.0 114.774 -176.042 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . 0.477 0.3 OUTLIER -51.17 -41.36 60.11 Favored 'General case' 0 CA--C 1.56 1.365 0 CA-C-O 113.55 -3.119 . . . . 0.0 106.692 174.912 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 12.9 mt -62.99 -55.36 26.39 Favored 'General case' 0 N--CA 1.495 1.813 1 CA-C-N 127.281 4.582 . . . . 0.0 115.403 169.59 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . 0.276 1.0 OUTLIER -55.75 -49.81 72.1 Favored 'General case' 0 CA--C 1.566 1.561 0 CA-C-O 116.25 -1.833 . . . . 0.0 113.764 179.559 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 1.6 tt -60.11 -39.48 80.59 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.843 0 CA-C-N 122.619 2.463 . . . . 0.0 115.124 165.421 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 2.4 t -70.1 -49.97 51.36 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.994 0 CA-C-N 123.418 2.826 . . . . 0.0 112.696 -178.015 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 24.8 mt-30 -43.46 -46.7 6.91 Favored 'General case' 0 N--CA 1.489 1.522 0 C-N-CA 124.781 1.233 . . . . 0.0 113.724 152.995 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . 0.372 28.7 m-20 -58.46 -42.59 87.78 Favored 'General case' 0 CA--C 1.558 1.285 0 N-CA-C 117.356 2.354 . . . . 0.0 117.356 163.928 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . 0.265 . . -79.48 -41.76 26.78 Favored 'General case' 0 CA--C 1.553 1.095 0 N-CA-C 115.955 1.835 . . . . 0.0 115.955 -159.589 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 1.4 pp -101.31 -24.71 14.17 Favored 'General case' 0 CA--C 1.567 1.625 0 N-CA-C 117.418 2.377 . . . . 0.0 117.418 160.777 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 1.4 m -95.47 -12.37 25.99 Favored 'General case' 0 N--CA 1.498 1.971 0 CA-C-N 122.699 2.5 . . . . 0.0 116.167 -177.213 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . 0.374 1.3 mmmt 67.33 -168.25 0.01 OUTLIER Pre-proline 0 CA--C 1.588 2.423 0 CA-C-N 123.329 2.786 . . . . 0.0 113.894 169.879 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 22.8 Cg_exo -56.21 172.98 4.81 Favored 'Cis proline' 0 C--N 1.375 1.932 0 CA-C-N 125.854 3.127 . . . . 0.0 116.391 -7.993 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 69.6 m -89.07 108.95 27.21 Favored Pre-proline 0 CA--C 1.568 1.637 0 O-C-N 120.522 -1.361 . . . . 0.0 107.692 133.333 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 5.0 Cg_exo -73.16 98.65 1.03 Allowed 'Trans proline' 0 CA--C 1.566 2.117 0 CA-C-N 124.091 2.497 . . . . 0.0 109.708 172.048 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 19.4 m -83.54 67.79 0.54 Allowed 'Isoleucine or valine' 0 N--CA 1.509 2.496 0 N-CA-C 115.203 1.556 . . . . 0.0 115.203 -150.435 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 24.5 p -101.0 62.52 0.98 Allowed 'General case' 0 N--CA 1.494 1.761 0 O-C-N 120.08 -1.637 . . . . 0.0 111.898 -163.893 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 60.26 41.1 98.18 Favored Glycine 0 N--CA 1.496 2.645 0 N-CA-C 121.082 3.193 . . . . 0.0 121.082 174.138 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -136.48 12.73 3.23 Favored 'General case' 0 N--CA 1.504 2.268 0 N-CA-C 120.421 3.489 . . . . 0.0 120.421 -166.621 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . 0.251 98.9 mtt180 67.95 108.62 0.05 OUTLIER 'General case' 0 CA--C 1.583 2.226 0 N-CA-C 114.815 1.413 . . . . 0.0 114.815 -170.067 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . 0.458 0.9 OUTLIER -134.59 63.15 1.63 Allowed 'General case' 0 N--CA 1.507 2.399 0 C-N-CA 125.45 1.5 . . . . 0.0 111.801 179.236 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 39.1 m-20 -80.81 65.91 6.13 Favored 'General case' 0 CA--C 1.573 1.852 1 CA-C-O 128.849 4.166 . . . . 0.0 114.507 146.626 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . 0.437 . . -110.07 -66.98 1.02 Allowed 'General case' 0 CA--C 1.563 1.465 0 CA-C-N 108.984 -3.735 . . . . 0.0 113.891 -166.455 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 47.1 mt-10 6.49 -25.31 0.0 OUTLIER 'General case' 0 N--CA 1.503 2.176 1 N-CA-C 126.926 5.899 . . . . 0.0 126.926 100.041 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -110.34 -38.65 5.19 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-O 114.969 -2.444 . . . . 0.0 116.19 171.347 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . 0.588 0.0 OUTLIER -48.83 -47.7 42.3 Favored 'General case' 0 N--CA 1.521 3.092 0 CA-C-N 124.423 3.283 . . . . 0.0 116.352 160.092 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . 0.437 . . -17.42 -86.76 0.0 OUTLIER 'General case' 0 CA--C 1.564 1.482 1 N-CA-C 124.187 4.884 . . . . 0.0 124.187 132.634 . . . . . . . . 3 2 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 1.7 t70 -55.75 -45.03 78.11 Favored 'General case' 0 N--CA 1.479 0.977 0 N-CA-C 119.627 3.195 . . . . 0.0 119.627 -179.342 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . 0.634 0.1 OUTLIER -77.78 -17.49 57.44 Favored 'General case' 0 N--CA 1.499 2.01 0 CA-C-N 122.471 2.396 . . . . 0.0 113.056 178.593 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . 0.306 0.0 OUTLIER -73.22 -68.05 0.53 Allowed 'General case' 0 C--N 1.376 1.74 0 CA-C-N 123.774 2.988 . . . . 0.0 104.342 156.751 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . 0.704 3.4 p -65.49 -27.66 68.65 Favored 'General case' 0 N--CA 1.486 1.374 1 N-CA-C 122.472 4.249 . . . . 0.0 122.472 -167.164 . . . . . . . . 3 2 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 1.7 tp10 -85.84 0.12 53.86 Favored 'General case' 0 CA--C 1.574 1.872 0 N-CA-C 116.783 2.142 . . . . 0.0 116.783 155.504 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . 0.271 4.8 mp -116.6 44.24 2.06 Favored 'General case' 0 N--CA 1.514 2.746 0 CA-C-N 125.088 3.585 . . . . 0.0 114.362 156.867 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . 0.296 0.9 OUTLIER . . . . . 0 N--CA 1.5 2.047 0 CA-C-N 112.868 -1.969 . . . . 0.0 111.417 -165.776 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.562 1.412 0 N-CA-C 113.496 0.924 . . . . 0.0 113.496 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 2' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -84.49 77.45 10.02 Favored 'General case' 0 N--CA 1.494 1.748 0 CA-C-O 122.699 1.237 . . . . 0.0 113.89 -178.381 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -123.48 42.2 3.28 Favored 'General case' 0 CA--C 1.569 1.696 0 C-N-CA 124.321 1.049 . . . . 0.0 112.103 170.412 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 4' ' ' ASP . . . . . . . . . . . . . 7.1 p-10 -150.91 69.66 8.47 Favored Pre-proline 0 CA--C 1.571 1.763 0 N-CA-C 113.71 1.004 . . . . 0.0 113.71 157.076 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 95.2 Cg_endo -63.12 173.56 3.92 Favored 'Trans proline' 0 CA--C 1.567 2.169 0 C-N-CA 122.787 2.325 . . . . 0.0 116.128 156.473 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 6' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -154.15 148.1 25.59 Favored 'General case' 0 CA--C 1.548 0.873 0 CA-C-N 112.745 -2.025 . . . . 0.0 114.663 -153.175 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 7' ' ' PHE . . . . . . . . . . . . . 17.3 p90 -122.53 170.36 10.08 Favored 'General case' 0 CA--C 1.561 1.371 0 CA-C-O 122.978 1.371 . . . . 0.0 109.961 153.18 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 8' ' ' ASN . . . . . . . . . . . . . 20.7 m-80 -85.18 92.52 8.42 Favored 'General case' 0 N--CA 1.485 1.291 0 O-C-N 119.894 -1.754 . . . . 0.0 108.06 160.616 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 9' ' ' PHE . . . . . . . . . . . . . 16.0 t80 -69.55 159.04 34.09 Favored 'General case' 0 CA--C 1.561 1.39 0 CA-C-O 125.296 2.474 . . . . 0.0 110.809 162.002 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 10' ' ' ARG . . . . . . . . . . . . . 2.3 tmm_? -176.35 107.76 0.08 Allowed 'General case' 0 C--N 1.304 -1.386 0 N-CA-C 103.399 -2.815 . . . . 0.0 103.399 -122.643 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 11' ' ' MET . . . . . . . . . . . . . 13.4 mtm -134.43 119.59 14.28 Favored Pre-proline 0 N--CA 1.484 1.235 0 CA-C-O 117.218 -1.373 . . . . 0.0 112.216 -161.428 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 12' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_exo -40.61 141.11 0.9 Allowed 'Trans proline' 0 C--N 1.372 1.8 0 C-N-CA 122.962 2.442 . . . . 0.0 116.192 160.991 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 13' ' ' MET . . . . . . . . . . . . . 27.2 tpp -58.98 -26.13 64.21 Favored 'General case' 0 N--CA 1.495 1.822 0 N-CA-C 118.378 2.733 . . . . 0.0 118.378 -157.754 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 14' ' ' GLU . . . . . . . . . . . . 0.252 6.4 pt-20 -64.4 -49.14 72.74 Favored 'General case' 0 CA--C 1.572 1.803 0 N-CA-C 116.213 1.931 . . . . 0.0 116.213 161.477 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -58.22 -47.0 88.56 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.301 0 CA-C-N 122.568 2.44 . . . . 0.0 113.309 173.646 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 2.7 ttt180 -75.06 -32.57 61.54 Favored 'General case' 0 CA--C 1.543 0.684 0 CA-C-O 116.305 -1.807 . . . . 0.0 115.763 175.652 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 17' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -61.39 -44.83 96.47 Favored 'General case' 0 N--CA 1.492 1.647 0 CA-C-N 123.23 2.741 . . . . 0.0 113.242 159.916 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . 0.262 53.2 mtmt -58.74 -52.68 64.65 Favored 'General case' 0 CA--C 1.562 1.421 0 CA-C-N 121.173 1.806 . . . . 0.0 115.345 171.215 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 19' ' ' LEU . . . . . . . . . . . . 0.26 12.5 tp -71.12 -36.35 72.1 Favored 'General case' 0 CA--C 1.563 1.444 0 N-CA-C 115.442 1.645 . . . . 0.0 115.442 178.41 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 20' ' ' LYS . . . . . . . . . . . . . 18.3 ttpt -83.66 -20.81 32.92 Favored 'General case' 0 CA--C 1.584 2.262 0 N-CA-C 114.132 1.16 . . . . 0.0 114.132 172.756 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 9.4 m-30 -73.34 -65.88 0.76 Allowed 'General case' 0 N--CA 1.497 1.875 0 CA-C-N 122.547 2.43 . . . . 0.0 110.847 162.866 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . 0.311 0.2 OUTLIER -17.23 -52.57 0.01 OUTLIER 'General case' 0 CA--C 1.597 2.76 0 CA-C-N 124.79 3.45 . . . . 0.0 114.757 153.614 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -58.27 -77.06 0.03 OUTLIER 'General case' 0 CA--C 1.575 1.905 0 N-CA-C 118.272 2.693 . . . . 0.0 118.272 158.975 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 58.0 mm-40 -75.5 -33.65 60.79 Favored 'General case' 0 CA--C 1.576 1.98 0 N-CA-C 118.303 2.705 . . . . 0.0 118.303 -174.996 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 25' ' ' ALA . . . . . . . . . . . . . . . -45.61 -51.66 11.79 Favored 'General case' 0 CA--C 1.585 2.293 0 N-CA-C 116.009 1.855 . . . . 0.0 116.009 154.162 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 26' ' ' ASN . . . . . . . . . . . . . 90.8 m-20 -78.68 -53.02 7.59 Favored 'General case' 0 N--CA 1.499 1.989 0 N-CA-C 115.145 1.535 . . . . 0.0 115.145 174.867 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 27' ' ' GLY . . . . . . . . . . . . . . . 120.36 24.69 2.6 Favored Glycine 0 CA--C 1.562 2.99 0 N-CA-C 118.403 2.121 . . . . 0.0 118.403 -154.277 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 28' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -104.88 178.96 4.41 Favored 'General case' 0 CA--C 1.574 1.87 0 CA-C-N 120.211 2.005 . . . . 0.0 107.798 157.546 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 29' ' ' SER . . . . . . . . . . . . . 6.8 t -135.24 115.95 13.88 Favored 'General case' 0 N--CA 1.5 2.052 0 O-C-N 118.73 -2.481 . . . . 0.0 106.92 171.385 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 30' ' ' MET . . . . . . . . . . . . 0.355 2.7 ptm -48.84 -17.2 0.16 Allowed 'General case' 0 N--CA 1.506 2.341 1 N-CA-C 123.761 4.726 . . . . 0.0 123.761 -146.323 . . . . . . . . 3 2 . 1 . 010 nuclear orig full ' B' B ' 31' ' ' ASN . . . . . . . . . . . . . 15.6 t-20 -56.29 -52.85 62.98 Favored 'General case' 0 CA--C 1.587 2.37 0 O-C-N 117.513 -3.242 . . . . 0.0 113.452 151.498 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 32' ' ' SER . . . . . . . . . . . . 0.299 71.0 m -49.37 -64.74 0.72 Allowed 'General case' 0 N--CA 1.496 1.849 0 N-CA-C 118.09 2.626 . . . . 0.0 118.09 150.329 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . 0.27 4.9 tp10 -62.67 -60.15 3.91 Favored 'General case' 0 N--CA 1.513 2.676 0 CA-C-N 124.064 3.12 . . . . 0.0 114.449 -178.195 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . 0.63 0.1 OUTLIER -53.57 -36.11 61.54 Favored 'General case' 0 CA--C 1.562 1.409 0 CA-C-O 114.607 -2.616 . . . . 0.0 106.548 -177.855 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 35' ' ' LEU . . . . . . . . . . . . . 19.6 mt -66.16 -48.95 69.05 Favored 'General case' 0 C--N 1.37 1.484 0 CA-C-N 125.365 3.711 . . . . 0.0 115.926 167.361 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 36' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.14 -45.72 86.87 Favored 'General case' 0 N--CA 1.487 1.382 0 N-CA-C 114.671 1.36 . . . . 0.0 114.671 177.097 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 37' ' ' ILE . . . . . . . . . . . . . 3.0 tp -71.09 -28.46 33.06 Favored 'Isoleucine or valine' 0 CA--C 1.579 2.068 0 N-CA-C 116.851 2.167 . . . . 0.0 116.851 164.914 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 38' ' ' VAL . . . . . . . . . . . . . 2.8 t -83.75 -47.04 18.16 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.312 0 CA-C-N 124.265 3.211 . . . . 0.0 110.708 -177.923 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 26.1 mt-30 -54.53 -40.87 69.07 Favored 'General case' 0 CA--C 1.566 1.572 0 CA-C-O 118.093 -0.956 . . . . 0.0 112.268 158.038 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 40' ' ' ASP . . . . . . . . . . . . 0.315 24.9 t0 -46.75 -57.32 4.97 Favored 'General case' 0 N--CA 1.493 1.692 0 N-CA-C 115.881 1.808 . . . . 0.0 115.881 153.06 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 41' ' ' ALA . . . . . . . . . . . . 0.31 . . -78.83 -31.96 45.98 Favored 'General case' 0 N--CA 1.474 0.737 0 N-CA-C 119.12 3.007 . . . . 0.0 119.12 -155.18 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 2.1 pp -107.1 -1.6 21.85 Favored 'General case' 0 CA--C 1.563 1.474 0 N-CA-C 117.261 2.319 . . . . 0.0 117.261 159.216 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 43' ' ' SER . . . . . . . . . . . . . 87.0 p -145.75 23.57 1.4 Allowed 'General case' 0 N--CA 1.494 1.755 0 N-CA-C 118.317 2.71 . . . . 0.0 118.317 -178.382 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 44' ' ' LYS . . . . . . . . . . . . . 10.7 tmtt? -64.73 -44.69 74.15 Favored Pre-proline 0 N--CA 1.505 2.281 0 N-CA-C 119.622 3.193 . . . . 0.0 119.622 174.4 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -79.91 68.12 8.4 Favored 'Trans proline' 0 CA--C 1.57 2.287 0 CA-C-N 124.949 2.803 . . . . 0.0 119.113 -161.136 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 46' ' ' SER . . . . . . . . . . . . . 68.7 m -90.27 -54.92 0.29 Allowed Pre-proline 0 CA--C 1.574 1.868 0 CA-C-O 116.54 -1.695 . . . . 0.0 111.241 137.992 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 93.1 Cg_endo -68.11 72.62 0.8 Allowed 'Trans proline' 0 CA--C 1.573 2.472 0 CA-C-N 124.669 2.703 . . . . 0.0 113.678 153.185 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 48' ' ' VAL . . . . . . . . . . . . . 13.1 p -80.48 -56.44 6.57 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.843 0 CA-C-N 114.816 -1.083 . . . . 0.0 113.712 -171.515 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 49' ' ' THR . . . . . . . . . . . . 0.307 17.2 p 66.84 53.75 0.84 Allowed 'General case' 0 N--CA 1.5 2.062 0 CA-C-O 122.667 1.222 . . . . 0.0 113.757 169.522 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 50' ' ' GLY . . . . . . . . . . . . . . . 90.85 -51.97 3.25 Favored Glycine 0 N--CA 1.493 2.496 0 N-CA-C 117.642 1.817 . . . . 0.0 117.642 -163.413 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 51' ' ' TYR . . . . . . . . . . . . 0.256 16.9 p90 -84.11 80.87 9.04 Favored 'General case' 0 CA--C 1.568 1.646 0 N-CA-C 117.903 2.557 . . . . 0.0 117.903 -159.055 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 52' ' ' ARG . . . . . . . . . . . . . 9.6 mpt_? -79.38 58.9 2.73 Favored 'General case' 0 N--CA 1.504 2.275 0 O-C-N 119.59 -1.944 . . . . 0.0 112.773 172.833 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 7.4 m120 -141.88 -135.76 0.1 Allowed 'General case' 0 CA--C 1.601 2.942 0 O-C-N 120.261 -1.524 . . . . 0.0 108.861 -159.059 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . 0.51 3.5 m-20 -6.31 91.02 0.01 OUTLIER 'General case' 0 N--CA 1.52 3.046 1 O-C-N 116.214 -4.053 . . . . 0.0 113.039 -97.5 . . . . . . . . 3 2 . 1 . 010 nuclear orig full ' B' B ' 55' ' ' ALA . . . . . . . . . . . . 0.561 . . -92.37 -131.47 0.12 Allowed 'General case' 0 N--CA 1.412 -2.331 0 CA-C-O 126.659 3.123 . . . . 0.0 109.951 -130.383 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -2.15 -38.95 0.0 OUTLIER 'General case' 0 CA--C 1.596 2.736 1 N-CA-C 123.289 4.552 . . . . 0.0 123.289 92.157 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 57' ' ' ARG . . . . . . . . . . . . . 3.7 tmt_? -75.36 -54.9 6.29 Favored 'General case' 0 CA--C 1.556 1.209 0 CA-C-O 115.299 -2.286 . . . . 0.0 116.391 161.164 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 58' ' ' LEU . . . . . . . . . . . . 0.307 11.6 mt -71.82 -20.77 61.79 Favored 'General case' 0 N--CA 1.507 2.375 0 CA-C-N 125.12 3.6 . . . . 0.0 115.009 172.135 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 59' ' ' ALA . . . . . . . . . . . . . . . -46.39 -56.5 5.79 Favored 'General case' 0 N--CA 1.477 0.877 0 N-CA-C 117.075 2.25 . . . . 0.0 117.075 142.817 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 5.4 t70 -82.03 -3.03 53.67 Favored 'General case' 0 N--CA 1.483 1.211 0 N-CA-C 119.575 3.176 . . . . 0.0 119.575 -179.656 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 61' ' ' GLU . . . . . . . . . . . . 0.262 3.5 mm-40 -95.97 -50.74 4.74 Favored 'General case' 0 C--N 1.31 -1.145 0 CA-C-O 117.856 -1.069 . . . . 0.0 109.747 172.384 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 62' ' ' GLN . . . . . . . . . . . . 0.283 0.6 OUTLIER -61.13 -49.63 76.47 Favored 'General case' 0 CA--C 1.551 1.013 0 CA-C-N 122.355 2.343 . . . . 0.0 111.269 166.587 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 63' ' ' SER . . . . . . . . . . . . 0.354 28.6 t -123.76 34.64 5.03 Favored 'General case' 0 CA--C 1.556 1.185 0 N-CA-C 117.496 2.406 . . . . 0.0 117.496 -175.664 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 64' ' ' GLU . . . . . . . . . . . . 1.968 39.3 mt-10 -41.28 -67.52 0.25 Allowed 'General case' 0 N--CA 1.488 1.473 0 N-CA-C 119.811 3.263 . . . . 0.0 119.811 94.579 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 65' ' ' LEU . . . . . . . . . . . . 0.279 9.4 mp -77.41 -45.6 25.33 Favored 'General case' 0 CA--C 1.548 0.893 0 N-CA-C 117.752 2.501 . . . . 0.0 117.752 -145.315 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 66' ' ' VAL . . . . . . . . . . . . . 8.1 m . . . . . 0 N--CA 1.516 2.871 1 N-CA-C 122.406 4.224 . . . . 0.0 122.406 146.539 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.562 1.435 0 N-CA-C 113.449 0.907 . . . . 0.0 113.449 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 29.7 mmt180 -89.02 75.3 7.99 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 120.953 -1.092 . . . . 0.0 113.364 -178.322 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . 0.252 28.7 t70 -152.58 -80.19 0.1 Allowed 'General case' 0 N--CA 1.488 1.426 0 C-N-CA 124.111 0.965 . . . . 0.0 110.492 170.232 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . 0.3 2.5 p30 -138.05 76.39 39.35 Favored Pre-proline 0 CA--C 1.567 1.614 0 O-C-N 121.176 -0.953 . . . . 0.0 113.361 170.243 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 47.8 Cg_endo -81.9 168.26 15.75 Favored 'Trans proline' 0 CA--C 1.567 2.159 0 C-N-CA 123.557 2.838 . . . . 0.0 115.983 176.492 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 65.0 m80 -108.75 144.93 35.91 Favored 'General case' 0 CA--C 1.567 1.607 0 CA-C-N 113.068 -1.878 . . . . 0.0 112.35 -165.438 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 20.2 p90 -138.46 150.08 46.1 Favored 'General case' 0 CA--C 1.564 1.51 0 O-C-N 120.062 -1.649 . . . . 0.0 111.397 142.63 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 11.7 m120 -71.98 83.48 0.96 Allowed 'General case' 0 N--CA 1.491 1.612 0 O-C-N 120.089 -1.632 . . . . 0.0 111.689 170.083 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 6.1 t80 -64.09 147.19 52.76 Favored 'General case' 0 CA--C 1.55 0.943 0 CA-C-O 125.313 2.482 . . . . 0.0 112.026 167.717 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 2.7 tmm_? -144.27 110.06 5.31 Favored 'General case' 0 C--N 1.304 -1.379 0 CA-C-N 111.166 -2.743 . . . . 0.0 104.974 -152.369 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 1.2 mpp? -116.12 116.2 40.11 Favored Pre-proline 0 CA--C 1.562 1.437 0 CA-C-O 117.64 -1.172 . . . . 0.0 111.764 -170.536 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_exo -41.55 140.35 1.74 Allowed 'Trans proline' 0 CA--C 1.559 1.768 0 C-N-CA 122.958 2.439 . . . . 0.0 115.575 156.411 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 25.0 tpp -57.85 -29.04 64.66 Favored 'General case' 0 N--CA 1.496 1.858 0 N-CA-C 118.173 2.657 . . . . 0.0 118.173 -158.87 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -57.43 -52.21 66.29 Favored 'General case' 0 CA--C 1.566 1.594 0 N-CA-C 117.696 2.48 . . . . 0.0 117.696 160.343 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -58.79 -49.45 82.82 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.249 0 CA-C-N 122.087 2.221 . . . . 0.0 112.507 172.207 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . 0.262 1.1 ttt180 -72.39 -37.54 68.7 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-O 115.405 -2.236 . . . . 0.0 115.191 176.959 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 41.8 mm-40 -62.42 -38.56 90.16 Favored 'General case' 0 CA--C 1.559 1.313 0 CA-C-N 124.485 3.311 . . . . 0.0 113.659 164.899 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . 0.576 26.5 pttt -74.72 -36.56 62.67 Favored 'General case' 0 CA--C 1.565 1.543 0 N-CA-C 117.777 2.51 . . . . 0.0 117.777 174.53 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . 0.253 11.2 tp -74.41 -34.91 63.38 Favored 'General case' 0 CA--C 1.574 1.891 0 N-CA-C 114.868 1.433 . . . . 0.0 114.868 167.978 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 2.2 ttpt -91.09 -31.27 16.32 Favored 'General case' 0 CA--C 1.57 1.715 0 O-C-N 120.124 -1.61 . . . . 0.0 113.631 179.908 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 22.7 m-85 -57.41 -68.58 0.22 Allowed 'General case' 0 N--CA 1.496 1.828 0 CA-C-O 113.649 -3.072 . . . . 0.0 110.416 153.977 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . 0.287 30.7 ttt85 -29.4 -43.38 0.03 OUTLIER 'General case' 0 CA--C 1.598 2.81 1 CA-C-N 126.017 4.008 . . . . 0.0 117.676 166.169 . . . . . . . . 3 2 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . 0.289 . . -60.05 -71.36 0.13 Allowed 'General case' 0 CA--C 1.589 2.476 0 O-C-N 118.484 -2.635 . . . . 0.0 116.93 159.508 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -63.39 -49.46 73.71 Favored 'General case' 0 N--CA 1.502 2.147 0 N-CA-C 118.477 2.769 . . . . 0.0 118.477 177.371 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -40.19 -48.18 2.52 Favored 'General case' 0 CA--C 1.574 1.89 0 N-CA-C 118.409 2.744 . . . . 0.0 118.409 159.916 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . 0.296 0.8 OUTLIER -125.07 -9.26 7.12 Favored 'General case' 0 CA--C 1.58 2.111 0 N-CA-C 116.646 2.091 . . . . 0.0 116.646 -154.306 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 115.59 29.64 2.41 Favored Glycine 0 N--CA 1.497 2.733 0 N-CA-C 119.21 2.444 . . . . 0.0 119.21 171.903 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 1.4 mpp_? -139.32 174.99 9.95 Favored 'General case' 0 CA--C 1.575 1.91 0 CA-C-N 119.201 1.5 . . . . 0.0 108.0 174.376 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 35.0 t -132.86 112.08 11.62 Favored 'General case' 0 N--CA 1.501 2.104 0 O-C-N 118.602 -2.561 . . . . 0.0 106.921 179.88 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 26.5 mtp -46.12 -31.78 2.56 Favored 'General case' 0 N--CA 1.501 2.105 0 N-CA-C 121.552 3.908 . . . . 0.0 121.552 -138.947 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . 0.275 5.6 t-20 -51.12 -50.91 57.92 Favored 'General case' 0 CA--C 1.59 2.486 0 O-C-N 118.506 -2.622 . . . . 0.0 114.11 160.51 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . 0.308 22.8 t -44.44 -68.08 0.23 Allowed 'General case' 0 N--CA 1.503 2.211 0 N-CA-C 117.055 2.243 . . . . 0.0 117.055 143.987 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 4.9 tm-20 -70.28 -54.79 11.19 Favored 'General case' 0 N--CA 1.505 2.293 0 N-CA-C 118.606 2.817 . . . . 0.0 118.606 -168.157 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . 0.589 0.0 OUTLIER -52.2 -34.03 43.55 Favored 'General case' 0 CA--C 1.574 1.87 0 CA-C-O 114.192 -2.813 . . . . 0.0 107.618 168.549 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 21.7 mt -65.7 -46.1 80.27 Favored 'General case' 0 N--CA 1.495 1.787 1 CA-C-N 126.835 4.379 . . . . 0.0 116.257 164.853 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -60.92 -45.1 96.03 Favored 'General case' 0 N--CA 1.488 1.455 0 N-CA-C 114.779 1.4 . . . . 0.0 114.779 178.606 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . 0.27 2.8 tt -60.56 -46.36 95.68 Favored 'Isoleucine or valine' 0 CA--C 1.566 1.573 0 CA-C-O 114.866 -2.492 . . . . 0.0 116.453 156.553 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 3.3 t -71.26 -44.75 72.89 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.215 0 CA-C-N 123.93 3.059 . . . . 0.0 111.676 -169.747 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 23.8 mt-30 -55.7 -45.61 77.83 Favored 'General case' 0 CA--C 1.565 1.551 0 C-N-CA 124.423 1.089 . . . . 0.0 112.776 158.503 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . 0.475 0.9 OUTLIER -49.52 -34.84 18.29 Favored 'General case' 0 N--CA 1.5 2.055 0 N-CA-C 118.648 2.832 . . . . 0.0 118.648 156.74 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -78.36 -70.2 0.51 Allowed 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 123.914 0.886 . . . . 0.0 111.113 -166.509 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 2.6 pp -86.03 17.3 3.61 Favored 'General case' 0 CA--C 1.569 1.69 0 N-CA-C 118.102 2.63 . . . . 0.0 118.102 171.46 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 5.1 t -114.21 -34.58 5.29 Favored 'General case' 0 N--CA 1.495 1.784 0 N-CA-C 117.435 2.383 . . . . 0.0 117.435 155.804 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . 0.283 47.3 tttt -96.21 -28.89 0.26 Allowed Pre-proline 0 N--CA 1.506 2.364 1 N-CA-C 122.667 4.321 . . . . 0.0 122.667 -150.238 . . . . . . . . 3 2 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 92.6 Cg_endo -82.55 119.23 2.97 Favored 'Trans proline' 0 CA--C 1.564 1.98 0 CA-C-N 126.878 3.492 . . . . 0.0 118.317 -168.032 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 75.7 m -74.65 153.94 87.41 Favored Pre-proline 0 CA--C 1.584 2.263 0 CA-C-N 114.867 -1.06 . . . . 0.0 112.722 130.624 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 95.0 Cg_endo -69.49 96.54 0.57 Allowed 'Trans proline' 0 CA--C 1.566 2.11 0 C-N-CA 122.497 2.131 . . . . 0.0 113.584 172.766 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 7.6 p -105.16 152.68 6.99 Favored 'Isoleucine or valine' 0 CA--C 1.567 1.628 0 CA-C-O 121.917 0.865 . . . . 0.0 111.9 -170.342 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . 0.452 12.3 t 66.48 -163.89 0.23 Allowed 'General case' 0 N--CA 1.499 2.012 0 N-CA-C 116.627 2.084 . . . . 0.0 116.627 151.556 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -81.32 -48.69 5.85 Favored Glycine 0 N--CA 1.494 2.53 0 CA-C-N 113.331 -1.759 . . . . 0.0 117.398 -173.295 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . 0.36 0.0 OUTLIER -71.95 30.19 0.05 Allowed 'General case' 0 CA--C 1.59 2.51 0 N-CA-C 118.624 2.824 . . . . 0.0 118.624 171.584 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . 0.628 0.0 OUTLIER 104.66 -102.75 0.0 OUTLIER 'General case' 0 CA--C 1.587 2.372 1 N-CA-C 121.893 4.034 . . . . 0.0 121.893 158.243 . . . . . . . . 4 3 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -109.67 -172.05 1.96 Allowed 'General case' 0 CA--C 1.582 2.192 2 O-C-N 110.624 -7.548 . . . . 0.0 115.984 33.146 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . 1.131 1.3 p30 -114.66 19.41 16.04 Favored 'General case' 0 N--CA 1.499 1.98 1 N-CA-C 121.825 4.009 . . . . 0.0 121.825 140.334 . . . . . . . . 3 2 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . 0.413 . . -94.33 -18.33 21.71 Favored 'General case' 0 CA--C 1.603 2.994 0 N-CA-C 118.111 2.634 . . . . 0.0 118.111 140.253 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.449 ' O ' ' CB ' ' A' ' 59' ' ' ALA . 10.9 tm-20 -51.82 -22.75 3.95 Favored 'General case' 0 CA--C 1.583 2.239 1 O-C-N 115.494 -4.504 . . . . 0.0 114.375 129.806 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . 1.711 0.0 OUTLIER -77.42 -9.83 59.1 Favored 'General case' 0 CA--C 1.588 2.408 1 O-C-N 115.053 -4.779 . . . . 0.0 114.739 160.395 . . . . . . . . 4 3 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . 2.16 1.8 pp -62.19 -24.97 67.52 Favored 'General case' 0 CA--C 1.609 3.232 0 O-C-N 116.871 -3.643 . . . . 0.0 113.039 150.122 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . 0.449 ' CB ' ' O ' ' A' ' 56' ' ' GLU . . . -54.65 -19.97 7.2 Favored 'General case' 0 N--CA 1.521 3.102 1 O-C-N 114.763 -4.961 . . . . 0.0 119.662 139.513 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . 0.539 0.0 OUTLIER -75.79 -1.35 24.65 Favored 'General case' 0 N--CA 1.522 3.133 1 N-CA-C 123.614 4.672 . . . . 0.0 123.614 141.834 . . . . . . . . 4 3 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . 0.466 0.0 OUTLIER -58.38 -25.18 61.76 Favored 'General case' 0 N--CA 1.519 3.019 0 O-C-N 119.469 -2.019 . . . . 0.0 116.018 129.989 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . 0.468 0.0 OUTLIER -69.15 -47.96 63.6 Favored 'General case' 0 N--CA 1.498 1.947 0 CA-C-O 116.42 -1.752 . . . . 0.0 112.866 161.931 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . 0.314 50.2 m -28.31 -51.56 0.08 Allowed 'General case' 0 N--CA 1.528 3.437 0 CA-C-N 122.543 2.429 . . . . 0.0 116.015 155.158 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . 0.321 2.4 tm-20 -83.66 -31.96 25.88 Favored 'General case' 0 CA--C 1.579 2.088 0 CA-C-N 112.94 -1.936 . . . . 0.0 115.397 -166.821 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 4.6 pp -58.34 -31.38 67.52 Favored 'General case' 0 N--CA 1.51 2.53 0 N-CA-C 117.57 2.433 . . . . 0.0 117.57 148.731 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . 0.413 1.3 m . . . . . 0 CA--C 1.592 2.593 0 CA-C-N 120.725 1.602 . . . . 0.0 111.175 177.976 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.562 1.437 0 N-CA-C 113.374 0.879 . . . . 0.0 113.374 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 2' ' ' ARG . . . . . . . . . . . . . 84.2 mtt85 -86.88 82.49 7.79 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.232 -0.918 . . . . 0.0 111.64 177.858 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 26.0 m-20 -129.73 81.77 2.03 Favored 'General case' 0 N--CA 1.489 1.51 0 N-CA-C 107.586 -1.265 . . . . 0.0 107.586 -179.587 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 4' ' ' ASP . . . . . . . . . . . . . 3.4 p30 -154.91 92.93 2.81 Favored Pre-proline 0 CA--C 1.566 1.584 0 CA-C-O 117.926 -1.035 . . . . 0.0 111.016 -179.464 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -94.92 140.28 1.12 Allowed 'Trans proline' 0 C--N 1.364 1.369 0 CA-C-N 123.005 2.109 . . . . 0.0 113.991 -163.489 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 6' ' ' HIS . . . . . . . . . . . . . 75.0 m80 -82.04 115.24 21.09 Favored 'General case' 0 CA--C 1.567 1.601 0 CA-C-N 114.137 -1.392 . . . . 0.0 111.109 170.833 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 7' ' ' PHE . . . . . . . . . . . . . 1.1 p90 -118.51 150.23 39.97 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 120.856 -1.153 . . . . 0.0 109.855 159.959 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 8' ' ' ASN . . . . . . . . . . . . . 18.2 m120 -68.94 91.02 0.45 Allowed 'General case' 0 N--CA 1.489 1.492 0 O-C-N 120.472 -1.392 . . . . 0.0 112.512 171.077 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 9' ' ' PHE . . . . . . . . . . . . . 4.4 t80 -77.8 146.42 35.8 Favored 'General case' 0 CA--C 1.564 1.486 0 CA-C-O 125.836 2.732 . . . . 0.0 109.592 153.725 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 177.78 102.75 0.02 OUTLIER 'General case' 0 N--CA 1.487 1.381 0 CA-C-N 112.59 -2.095 . . . . 0.0 106.699 -130.363 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 11' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -132.73 136.53 27.96 Favored Pre-proline 0 N--CA 1.491 1.623 0 CA-C-O 117.549 -1.215 . . . . 0.0 113.677 -154.486 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 12' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -59.19 154.25 47.34 Favored 'Trans proline' 0 CA--C 1.565 2.041 0 CA-C-N 122.692 1.997 . . . . 0.0 114.087 168.517 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 13' ' ' MET . . . . . . . . . . . . . 4.7 tpp -61.77 -37.45 84.35 Favored 'General case' 0 N--CA 1.487 1.422 0 N-CA-C 118.365 2.728 . . . . 0.0 118.365 -146.66 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 -61.81 -40.92 96.93 Favored 'General case' 0 CA--C 1.566 1.566 0 N-CA-C 116.428 2.01 . . . . 0.0 116.428 167.139 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -63.09 -49.43 83.4 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.08 0 CA-C-N 123.293 2.769 . . . . 0.0 111.921 171.788 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 16' ' ' ARG . . . . . . . . . . . . 0.296 6.0 ttt180 -70.45 -37.05 74.28 Favored 'General case' 0 N--CA 1.477 0.908 0 CA-C-N 121.729 2.059 . . . . 0.0 115.997 175.341 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 17' ' ' GLU . . . . . . . . . . . . . 37.6 mt-10 -63.03 -39.44 94.74 Favored 'General case' 0 N--CA 1.491 1.609 0 CA-C-N 123.548 2.886 . . . . 0.0 114.234 163.473 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . 0.257 53.6 mtmt -65.0 -49.09 71.61 Favored 'General case' 0 CA--C 1.563 1.452 0 CA-C-N 121.921 2.146 . . . . 0.0 115.344 170.352 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 19' ' ' LEU . . . . . . . . . . . . 0.263 11.9 tp -65.75 -39.69 91.33 Favored 'General case' 0 CA--C 1.568 1.668 0 CA-C-N 120.759 1.618 . . . . 0.0 114.336 173.791 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 20' ' ' LYS . . . . . . . . . . . . . 12.1 ttpt -84.84 -31.31 23.88 Favored 'General case' 0 CA--C 1.557 1.238 0 C-N-CA 125.244 1.418 . . . . 0.0 114.36 179.621 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 20.0 m-85 -60.91 -74.1 0.08 Allowed 'General case' 0 N--CA 1.49 1.531 0 CA-C-O 112.282 -3.723 . . . . 0.0 110.583 154.711 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . 0.292 8.7 ttt180 -16.84 -57.96 0.01 OUTLIER 'General case' 0 CA--C 1.586 2.347 1 CA-C-N 126.487 4.221 . . . . 0.0 116.699 168.866 . . . . . . . . 3 2 . 1 . 011 nuclear orig full ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -53.41 -72.31 0.06 Allowed 'General case' 0 CA--C 1.583 2.242 1 N-CA-C 122.153 4.131 . . . . 0.0 122.153 156.896 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 49.3 mt-10 -66.92 -38.71 86.72 Favored 'General case' 0 N--CA 1.505 2.305 0 N-CA-C 118.138 2.644 . . . . 0.0 118.138 177.144 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 25' ' ' ALA . . . . . . . . . . . . . . . -38.5 -48.47 1.4 Allowed 'General case' 0 CA--C 1.585 2.325 0 N-CA-C 116.493 2.034 . . . . 0.0 116.493 155.883 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 26' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -101.27 -48.01 4.52 Favored 'General case' 0 CA--C 1.578 2.031 0 N-CA-C 116.626 2.084 . . . . 0.0 116.626 -173.748 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 27' ' ' GLY . . . . . . . . . . . . . . . 117.95 39.41 0.76 Allowed Glycine 0 CA--C 1.558 2.754 0 N-CA-C 117.774 1.87 . . . . 0.0 117.774 -157.75 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 28' ' ' ARG . . . . . . . . . . . . . 3.1 mtt85 -138.14 97.97 3.52 Favored 'General case' 0 N--CA 1.492 1.663 0 CA-C-N 119.936 1.868 . . . . 0.0 106.078 174.852 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 29' ' ' SER . . . . . . . . . . . . . 32.2 t -75.82 127.88 33.96 Favored 'General case' 0 N--CA 1.504 2.26 0 O-C-N 117.758 -3.089 . . . . 0.0 107.92 -162.301 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 30' ' ' MET . . . . . . . . . . . . . 25.4 mtp -44.93 -42.7 8.35 Favored 'General case' 0 N--CA 1.503 2.198 0 N-CA-C 118.663 2.838 . . . . 0.0 118.663 -144.973 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 31' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -46.26 -40.7 11.93 Favored 'General case' 0 CA--C 1.595 2.688 0 CA-C-N 125.245 3.657 . . . . 0.0 115.788 165.899 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 32' ' ' SER . . . . . . . . . . . . 0.28 40.4 t -56.4 -66.36 0.45 Allowed 'General case' 0 N--CA 1.498 1.963 0 N-CA-C 119.361 3.097 . . . . 0.0 119.361 148.133 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 8.1 tp10 -66.22 -56.27 12.12 Favored 'General case' 0 N--CA 1.515 2.807 0 CA-C-N 124.007 3.094 . . . . 0.0 114.739 -177.857 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -37.64 -52.61 1.23 Allowed 'General case' 0 CA--C 1.546 0.81 0 CA-C-O 115.614 -2.136 . . . . 0.0 109.379 165.935 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 35' ' ' LEU . . . . . . . . . . . . . 9.5 mt -62.37 -53.13 59.42 Favored 'General case' 0 N--CA 1.485 1.321 0 CA-C-N 123.984 3.084 . . . . 0.0 115.306 175.148 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 36' ' ' GLN . . . . . . . . . . . . 0.271 0.5 OUTLIER -63.89 -33.12 74.99 Favored 'General case' 0 CA--C 1.58 2.109 0 N-CA-C 115.963 1.838 . . . . 0.0 115.963 179.644 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 37' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -71.71 -31.05 40.41 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.703 0 CA-C-N 121.058 1.754 . . . . 0.0 115.183 160.905 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 38' ' ' VAL . . . . . . . . . . . . . 2.4 t -80.15 -49.02 19.58 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.262 0 CA-C-N 122.682 2.492 . . . . 0.0 112.328 -179.033 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 32.4 mt-30 -47.01 -41.41 16.39 Favored 'General case' 0 CA--C 1.563 1.448 0 CA-C-O 116.72 -1.61 . . . . 0.0 113.856 149.447 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 40' ' ' ASP . . . . . . . . . . . . 0.447 8.1 t70 -51.32 -55.07 20.33 Favored 'General case' 0 N--CA 1.497 1.899 0 CA-C-N 121.766 2.075 . . . . 0.0 115.936 155.212 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -73.63 -33.31 64.49 Favored 'General case' 0 CA--C 1.552 1.023 0 N-CA-C 116.431 2.012 . . . . 0.0 116.431 -153.467 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -104.82 -10.01 17.66 Favored 'General case' 0 N--CA 1.488 1.444 0 N-CA-C 118.691 2.849 . . . . 0.0 118.691 156.273 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 43' ' ' SER . . . . . . . . . . . . . 60.0 p -140.32 6.34 2.12 Favored 'General case' 0 N--CA 1.496 1.873 0 N-CA-C 120.675 3.583 . . . . 0.0 120.675 -173.979 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 44' ' ' LYS . . . . . . . . . . . . 0.4 1.6 mtmt -65.36 139.87 97.54 Favored Pre-proline 0 N--CA 1.53 3.542 1 CA-C-N 126.103 4.047 . . . . 0.0 114.807 -174.377 . . . . . . . . 3 2 . 1 . 011 nuclear orig full ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 42.8 Cg_exo -48.31 131.09 22.18 Favored 'Trans proline' 0 C--N 1.379 2.14 0 N-CA-C 120.432 3.205 . . . . 0.0 120.432 -155.46 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 46' ' ' SER . . . . . . . . . . . . . 91.0 p -139.97 100.09 7.31 Favored Pre-proline 0 CA--C 1.57 1.745 0 CA-C-O 117.735 -1.126 . . . . 0.0 113.379 -159.801 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 81.7 Cg_endo -81.5 143.83 59.88 Favored 'Cis proline' 0 CA--C 1.571 2.328 0 CA-C-N 122.787 2.031 . . . . 0.0 116.101 -3.121 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 48' ' ' VAL . . . . . . . . . . . . . 96.1 t -75.51 -38.03 38.45 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.423 0 O-C-N 120.46 -1.4 . . . . 0.0 112.053 141.607 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 49' ' ' THR . . . . . . . . . . . . 0.284 4.2 t -168.26 -75.86 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.714 0 CA-C-O 123.585 1.659 . . . . 0.0 108.681 -155.838 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 50' ' ' GLY . . . . . . . . . . . . . . . 166.29 87.13 0.06 OUTLIER Glycine 0 CA--C 1.549 2.214 0 CA-C-N 112.094 -2.321 . . . . 0.0 115.066 156.195 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 51' ' ' TYR . . . . . . . . . . . . 0.313 1.4 m-30 62.65 66.17 0.78 Allowed 'General case' 0 CA--C 1.577 2.0 2 O-C-N 113.646 -5.62 . . . . 0.0 117.268 -16.186 . . . . . . . . 3 2 . 1 . 011 nuclear orig full ' B' B ' 52' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -154.64 112.4 3.45 Favored 'General case' 0 N--CA 1.5 2.05 0 C-N-CA 124.307 1.043 . . . . 0.0 108.8 174.238 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . 0.762 0.2 OUTLIER -70.49 119.23 14.35 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 118.669 -2.52 . . . . 0.0 111.595 -171.886 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . 2.402 0.0 OUTLIER 59.94 5.11 0.69 Allowed 'General case' 0 N--CA 1.521 3.091 1 O-C-N 115.315 -4.616 . . . . 0.0 115.807 12.37 . . . . . . . . 4 3 . 1 . 011 nuclear orig full ' B' B ' 55' ' ' ALA . . . . . . . . . . . . 1.849 . . -124.57 -43.25 2.04 Favored 'General case' 0 CA--C 1.57 1.713 0 O-C-N 118.216 -2.803 . . . . 0.0 112.725 -179.907 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 56' ' ' GLU . . . . . . . . . . . . 0.279 6.7 tp10 -2.96 -36.8 0.0 OUTLIER 'General case' 0 CA--C 1.618 3.562 1 N-CA-C 124.172 4.879 . . . . 0.0 124.172 94.517 . . . . . . . . 3 2 . 1 . 011 nuclear orig full ' B' B ' 57' ' ' ARG . . . . . . . . . . . . 0.289 45.6 ttt-85 -65.05 -48.72 72.8 Favored 'General case' 0 N--CA 1.501 2.123 1 O-C-N 116.174 -4.078 . . . . 0.0 111.562 152.274 . . . . . . . . 3 2 . 1 . 011 nuclear orig full ' B' B ' 58' ' ' LEU . . . . . . . . . . . . 0.264 5.2 mt -58.36 -24.83 61.03 Favored 'General case' 0 N--CA 1.507 2.419 0 N-CA-C 114.146 1.165 . . . . 0.0 114.146 170.828 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 59' ' ' ALA . . . . . . . . . . . . . . . -44.22 -88.31 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.564 0 CA-C-O 116.021 -1.943 . . . . 0.0 114.721 137.1 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -69.32 -6.41 29.48 Favored 'General case' 0 N--CA 1.497 1.876 0 N-CA-C 119.72 3.23 . . . . 0.0 119.72 -161.499 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 13.2 mm-40 -83.2 -51.54 7.39 Favored 'General case' 0 N--CA 1.483 1.199 0 CA-C-O 117.245 -1.36 . . . . 0.0 114.201 157.663 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -77.43 -69.6 0.52 Allowed 'General case' 0 C--N 1.358 0.953 0 CA-C-N 123.107 2.685 . . . . 0.0 108.674 175.358 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 63' ' ' SER . . . . . . . . . . . . 0.322 4.0 t -67.01 43.39 0.03 OUTLIER 'General case' 0 CA--C 1.577 1.994 0 N-CA-C 119.158 3.021 . . . . 0.0 119.158 159.293 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 64' ' ' GLU . . . . . . . . . . . . . 5.8 tt0 -142.42 16.49 2.03 Favored 'General case' 0 CA--C 1.582 2.21 0 O-C-N 119.258 -2.151 . . . . 0.0 116.754 121.479 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 45.6 mt -106.33 -35.86 7.02 Favored 'General case' 0 N--CA 1.512 2.637 0 CA-C-N 122.048 2.203 . . . . 0.0 114.767 165.844 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 66' ' ' VAL . . . . . . . . . . . . . 7.6 p . . . . . 0 N--CA 1.499 2.014 1 N-CA-C 124.06 4.837 . . . . 0.0 124.06 143.68 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.563 1.457 0 N-CA-C 113.477 0.917 . . . . 0.0 113.477 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 -81.51 74.09 8.52 Favored 'General case' 0 N--CA 1.498 1.95 0 O-C-N 121.021 -1.049 . . . . 0.0 112.763 -178.876 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -123.44 76.31 1.39 Allowed 'General case' 0 N--CA 1.491 1.608 0 N-CA-C 107.559 -1.274 . . . . 0.0 107.559 -179.812 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 12.1 p-10 -154.66 81.56 4.34 Favored Pre-proline 0 CA--C 1.57 1.714 0 O-C-N 121.499 -0.751 . . . . 0.0 110.485 177.48 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_exo -98.21 145.95 0.64 Allowed 'Trans proline' 0 C--N 1.364 1.39 0 CA-C-N 123.059 2.128 . . . . 0.0 114.537 -153.793 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 81.0 m80 -75.46 132.85 41.1 Favored 'General case' 0 CA--C 1.563 1.475 0 CA-C-N 113.999 -1.455 . . . . 0.0 112.603 174.569 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 5.1 p90 -133.28 154.21 50.89 Favored 'General case' 0 CA--C 1.563 1.444 0 O-C-N 120.815 -1.178 . . . . 0.0 110.412 146.843 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 4.2 p-10 -59.77 86.44 0.01 OUTLIER 'General case' 0 CA--C 1.566 1.568 0 N-CA-C 115.744 1.757 . . . . 0.0 115.744 168.193 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . 0.26 2.6 t80 -82.26 141.51 32.88 Favored 'General case' 0 CA--C 1.564 1.511 0 CA-C-O 126.375 2.988 . . . . 0.0 110.273 162.019 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 23.2 ttt85 -166.56 121.43 1.13 Allowed 'General case' 0 C--N 1.309 -1.174 0 CA-C-N 111.466 -2.607 . . . . 0.0 107.911 -146.482 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 2.3 mpt? -133.63 119.49 15.09 Favored Pre-proline 0 CA--C 1.56 1.336 0 CA-C-O 117.73 -1.129 . . . . 0.0 111.314 -148.498 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_exo -46.59 146.27 5.47 Favored 'Trans proline' 0 CA--C 1.561 1.841 0 C-N-CA 122.68 2.253 . . . . 0.0 114.931 161.61 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.4 tpp -64.83 -27.99 69.25 Favored 'General case' 0 CA--C 1.568 1.672 0 N-CA-C 118.386 2.736 . . . . 0.0 118.386 -151.188 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . 0.25 8.2 pt-20 -64.63 -43.71 92.83 Favored 'General case' 0 CA--C 1.566 1.593 0 N-CA-C 116.654 2.094 . . . . 0.0 116.654 160.609 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -59.7 -48.2 88.38 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.275 0 CA-C-N 123.269 2.759 . . . . 0.0 112.603 173.231 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 2.0 ttt180 -71.36 -40.28 70.76 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-O 116.265 -1.826 . . . . 0.0 115.611 174.486 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -60.85 -38.71 86.45 Favored 'General case' 0 CA--C 1.567 1.62 0 CA-C-N 123.349 2.795 . . . . 0.0 114.007 166.036 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 52.2 mtmt -66.9 -51.1 59.46 Favored 'General case' 0 CA--C 1.562 1.42 0 CA-C-N 121.362 1.892 . . . . 0.0 115.363 170.791 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . 0.281 14.1 tp -65.44 -39.76 92.46 Favored 'General case' 0 CA--C 1.566 1.564 0 N-CA-C 115.542 1.682 . . . . 0.0 115.542 173.863 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 18.9 ttpt -88.2 -25.97 22.63 Favored 'General case' 0 CA--C 1.567 1.629 0 C-N-CA 124.923 1.289 . . . . 0.0 113.922 -179.754 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 19.5 m-30 -67.47 -66.72 0.53 Allowed 'General case' 0 N--CA 1.493 1.693 0 CA-C-O 113.929 -2.938 . . . . 0.0 110.812 158.545 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . 0.336 1.6 tmt_? -27.04 -45.99 0.03 OUTLIER 'General case' 0 CA--C 1.602 2.944 0 CA-C-N 125.699 3.863 . . . . 0.0 114.614 164.528 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -59.73 -74.87 0.06 Allowed 'General case' 0 CA--C 1.585 2.29 0 N-CA-C 117.298 2.333 . . . . 0.0 117.298 159.314 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -68.97 -39.52 79.41 Favored 'General case' 0 N--CA 1.502 2.141 0 N-CA-C 118.72 2.859 . . . . 0.0 118.72 -179.023 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -41.83 -51.38 4.27 Favored 'General case' 0 CA--C 1.587 2.397 0 N-CA-C 115.929 1.826 . . . . 0.0 115.929 157.084 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 84.8 m-20 -83.13 -48.21 10.8 Favored 'General case' 0 N--CA 1.5 2.041 0 N-CA-C 116.126 1.899 . . . . 0.0 116.126 177.22 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 119.45 26.87 2.3 Favored Glycine 0 CA--C 1.56 2.886 0 N-CA-C 118.651 2.22 . . . . 0.0 118.651 -157.775 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 24.5 mtm-85 -115.7 158.89 22.11 Favored 'General case' 0 N--CA 1.491 1.594 0 CA-C-N 119.696 1.748 . . . . 0.0 107.161 167.066 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 43.1 t -114.6 113.73 24.77 Favored 'General case' 0 N--CA 1.496 1.845 0 N-CA-C 104.35 -2.463 . . . . 0.0 104.35 -178.082 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 6.2 mtp -38.03 -40.32 0.47 Allowed 'General case' 0 N--CA 1.501 2.084 0 N-CA-C 121.01 3.708 . . . . 0.0 121.01 -152.111 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . 0.253 0.1 OUTLIER -47.87 -46.79 31.71 Favored 'General case' 0 CA--C 1.592 2.56 0 O-C-N 118.575 -2.578 . . . . 0.0 115.446 163.93 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . 0.354 38.4 t -47.4 -76.14 0.02 OUTLIER 'General case' 0 N--CA 1.5 2.064 0 N-CA-C 118.151 2.649 . . . . 0.0 118.151 142.444 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -62.87 -56.76 14.42 Favored 'General case' 0 N--CA 1.507 2.39 0 CA-C-N 123.185 2.72 . . . . 0.0 117.261 -170.057 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . 0.458 0.4 OUTLIER -47.04 -42.01 17.74 Favored 'General case' 0 CA--C 1.563 1.445 0 CA-C-O 113.274 -3.251 . . . . 0.0 107.313 168.863 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 12.8 mt -61.09 -48.09 83.32 Favored 'General case' 0 N--CA 1.499 1.996 1 CA-C-N 127.11 4.504 . . . . 0.0 116.529 166.201 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.28 -43.32 99.07 Favored 'General case' 0 N--CA 1.487 1.41 0 N-CA-C 115.544 1.683 . . . . 0.0 115.544 -179.145 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 5.4 tt -67.57 -35.44 73.09 Favored 'Isoleucine or valine' 0 C--O 1.199 -1.597 0 CA-C-O 114.29 -2.767 . . . . 0.0 115.781 160.508 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 2.1 t -75.04 -47.67 35.51 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.143 0 CA-C-N 124.398 3.272 . . . . 0.0 112.619 -174.527 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 32.9 mt-30 -50.52 -46.71 57.41 Favored 'General case' 0 N--CA 1.486 1.341 0 N-CA-C 113.116 0.784 . . . . 0.0 113.116 156.026 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . 0.807 0.0 OUTLIER -55.83 -34.24 65.2 Favored 'General case' 0 CA--C 1.576 1.972 0 N-CA-C 119.555 3.169 . . . . 0.0 119.555 159.971 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -77.46 -49.62 14.4 Favored 'General case' 0 N--CA 1.481 1.105 0 N-CA-C 115.142 1.534 . . . . 0.0 115.142 -166.307 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 2.5 pp -90.51 1.07 57.04 Favored 'General case' 0 CA--C 1.57 1.734 0 N-CA-C 117.746 2.499 . . . . 0.0 117.746 164.437 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 60.0 m -137.58 45.36 2.18 Favored 'General case' 0 N--CA 1.498 1.97 0 CA-C-N 122.443 2.383 . . . . 0.0 115.806 166.855 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . 0.286 6.9 tmtt? -64.73 -66.49 1.42 Allowed Pre-proline 0 N--CA 1.504 2.272 0 N-CA-C 119.076 2.991 . . . . 0.0 119.076 173.554 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -85.65 98.84 0.62 Allowed 'Trans proline' 0 CA--C 1.559 1.755 0 CA-C-N 124.025 2.473 . . . . 0.0 117.96 -139.392 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 74.4 m -109.68 -57.08 0.05 OUTLIER Pre-proline 0 CA--C 1.571 1.773 0 CA-C-O 115.862 -2.018 . . . . 0.0 113.121 128.935 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -86.6 57.88 3.82 Favored 'Trans proline' 0 C--N 1.375 1.958 0 CA-C-N 125.789 3.103 . . . . 0.0 117.01 -170.517 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 65.5 t -79.95 -59.5 2.89 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.516 0 O-C-N 121.764 -0.585 . . . . 0.0 112.535 179.281 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . 0.331 11.5 t 37.28 54.66 1.33 Allowed 'General case' 0 N--CA 1.509 2.481 0 N-CA-C 120.982 3.697 . . . . 0.0 120.982 158.566 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 132.07 -44.72 1.18 Allowed Glycine 0 N--CA 1.496 2.675 0 N-CA-C 116.194 1.238 . . . . 0.0 116.194 -165.315 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 45.7 m-85 -69.33 101.42 1.52 Allowed 'General case' 0 CA--C 1.566 1.586 0 CA-C-N 118.591 1.195 . . . . 0.0 113.252 178.033 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 99.9 mtt180 -68.74 35.2 0.03 OUTLIER 'General case' 0 CA--C 1.592 2.593 0 N-CA-C 117.125 2.269 . . . . 0.0 117.125 165.642 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 3.2 m-80 -157.97 166.88 31.46 Favored 'General case' 0 CA--C 1.578 2.043 0 C-N-CA 126.842 2.057 . . . . 0.0 110.747 167.067 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -78.05 92.85 4.41 Favored 'General case' 0 CA--C 1.555 1.163 2 O-C-N 112.534 -6.354 . . . . 0.0 109.823 3.658 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -94.17 -95.1 0.16 Allowed 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 111.97 -2.377 . . . . 0.0 108.678 -158.943 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 62.9 mm-40 -2.33 -61.3 0.0 OUTLIER 'General case' 0 CA--C 1.564 1.488 1 N-CA-C 124.388 4.958 . . . . 0.0 124.388 107.246 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . 0.364 2.0 mpt_? -71.35 -37.07 71.7 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 118.146 -2.846 . . . . 0.0 114.995 178.306 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . 0.645 58.0 mt -93.55 2.71 56.31 Favored 'General case' 0 CA--C 1.599 2.859 0 O-C-N 119.491 -2.006 . . . . 0.0 114.138 165.429 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -63.17 -30.53 71.66 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 117.358 -3.339 . . . . 0.0 116.856 138.607 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -66.39 -29.62 69.82 Favored 'General case' 0 N--CA 1.487 1.383 0 O-C-N 120.135 -1.603 . . . . 0.0 115.2 155.811 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -50.97 -48.54 61.14 Favored 'General case' 0 N--CA 1.503 2.187 0 CA-C-O 117.491 -1.242 . . . . 0.0 112.19 157.708 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -52.51 -54.33 34.07 Favored 'General case' 0 CA--C 1.558 1.288 0 CA-C-O 114.616 -2.611 . . . . 0.0 112.125 165.164 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . 0.314 4.9 m -40.91 -30.31 0.13 Allowed 'General case' 0 N--CA 1.515 2.801 0 N-CA-C 120.815 3.635 . . . . 0.0 120.815 161.981 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . 0.337 0.7 OUTLIER -91.6 -4.21 55.54 Favored 'General case' 0 CA--C 1.597 2.784 0 N-CA-C 116.049 1.87 . . . . 0.0 116.049 170.795 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -142.14 44.97 1.67 Allowed 'General case' 0 CA--C 1.599 2.862 0 C-N-CA 127.705 2.402 . . . . 0.0 112.886 173.911 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . 0.259 2.7 p . . . . . 0 N--CA 1.513 2.722 0 C-N-CA 126.538 1.935 . . . . 0.0 112.919 -168.252 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.565 1.556 0 N-CA-C 115.502 1.667 . . . . 0.0 115.502 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 2' ' ' ARG . . . . . . . . . . . . 0.294 53.6 ptt85 37.15 46.27 0.55 Allowed 'General case' 0 N--CA 1.505 2.307 0 N-CA-C 121.62 3.933 . . . . 0.0 121.62 174.349 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -138.19 75.45 1.52 Allowed 'General case' 0 CA--C 1.564 1.487 0 CA-C-O 122.328 1.061 . . . . 0.0 111.19 -176.153 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 4' ' ' ASP . . . . . . . . . . . . . 1.4 p30 -130.64 73.01 81.6 Favored Pre-proline 0 CA--C 1.565 1.53 0 N-CA-C 113.089 0.774 . . . . 0.0 113.089 153.437 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 62.7 Cg_endo -62.11 173.69 3.03 Favored 'Trans proline' 0 CA--C 1.566 2.107 0 C-N-CA 122.632 2.221 . . . . 0.0 116.127 153.485 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 6' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -153.68 159.95 42.2 Favored 'General case' 0 CA--C 1.552 1.028 0 CA-C-N 113.797 -1.547 . . . . 0.0 114.88 -149.802 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 7' ' ' PHE . . . . . . . . . . . . . 36.9 p90 -142.29 156.58 45.28 Favored 'General case' 0 CA--C 1.56 1.328 0 CA-C-O 122.499 1.142 . . . . 0.0 109.145 161.01 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 8' ' ' ASN . . . . . . . . . . . . . 91.6 m-20 -76.0 87.27 2.93 Favored 'General case' 0 CA--C 1.566 1.581 0 O-C-N 119.922 -1.736 . . . . 0.0 110.716 172.128 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 9' ' ' PHE . . . . . . . . . . . . . 4.8 t80 -62.7 142.3 58.18 Favored 'General case' 0 CA--C 1.56 1.35 0 CA-C-O 125.323 2.487 . . . . 0.0 111.245 171.001 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -148.05 96.78 2.69 Favored 'General case' 0 N--CA 1.486 1.358 0 CA-C-N 111.657 -2.52 . . . . 0.0 107.986 -147.015 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 11' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -114.23 118.26 42.26 Favored Pre-proline 0 CA--C 1.567 1.607 0 CA-C-O 117.135 -1.412 . . . . 0.0 112.012 -156.053 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 12' ' ' PRO . . . . . . . . . . . . . 80.3 Cg_exo -42.57 140.57 2.67 Favored 'Trans proline' 0 C--N 1.373 1.848 0 C-N-CA 123.389 2.726 . . . . 0.0 116.252 164.544 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 13' ' ' MET . . . . . . . . . . . . . 25.9 tpp -58.71 -26.53 64.0 Favored 'General case' 0 N--CA 1.498 1.931 0 N-CA-C 119.003 2.964 . . . . 0.0 119.003 -157.818 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 14' ' ' GLU . . . . . . . . . . . . 0.297 7.0 pt-20 -61.28 -50.96 70.92 Favored 'General case' 0 CA--C 1.566 1.588 0 N-CA-C 115.905 1.817 . . . . 0.0 115.905 160.161 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -58.8 -52.88 54.87 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.794 0 CA-C-N 122.092 2.224 . . . . 0.0 112.109 174.013 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 16' ' ' ARG . . . . . . . . . . . . 0.261 1.8 ttt180 -69.01 -33.21 73.27 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-N 122.255 2.298 . . . . 0.0 115.857 177.889 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 17' ' ' GLU . . . . . . . . . . . . . 5.4 pt-20 -65.3 -44.73 86.98 Favored 'General case' 0 N--CA 1.487 1.385 0 CA-C-N 123.326 2.784 . . . . 0.0 113.948 164.988 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . 0.296 52.5 mtmt -53.12 -55.86 20.8 Favored 'General case' 0 N--CA 1.487 1.412 0 N-CA-C 115.765 1.765 . . . . 0.0 115.765 166.006 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 19' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -71.87 -32.91 67.94 Favored 'General case' 0 CA--C 1.566 1.558 0 N-CA-C 116.321 1.971 . . . . 0.0 116.321 -179.984 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 20' ' ' LYS . . . . . . . . . . . . . 7.6 ttpt -87.29 -21.62 25.65 Favored 'General case' 0 CA--C 1.57 1.72 0 C-N-CA 124.78 1.232 . . . . 0.0 113.78 173.413 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 10.5 m-85 -66.25 -66.7 0.52 Allowed 'General case' 0 N--CA 1.49 1.53 0 CA-C-N 122.132 2.242 . . . . 0.0 110.635 155.195 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . 0.274 1.8 tpt180 -21.48 -53.27 0.02 OUTLIER 'General case' 0 CA--C 1.596 2.742 0 CA-C-N 124.459 3.299 . . . . 0.0 115.259 160.052 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 23' ' ' ALA . . . . . . . . . . . . 0.318 . . -54.18 -77.0 0.03 OUTLIER 'General case' 0 CA--C 1.577 2.0 0 N-CA-C 120.546 3.536 . . . . 0.0 120.546 154.066 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 50.6 mm-40 -74.19 -34.38 63.73 Favored 'General case' 0 CA--C 1.576 1.968 0 N-CA-C 118.766 2.876 . . . . 0.0 118.766 -175.836 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 25' ' ' ALA . . . . . . . . . . . . . . . -46.2 -52.41 12.45 Favored 'General case' 0 CA--C 1.579 2.083 0 N-CA-C 116.015 1.857 . . . . 0.0 116.015 154.562 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 26' ' ' ASN . . . . . . . . . . . . . 72.0 m-20 -82.5 -56.8 3.66 Favored 'General case' 0 CA--C 1.575 1.935 0 N-CA-C 114.536 1.31 . . . . 0.0 114.536 179.236 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 27' ' ' GLY . . . . . . . . . . . . . . . 128.17 28.28 0.86 Allowed Glycine 0 CA--C 1.561 2.952 0 N-CA-C 119.037 2.375 . . . . 0.0 119.037 -166.703 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 28' ' ' ARG . . . . . . . . . . . . 0.254 8.3 mtm-85 -118.13 166.13 12.94 Favored 'General case' 0 N--CA 1.497 1.92 0 N-CA-C 105.682 -1.97 . . . . 0.0 105.682 159.929 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 29' ' ' SER . . . . . . . . . . . . . 87.4 p -115.85 113.24 23.09 Favored 'General case' 0 N--CA 1.498 1.935 0 O-C-N 118.836 -2.415 . . . . 0.0 105.244 -173.098 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 30' ' ' MET . . . . . . . . . . . . . 13.3 mtp -36.76 -39.5 0.22 Allowed 'General case' 0 N--CA 1.502 2.174 0 N-CA-C 121.397 3.851 . . . . 0.0 121.397 -147.87 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 31' ' ' ASN . . . . . . . . . . . . 0.3 0.5 OUTLIER -48.56 -50.47 32.06 Favored 'General case' 0 CA--C 1.587 2.368 0 O-C-N 118.857 -2.402 . . . . 0.0 114.662 162.945 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 32' ' ' SER . . . . . . . . . . . . 0.361 35.4 t -47.6 -69.95 0.11 Allowed 'General case' 0 N--CA 1.497 1.923 0 N-CA-C 118.392 2.738 . . . . 0.0 118.392 144.449 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 6.6 tm-20 -76.15 -50.06 15.61 Favored 'General case' 0 N--CA 1.51 2.569 0 CA-C-N 123.978 3.081 . . . . 0.0 119.022 -169.496 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . 0.47 0.3 OUTLIER -47.06 -39.12 12.34 Favored 'General case' 0 CA--C 1.579 2.09 0 CA-C-O 113.679 -3.057 . . . . 0.0 107.226 161.82 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 35' ' ' LEU . . . . . . . . . . . . . 16.1 mt -65.19 -53.15 49.19 Favored 'General case' 0 N--CA 1.499 1.975 1 CA-C-N 127.692 4.769 . . . . 0.0 114.795 166.341 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 36' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -60.96 -33.79 73.76 Favored 'General case' 0 N--CA 1.493 1.688 0 N-CA-C 115.911 1.819 . . . . 0.0 115.911 -178.034 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 37' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -72.35 -42.2 65.25 Favored 'Isoleucine or valine' 0 C--O 1.2 -1.516 0 CA-C-O 115.115 -2.374 . . . . 0.0 115.383 159.409 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 38' ' ' VAL . . . . . . . . . . . . . 3.0 t -71.79 -48.71 49.9 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.408 0 CA-C-N 124.532 3.333 . . . . 0.0 113.111 -177.18 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 24.3 mt-30 -47.72 -51.1 23.27 Favored 'General case' 0 N--CA 1.476 0.856 0 CA-C-O 115.518 -2.182 . . . . 0.0 111.336 155.216 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 40' ' ' ASP . . . . . . . . . . . . 0.69 0.0 OUTLIER -44.1 -51.99 7.55 Favored 'General case' 0 N--CA 1.493 1.71 0 N-CA-C 117.274 2.324 . . . . 0.0 117.274 161.873 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 41' ' ' ALA . . . . . . . . . . . . 0.305 . . -80.18 -27.68 38.87 Favored 'General case' 0 CA--C 1.562 1.426 0 N-CA-C 116.507 2.04 . . . . 0.0 116.507 -159.812 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 1.1 pp -122.73 30.69 6.35 Favored 'General case' 0 N--CA 1.489 1.523 0 N-CA-C 118.217 2.673 . . . . 0.0 118.217 158.112 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 43' ' ' SER . . . . . . . . . . . . . 20.2 m 152.68 65.15 0.0 OUTLIER 'General case' 0 N--CA 1.505 2.276 0 O-C-N 119.279 -2.138 . . . . 0.0 110.861 107.56 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 44' ' ' LYS . . . . . . . . . . . . 0.367 7.1 ttpm? -90.72 118.88 68.97 Favored Pre-proline 0 N--CA 1.531 3.578 0 N-CA-C 116.23 1.937 . . . . 0.0 116.23 -169.288 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 84.6 Cg_endo -77.85 131.09 10.92 Favored 'Trans proline' 0 CA--C 1.567 2.162 0 C-N-CA 122.728 2.286 . . . . 0.0 115.508 161.08 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 46' ' ' SER . . . . . . . . . . . . 0.319 69.4 m -106.64 -110.58 0.0 OUTLIER Pre-proline 0 CA--C 1.581 2.15 0 CA-C-O 114.241 -2.79 . . . . 0.0 110.708 171.927 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 25.3 Cg_endo -88.22 58.45 2.8 Favored 'Trans proline' 0 CA--C 1.567 2.153 1 CA-C-N 128.779 4.171 . . . . 0.0 116.137 -179.54 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 48' ' ' VAL . . . . . . . . . . . . . 20.5 t -37.13 118.0 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.508 2.466 0 N-CA-C 116.742 2.127 . . . . 0.0 116.742 -173.333 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 49' ' ' THR . . . . . . . . . . . . 0.671 0.5 OUTLIER 75.94 15.5 2.47 Favored 'General case' 0 N--CA 1.508 2.431 3 O-C-N 112.226 -6.546 . . . . 0.0 123.121 -13.352 . . . . . . . . 4 3 . 1 . 012 nuclear orig full ' B' B ' 50' ' ' GLY . . . . . . . . . . . . . . . 72.81 31.71 62.05 Favored Glycine 0 N--CA 1.502 3.044 0 N-CA-C 121.475 3.35 . . . . 0.0 121.475 165.645 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 51' ' ' TYR . . . . . . . . . . . . . 20.4 m-85 -77.02 89.43 3.56 Favored 'General case' 0 CA--C 1.576 1.968 0 CA-C-N 118.974 1.387 . . . . 0.0 113.668 -178.277 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 52' ' ' ARG . . . . . . . . . . . . . 69.1 ttt-85 -153.9 68.86 0.77 Allowed 'General case' 0 N--CA 1.5 2.062 0 N-CA-C 114.648 1.351 . . . . 0.0 114.648 176.42 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -171.96 166.74 6.27 Favored 'General case' 0 N--CA 1.503 2.223 0 N-CA-C 116.411 2.004 . . . . 0.0 116.411 167.025 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . 1.036 0.0 OUTLIER 47.91 13.5 0.04 OUTLIER 'General case' 0 N--CA 1.522 3.133 1 N-CA-C 125.738 5.459 . . . . 0.0 125.738 148.145 . . . . . . . . 4 3 . 1 . 012 nuclear orig full ' B' B ' 55' ' ' ALA . . . . . . . . . . . . 0.34 . . 0.16 -79.02 0.0 OUTLIER 'General case' 0 CA--C 1.595 2.676 2 O-C-N 114.344 -5.222 . . . . 0.0 122.481 83.467 . . . . . . . . 3 2 . 1 . 012 nuclear orig full ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 23.9 mp0 -39.46 -4.76 0.0 OUTLIER 'General case' 0 CA--C 1.592 2.591 1 N-CA-C 122.599 4.296 . . . . 0.0 122.599 148.522 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 57' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -103.35 -35.17 8.5 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 119.751 -1.843 . . . . 0.0 114.286 167.264 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 93.9 mt -62.73 -45.61 91.93 Favored 'General case' 0 N--CA 1.501 2.094 0 CA-C-N 120.61 1.55 . . . . 0.0 113.931 164.814 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 59' ' ' ALA . . . . . . . . . . . . . . . -24.25 -76.36 0.02 OUTLIER 'General case' 0 N--CA 1.486 1.369 0 N-CA-C 119.825 3.268 . . . . 0.0 119.825 141.243 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -86.32 3.64 42.55 Favored 'General case' 0 CA--C 1.551 1.007 0 N-CA-C 115.726 1.75 . . . . 0.0 115.726 -168.36 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 61' ' ' GLU . . . . . . . . . . . . 0.257 19.7 tt0 -65.7 -62.97 1.21 Allowed 'General case' 0 N--CA 1.482 1.17 0 CA-C-O 115.427 -2.225 . . . . 0.0 112.439 145.501 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 62' ' ' GLN . . . . . . . . . . . . 0.506 1.0 OUTLIER -74.02 -66.69 0.68 Allowed 'General case' 0 C--N 1.367 1.348 0 CA-C-N 123.148 2.704 . . . . 0.0 112.42 -176.322 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 63' ' ' SER . . . . . . . . . . . . 0.321 46.2 t -72.96 46.44 0.17 Allowed 'General case' 0 CA--C 1.575 1.931 0 N-CA-C 118.082 2.623 . . . . 0.0 118.082 164.078 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 64' ' ' GLU . . . . . . . . . . . . . 11.5 tt0 -125.28 -32.24 2.97 Favored 'General case' 0 CA--C 1.573 1.856 0 O-C-N 120.083 -1.636 . . . . 0.0 114.21 125.794 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 39.9 mt -78.03 -22.32 49.39 Favored 'General case' 0 N--CA 1.505 2.318 0 CA-C-N 122.021 2.191 . . . . 0.0 116.477 -179.32 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 66' ' ' VAL . . . . . . . . . . . . . 19.4 m . . . . . 0 N--CA 1.507 2.386 0 N-CA-C 119.576 3.176 . . . . 0.0 119.576 170.707 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.567 1.633 0 N-CA-C 117.244 2.313 . . . . 0.0 117.244 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . 0.367 55.1 ptt85 45.7 51.24 10.33 Favored 'General case' 0 N--CA 1.501 2.106 0 N-CA-C 119.053 2.983 . . . . 0.0 119.053 -174.493 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -164.49 -44.09 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.495 0 O-C-N 120.783 -1.198 . . . . 0.0 113.008 169.438 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 47.8 t0 -145.55 90.2 6.05 Favored Pre-proline 0 CA--C 1.571 1.757 0 N-CA-C 108.549 -0.908 . . . . 0.0 108.549 157.388 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 2.8 Cg_endo -106.07 149.68 0.12 Allowed 'Trans proline' 0 C--N 1.371 1.722 0 C-N-CA 122.461 2.107 . . . . 0.0 114.643 -164.723 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 74.5 m80 -89.89 138.52 31.42 Favored 'General case' 0 N--CA 1.489 1.485 0 N-CA-C 113.605 0.965 . . . . 0.0 113.605 -178.744 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 15.8 p90 -128.26 157.35 41.15 Favored 'General case' 0 CA--C 1.566 1.583 0 O-C-N 120.193 -1.567 . . . . 0.0 110.726 144.654 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 85.5 m-20 -71.4 88.02 0.88 Allowed 'General case' 0 N--CA 1.491 1.598 0 O-C-N 119.938 -1.726 . . . . 0.0 111.666 169.956 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 2.2 t80 -66.45 151.33 47.42 Favored 'General case' 0 CA--C 1.556 1.185 0 CA-C-O 125.319 2.485 . . . . 0.0 111.014 157.728 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -166.97 99.87 0.54 Allowed 'General case' 0 N--CA 1.488 1.428 0 CA-C-N 111.666 -2.516 . . . . 0.0 108.074 -142.545 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 1.3 mpt? -125.43 117.4 25.0 Favored Pre-proline 0 CA--C 1.561 1.392 0 CA-C-O 116.727 -1.606 . . . . 0.0 112.831 -151.213 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 82.7 Cg_exo -42.66 145.98 0.9 Allowed 'Trans proline' 0 CA--C 1.561 1.869 0 C-N-CA 123.062 2.508 . . . . 0.0 116.679 166.13 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -52.61 -38.45 60.2 Favored 'General case' 0 N--CA 1.498 1.932 0 N-CA-C 117.43 2.382 . . . . 0.0 117.43 -160.713 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . 0.26 9.9 pt-20 -64.59 -42.54 95.52 Favored 'General case' 0 CA--C 1.563 1.476 0 N-CA-C 116.719 2.118 . . . . 0.0 116.719 167.239 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -60.55 -50.31 80.89 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.191 0 CA-C-N 123.977 3.08 . . . . 0.0 113.005 173.795 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 1.2 ttt180 -68.65 -40.95 80.01 Favored 'General case' 0 C--O 1.215 -0.722 0 CA-C-O 115.983 -1.961 . . . . 0.0 115.467 173.191 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -58.5 -41.41 85.3 Favored 'General case' 0 CA--C 1.565 1.521 0 CA-C-N 123.858 3.026 . . . . 0.0 114.427 164.033 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . 0.277 48.8 mtmt -63.07 -54.67 34.4 Favored 'General case' 0 CA--C 1.562 1.418 0 CA-C-N 121.337 1.88 . . . . 0.0 115.046 169.94 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 9.0 mt -62.53 -38.16 88.88 Favored 'General case' 0 CA--C 1.57 1.747 0 N-CA-C 116.532 2.049 . . . . 0.0 116.532 172.832 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 14.3 ttpt -89.32 -24.94 21.88 Favored 'General case' 0 CA--C 1.57 1.718 0 C-N-CA 125.202 1.401 . . . . 0.0 113.19 -177.733 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 13.3 m-30 -65.23 -65.29 0.69 Allowed 'General case' 0 N--CA 1.49 1.571 0 CA-C-O 115.374 -2.25 . . . . 0.0 111.051 154.363 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . 0.273 7.3 ttm180 -20.71 -54.59 0.02 OUTLIER 'General case' 0 CA--C 1.587 2.401 0 CA-C-N 124.416 3.28 . . . . 0.0 115.922 158.146 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . 0.287 . . -57.87 -74.33 0.06 Allowed 'General case' 0 CA--C 1.585 2.319 0 N-CA-C 118.512 2.782 . . . . 0.0 118.512 158.919 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 15.6 mm-40 -74.13 -36.84 64.21 Favored 'General case' 0 N--CA 1.499 1.976 0 N-CA-C 118.814 2.894 . . . . 0.0 118.814 -175.621 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -46.34 -50.07 16.85 Favored 'General case' 0 CA--C 1.584 2.282 0 N-CA-C 116.091 1.886 . . . . 0.0 116.091 155.187 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 52.2 m-20 -88.44 -43.97 11.08 Favored 'General case' 0 N--CA 1.497 1.916 0 N-CA-C 116.475 2.028 . . . . 0.0 116.475 -175.835 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 116.43 24.37 3.8 Favored Glycine 0 CA--C 1.561 2.908 0 N-CA-C 119.266 2.467 . . . . 0.0 119.266 -163.68 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . 0.305 2.7 mtm-85 -116.79 167.41 11.13 Favored 'General case' 0 CA--C 1.576 1.958 0 N-CA-C 105.541 -2.022 . . . . 0.0 105.541 163.466 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 28.4 t -126.69 112.7 15.75 Favored 'General case' 0 N--CA 1.506 2.346 0 O-C-N 117.359 -3.338 . . . . 0.0 106.59 -173.793 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 14.2 mtp -38.2 -39.03 0.38 Allowed 'General case' 0 N--CA 1.501 2.096 1 N-CA-C 121.854 4.02 . . . . 0.0 121.854 -144.676 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 11.6 t-20 -47.15 -53.38 13.14 Favored 'General case' 0 CA--C 1.588 2.413 0 O-C-N 118.713 -2.492 . . . . 0.0 114.186 159.985 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . 0.308 30.2 t -49.17 -61.43 2.08 Favored 'General case' 0 N--CA 1.501 2.076 0 N-CA-C 120.219 3.415 . . . . 0.0 120.219 148.41 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -84.14 -47.83 10.48 Favored 'General case' 0 N--CA 1.517 2.918 0 CA-C-N 124.0 3.091 . . . . 0.0 117.829 -174.036 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . 0.489 0.3 OUTLIER -50.12 -39.27 42.49 Favored 'General case' 0 CA--C 1.584 2.288 0 CA-C-O 113.744 -3.027 . . . . 0.0 106.326 163.0 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 13.8 mt -66.26 -57.15 8.16 Favored 'General case' 0 N--CA 1.499 2.014 1 CA-C-N 127.437 4.653 . . . . 0.0 115.014 169.272 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -56.36 -40.52 74.65 Favored 'General case' 0 CA--C 1.557 1.25 0 CA-C-O 115.54 -2.172 . . . . 0.0 113.719 -179.813 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -70.49 -31.04 45.2 Favored 'Isoleucine or valine' 0 C--O 1.201 -1.481 0 CA-C-N 123.156 2.707 . . . . 0.0 116.254 165.144 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 2.4 t -75.94 -49.83 24.78 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.136 0 CA-C-N 124.084 3.129 . . . . 0.0 112.077 177.076 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 27.1 mt-30 -46.25 -47.21 18.11 Favored 'General case' 0 N--CA 1.486 1.33 0 CA-C-O 116.662 -1.637 . . . . 0.0 113.214 154.09 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . 0.417 24.7 m-20 -47.33 -67.18 0.3 Allowed 'General case' 0 N--CA 1.491 1.593 0 CA-C-N 120.82 1.646 . . . . 0.0 110.509 158.307 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . 0.348 . . -66.06 -33.56 76.07 Favored 'General case' 0 CA--C 1.558 1.252 0 N-CA-C 116.975 2.213 . . . . 0.0 116.975 -152.693 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 2.4 pp -105.43 6.06 32.18 Favored 'General case' 0 N--CA 1.492 1.662 0 N-CA-C 120.818 3.636 . . . . 0.0 120.818 159.754 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 74.2 m -143.14 -42.11 0.3 Allowed 'General case' 0 N--CA 1.5 2.06 0 N-CA-C 120.355 3.465 . . . . 0.0 120.355 174.17 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . 0.446 1.1 tmtp? -60.44 -61.42 7.98 Favored Pre-proline 0 N--CA 1.528 3.451 0 N-CA-C 121.432 3.864 . . . . 0.0 121.432 -121.889 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_exo -67.26 102.96 0.72 Allowed 'Trans proline' 0 CA--C 1.57 2.292 0 CA-C-N 125.016 2.827 . . . . 0.0 117.568 -168.025 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 26.3 t -59.51 -49.71 90.83 Favored Pre-proline 0 CA--C 1.575 1.931 0 N-CA-C 119.897 3.295 . . . . 0.0 119.897 -171.753 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 97.2 Cg_endo -72.7 -9.77 24.28 Favored 'Trans proline' 0 N--CA 1.502 1.985 0 N-CA-C 120.947 3.403 . . . . 0.0 120.947 176.617 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . 0.387 84.8 t 70.65 -73.85 0.1 Allowed 'Isoleucine or valine' 0 N--CA 1.5 2.07 0 C-N-CA 125.978 1.711 . . . . 0.0 113.48 165.824 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . 0.362 8.0 t 50.49 53.99 11.95 Favored 'General case' 0 N--CA 1.501 2.097 0 N-CA-C 118.546 2.795 . . . . 0.0 118.546 162.128 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 117.47 -56.32 0.55 Allowed Glycine 0 N--CA 1.496 2.636 0 N-CA-C 118.986 2.354 . . . . 0.0 118.986 175.813 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . 0.499 0.0 OUTLIER -79.48 69.82 5.81 Favored 'General case' 0 CA--C 1.611 3.292 0 N-CA-C 118.376 2.732 . . . . 0.0 118.376 -156.389 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . 0.386 3.5 tpm_? 41.22 166.84 0.0 OUTLIER 'General case' 1 N--CA 1.547 4.395 1 N-CA-C 123.506 4.632 . . . . 0.0 123.506 158.331 . . . . . . . . 4 2 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . 2.109 0.1 OUTLIER -114.26 13.61 17.93 Favored 'General case' 2 CA--C 1.664 5.343 2 N-CA-C 134.661 8.763 . . . . 0.0 134.661 -151.491 . . . . . . . . 5 3 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . 1.66 0.0 OUTLIER 57.18 -57.09 0.03 OUTLIER 'General case' 1 N--CA 1.566 5.327 2 O-C-N 108.027 -9.171 . . . . 0.0 121.389 115.108 . . . . . . . . 5 3 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . 0.344 . . -62.97 -48.28 79.53 Favored 'General case' 0 C--N 1.286 -2.162 0 N-CA-C 115.728 1.751 . . . . 0.0 115.728 166.081 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -56.7 -10.46 1.02 Allowed 'General case' 0 CA--C 1.584 2.272 0 N-CA-C 118.831 2.9 . . . . 0.0 118.831 150.411 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 37.5 ttt85 -96.47 -38.59 9.95 Favored 'General case' 0 N--CA 1.503 2.218 0 N-CA-C 116.623 2.083 . . . . 0.0 116.623 173.967 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.476 ' O ' ' CB ' ' A' ' 61' ' ' GLU 0.304 22.2 mt -64.61 -19.09 65.47 Favored 'General case' 0 CA--C 1.573 1.856 0 CA-C-O 113.492 -3.147 . . . . 0.0 115.092 160.08 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -65.52 -36.38 83.65 Favored 'General case' 0 N--CA 1.516 2.837 0 N-CA-C 120.791 3.626 . . . . 0.0 120.791 148.05 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -68.82 17.43 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.597 0 O-C-N 118.319 -2.738 . . . . 0.0 116.803 144.149 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.476 ' CB ' ' O ' ' A' ' 58' ' ' LEU 2.142 0.0 OUTLIER 89.85 151.21 0.04 OUTLIER 'General case' 0 CA--C 1.557 1.224 0 N-CA-C 103.729 -2.693 . . . . 0.0 103.729 91.193 . . . . . . . . 4 4 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -28.95 -50.35 0.08 Allowed 'General case' 0 CA--C 1.581 2.141 1 CA-C-N 101.422 -7.172 . . . . 0.0 118.401 102.32 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . 0.41 36.4 t -109.87 43.52 1.33 Allowed 'General case' 0 CA--C 1.56 1.36 0 N-CA-C 116.418 2.007 . . . . 0.0 116.418 -172.319 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 37.3 tt0 -96.26 -25.73 15.68 Favored 'General case' 0 CA--C 1.57 1.723 0 N-CA-C 116.23 1.937 . . . . 0.0 116.23 106.021 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -68.54 -78.79 0.06 Allowed 'General case' 0 CA--C 1.585 2.314 0 CA-C-N 124.442 3.292 . . . . 0.0 113.26 -177.094 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . 0.501 2.7 m . . . . . 0 N--CA 1.518 2.936 1 N-CA-C 122.431 4.234 . . . . 0.0 122.431 157.625 . . . . . . . . 2 1 . 1 . 013 nuclear orig full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.564 1.488 0 N-CA-C 113.802 1.038 . . . . 0.0 113.802 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 2' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -83.0 76.02 9.86 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.013 -1.054 . . . . 0.0 112.609 177.365 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -119.53 70.36 0.85 Allowed 'General case' 0 N--CA 1.49 1.53 0 N-CA-C 108.05 -1.092 . . . . 0.0 108.05 173.601 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 4' ' ' ASP . . . . . . . . . . . . . 8.6 p-10 -152.63 87.39 4.12 Favored Pre-proline 0 CA--C 1.571 1.767 0 O-C-N 121.439 -0.788 . . . . 0.0 110.552 -178.037 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 7.7 Cg_exo -94.45 144.93 1.7 Allowed 'Trans proline' 0 C--N 1.367 1.523 0 CA-C-N 122.937 2.085 . . . . 0.0 114.75 -156.633 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 6' ' ' HIS . . . . . . . . . . . . . 74.2 m80 -79.44 126.74 31.23 Favored 'General case' 0 CA--C 1.565 1.522 0 CA-C-N 113.931 -1.486 . . . . 0.0 111.612 177.107 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 7' ' ' PHE . . . . . . . . . . . . 0.255 2.3 p90 -131.8 153.44 50.13 Favored 'General case' 0 CA--C 1.561 1.372 0 O-C-N 120.239 -1.538 . . . . 0.0 110.419 146.81 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 8' ' ' ASN . . . . . . . . . . . . . 43.4 p-10 -70.48 77.12 0.57 Allowed 'General case' 0 CA--C 1.569 1.683 0 O-C-N 120.989 -1.069 . . . . 0.0 113.842 172.238 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 9' ' ' PHE . . . . . . . . . . . . . 12.2 t80 -73.52 145.7 45.4 Favored 'General case' 0 CA--C 1.558 1.268 0 CA-C-O 126.666 3.126 . . . . 0.0 110.207 168.262 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 10' ' ' ARG . . . . . . . . . . . . . 1.6 ttp180 -173.74 127.77 0.4 Allowed 'General case' 0 C--N 1.298 -1.652 0 CA-C-N 111.235 -2.711 . . . . 0.0 104.818 -135.847 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 11' ' ' MET . . . . . . . . . . . . . 1.3 mpt? -143.04 129.71 10.61 Favored Pre-proline 0 CA--C 1.559 1.307 0 CA-C-O 117.271 -1.347 . . . . 0.0 113.836 -159.896 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 12' ' ' PRO . . . . . . . . . . . . . 85.0 Cg_exo -43.06 146.27 0.98 Allowed 'Trans proline' 0 C--N 1.376 1.987 0 C-N-CA 123.201 2.601 . . . . 0.0 116.005 164.167 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 13' ' ' MET . . . . . . . . . . . . . 1.7 tpt -51.34 -36.41 42.83 Favored 'General case' 0 CA--C 1.57 1.749 0 N-CA-C 117.177 2.288 . . . . 0.0 117.177 -159.868 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 14' ' ' GLU . . . . . . . . . . . . 0.252 7.5 pt-20 -64.04 -51.02 66.13 Favored 'General case' 0 CA--C 1.572 1.799 0 N-CA-C 116.36 1.985 . . . . 0.0 116.36 170.407 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -56.03 -49.9 72.87 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.393 0 CA-C-N 123.364 2.802 . . . . 0.0 111.972 171.797 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.4 -24.89 63.02 Favored 'General case' 0 N--CA 1.474 0.758 0 N-CA-C 117.304 2.335 . . . . 0.0 117.304 174.484 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 17' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -68.96 -40.41 78.9 Favored 'General case' 0 N--CA 1.492 1.655 0 CA-C-N 123.273 2.76 . . . . 0.0 113.986 154.632 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . 0.263 53.8 mtmt -71.85 -47.79 50.57 Favored 'General case' 0 CA--C 1.563 1.46 0 CA-C-N 121.534 1.97 . . . . 0.0 115.732 179.157 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 19' ' ' LEU . . . . . . . . . . . . . 12.6 mt -56.02 -54.55 43.49 Favored 'General case' 0 CA--C 1.566 1.593 0 CA-C-N 120.225 1.375 . . . . 0.0 114.238 158.989 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 20' ' ' LYS . . . . . . . . . . . . . 15.1 ttpt -78.67 -20.84 49.31 Favored 'General case' 0 CA--C 1.572 1.809 0 O-C-N 119.453 -2.029 . . . . 0.0 114.371 -173.191 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 14.2 m-85 -68.62 -68.74 0.37 Allowed 'General case' 0 N--CA 1.489 1.516 0 CA-C-O 113.696 -3.05 . . . . 0.0 111.194 156.218 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . 0.276 13.5 tpp180 -22.97 -49.71 0.02 OUTLIER 'General case' 0 CA--C 1.599 2.86 1 CA-C-N 126.231 4.105 . . . . 0.0 115.554 162.7 . . . . . . . . 3 2 . 1 . 013 nuclear orig full ' B' B ' 23' ' ' ALA . . . . . . . . . . . . 0.265 . . -60.09 -76.08 0.05 Allowed 'General case' 0 CA--C 1.582 2.176 0 N-CA-C 116.815 2.154 . . . . 0.0 116.815 160.884 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 57.7 mm-40 -71.43 -35.03 70.82 Favored 'General case' 0 N--CA 1.5 2.057 0 N-CA-C 118.921 2.934 . . . . 0.0 118.921 -177.516 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 25' ' ' ALA . . . . . . . . . . . . . . . -44.69 -50.27 10.02 Favored 'General case' 0 CA--C 1.585 2.32 0 N-CA-C 115.89 1.811 . . . . 0.0 115.89 155.705 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 26' ' ' ASN . . . . . . . . . . . . . 88.4 m-20 -82.74 -43.37 16.88 Favored 'General case' 0 N--CA 1.501 2.124 0 N-CA-C 116.823 2.157 . . . . 0.0 116.823 176.3 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 27' ' ' GLY . . . . . . . . . . . . . . . 106.51 30.29 4.42 Favored Glycine 0 CA--C 1.561 2.936 0 N-CA-C 118.001 1.96 . . . . 0.0 118.001 -152.875 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 28' ' ' ARG . . . . . . . . . . . . . 48.4 mtm180 -114.62 145.39 42.06 Favored 'General case' 0 CA--C 1.57 1.742 0 N-CA-C 104.179 -2.526 . . . . 0.0 104.179 171.852 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 29' ' ' SER . . . . . . . . . . . . . 81.0 p -113.05 115.15 27.91 Favored 'General case' 0 N--CA 1.507 2.419 0 O-C-N 117.964 -2.96 . . . . 0.0 105.896 -170.271 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 30' ' ' MET . . . . . . . . . . . . . 32.6 mtp -46.62 -42.18 15.8 Favored 'General case' 0 N--CA 1.498 1.943 0 N-CA-C 118.833 2.901 . . . . 0.0 118.833 -141.566 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 31' ' ' ASN . . . . . . . . . . . . . 6.0 t-20 -45.1 -45.52 11.2 Favored 'General case' 0 CA--C 1.594 2.652 0 CA-C-N 125.974 3.988 . . . . 0.0 115.835 163.225 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 32' ' ' SER . . . . . . . . . . . . 0.274 51.7 m -55.34 -62.73 1.48 Allowed 'General case' 0 N--CA 1.502 2.156 0 N-CA-C 120.47 3.507 . . . . 0.0 120.47 151.963 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 6.2 tm-20 -58.54 -62.58 1.75 Allowed 'General case' 0 N--CA 1.507 2.42 0 CA-C-N 123.076 2.671 . . . . 0.0 115.675 175.343 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -44.23 -52.07 7.74 Favored 'General case' 0 C--O 1.212 -0.894 0 CA-C-O 115.653 -2.118 . . . . 0.0 105.948 178.254 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 35' ' ' LEU . . . . . . . . . . . . . 8.3 mt -63.17 -56.12 19.39 Favored 'General case' 0 C--N 1.364 1.237 0 CA-C-N 123.319 2.782 . . . . 0.0 116.839 179.98 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 36' ' ' GLN . . . . . . . . . . . . 0.287 0.7 OUTLIER -59.11 -35.85 74.14 Favored 'General case' 0 CA--C 1.568 1.663 0 CA-C-O 117.599 -1.191 . . . . 0.0 113.875 176.122 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 37' ' ' ILE . . . . . . . . . . . . . 1.3 tp -73.54 -26.08 21.65 Favored 'Isoleucine or valine' 0 CA--C 1.568 1.672 0 N-CA-C 117.831 2.53 . . . . 0.0 117.831 164.015 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 38' ' ' VAL . . . . . . . . . . . . . 2.4 t -80.97 -46.26 20.82 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.091 0 C-N-CA 127.887 2.475 . . . . 0.0 112.285 179.807 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 33.5 mt-30 -46.26 -46.92 18.12 Favored 'General case' 0 CA--C 1.576 1.968 0 C-N-CA 124.094 0.958 . . . . 0.0 113.53 150.023 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 40' ' ' ASP . . . . . . . . . . . . 0.289 1.2 t70 -58.56 -32.36 68.84 Favored 'General case' 0 CA--C 1.575 1.918 0 N-CA-C 118.151 2.648 . . . . 0.0 118.151 159.534 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -78.34 -50.92 10.9 Favored 'General case' 0 N--CA 1.48 1.072 0 N-CA-C 115.811 1.782 . . . . 0.0 115.811 -167.715 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 2.6 pp -89.01 -21.33 23.54 Favored 'General case' 0 CA--C 1.566 1.564 0 N-CA-C 117.281 2.326 . . . . 0.0 117.281 164.812 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 43' ' ' SER . . . . . . . . . . . . . 41.8 t -126.39 45.91 2.56 Favored 'General case' 0 CA--C 1.568 1.654 0 CA-C-N 121.568 1.985 . . . . 0.0 114.294 177.322 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 44' ' ' LYS . . . . . . . . . . . . . 2.4 tmtm? -47.4 -61.84 2.57 Favored Pre-proline 0 CA--C 1.588 2.412 0 N-CA-C 121.281 3.808 . . . . 0.0 121.281 172.03 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 61.9 Cg_endo -86.65 139.53 5.73 Favored 'Trans proline' 0 CA--C 1.562 1.884 0 N-CA-C 119.614 2.89 . . . . 0.0 119.614 -141.126 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 46' ' ' SER . . . . . . . . . . . . 0.27 44.0 m -140.39 -88.88 0.0 OUTLIER Pre-proline 0 CA--C 1.574 1.892 0 CA-C-O 115.01 -2.424 . . . . 0.0 109.952 141.713 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_endo -82.04 71.81 6.49 Favored 'Trans proline' 0 CA--C 1.567 2.129 0 CA-C-N 127.022 3.543 . . . . 0.0 113.883 174.568 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 48' ' ' VAL . . . . . . . . . . . . . 13.0 p -157.07 115.96 0.26 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.927 0 CA-C-O 123.082 1.42 . . . . 0.0 111.216 -173.656 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 49' ' ' THR . . . . . . . . . . . . . 4.0 t -163.66 57.18 0.17 Allowed 'General case' 0 N--CA 1.5 2.057 0 O-C-N 120.617 -1.302 . . . . 0.0 113.87 -132.136 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 50' ' ' GLY . . . . . . . . . . . . . . . 73.7 81.94 0.39 Allowed Glycine 0 N--CA 1.496 2.656 0 O-C-N 121.057 -1.027 . . . . 0.0 113.752 -170.52 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 51' ' ' TYR . . . . . . . . . . . . . 2.8 p90 -55.86 134.66 52.05 Favored 'General case' 0 CA--C 1.576 1.972 2 O-C-N 114.585 -5.067 . . . . 0.0 120.75 22.028 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 52' ' ' ARG . . . . . . . . . . . . . 53.9 ttp85 -156.5 94.52 1.49 Allowed 'General case' 0 CA--C 1.566 1.569 0 N-CA-C 107.037 -1.468 . . . . 0.0 107.037 168.609 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . 0.321 0.2 OUTLIER -87.62 -4.31 58.95 Favored 'General case' 0 N--CA 1.506 2.34 0 C-N-CA 129.781 3.232 . . . . 0.0 110.341 169.899 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . 0.535 1.1 p30 -72.01 57.03 0.32 Allowed 'General case' 0 CA--C 1.573 1.831 0 CA-C-N 123.986 3.085 . . . . 0.0 112.513 167.895 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 55' ' ' ALA . . . . . . . . . . . . . . . -156.0 -76.21 0.1 Allowed 'General case' 0 C--N 1.316 -0.877 0 N-CA-C 103.282 -2.858 . . . . 0.0 103.282 -127.329 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 39.2 mt-10 -42.94 -57.15 2.96 Favored 'General case' 0 N--CA 1.48 1.036 0 N-CA-C 118.789 2.885 . . . . 0.0 118.789 123.32 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 57' ' ' ARG . . . . . . . . . . . . . 1.4 mpt_? -75.41 -37.62 60.35 Favored 'General case' 0 C--N 1.319 -0.717 0 N-CA-C 114.759 1.392 . . . . 0.0 114.759 -163.119 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 58' ' ' LEU . . . . . . . . . . . . 0.488 31.0 mt -109.19 2.33 20.89 Favored 'General case' 0 CA--C 1.588 2.41 0 CA-C-N 120.312 1.414 . . . . 0.0 113.097 171.263 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 59' ' ' ALA . . . . . . . . . . . . . . . -52.62 -29.93 28.66 Favored 'General case' 0 N--CA 1.498 1.946 0 O-C-N 118.034 -2.916 . . . . 0.0 117.461 127.321 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . 0.332 19.8 t0 -100.68 -8.75 22.53 Favored 'General case' 0 CA--C 1.56 1.345 0 N-CA-C 115.907 1.817 . . . . 0.0 115.907 -175.321 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -51.31 -59.56 4.09 Favored 'General case' 0 CA--C 1.564 1.513 0 CA-C-O 116.459 -1.734 . . . . 0.0 112.548 129.483 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 62' ' ' GLN . . . . . . . . . . . . 0.331 0.2 OUTLIER -47.83 -54.34 12.76 Favored 'General case' 0 CA--C 1.566 1.596 0 CA-C-N 123.303 2.774 . . . . 0.0 116.269 171.292 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 61.1 m -30.41 -49.28 0.11 Allowed 'General case' 0 N--CA 1.516 2.858 0 N-CA-C 118.913 2.931 . . . . 0.0 118.913 164.579 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 64' ' ' GLU . . . . . . . . . . . . 0.548 0.4 OUTLIER -99.83 -8.28 24.32 Favored 'General case' 0 CA--C 1.597 2.776 0 CA-C-N 112.875 -1.966 . . . . 0.0 111.188 -167.51 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 65' ' ' LEU . . . . . . . . . . . . 0.297 0.3 OUTLIER -77.51 -47.02 20.63 Favored 'General case' 0 CA--C 1.583 2.221 0 O-C-N 118.571 -2.581 . . . . 0.0 116.64 147.623 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 66' ' ' VAL . . . . . . . . . . . . . 31.5 m . . . . . 0 N--CA 1.515 2.788 0 N-CA-C 119.257 3.058 . . . . 0.0 119.257 -160.628 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.56 1.362 0 N-CA-C 113.592 0.96 . . . . 0.0 113.592 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 57.9 mtp180 -86.14 88.76 7.65 Favored 'General case' 0 CA--C 1.568 1.671 0 CA-C-O 121.962 0.887 . . . . 0.0 111.752 173.753 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 4.3 p-10 -82.68 55.39 2.98 Favored 'General case' 0 CA--C 1.571 1.786 0 O-C-N 120.884 -1.135 . . . . 0.0 112.47 163.411 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 8.8 p-10 -149.38 69.53 9.61 Favored Pre-proline 0 CA--C 1.567 1.617 0 O-C-N 120.835 -1.166 . . . . 0.0 112.049 -175.352 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 64.1 Cg_endo -64.37 148.39 90.86 Favored 'Trans proline' 0 CA--C 1.559 1.752 0 C-N-CA 123.698 2.932 . . . . 0.0 116.486 175.847 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 73.2 m80 -92.44 133.01 36.31 Favored 'General case' 0 CA--C 1.566 1.57 0 CA-C-N 113.301 -1.772 . . . . 0.0 110.956 178.977 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 2.8 p90 -125.82 151.23 47.07 Favored 'General case' 0 CA--C 1.563 1.479 0 O-C-N 120.423 -1.423 . . . . 0.0 110.28 154.285 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 14.3 m120 -69.25 90.67 0.5 Allowed 'General case' 0 N--CA 1.488 1.445 0 O-C-N 120.434 -1.416 . . . . 0.0 111.465 167.517 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . 0.489 ' CD2' ' SD ' ' A' ' 11' ' ' MET . 4.5 t80 -72.57 159.7 33.48 Favored 'General case' 0 CA--C 1.565 1.54 0 CA-C-O 125.207 2.432 . . . . 0.0 109.824 153.723 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 3.1 tmm_? -176.5 114.93 0.11 Allowed 'General case' 0 C--N 1.308 -1.232 0 N-CA-C 104.499 -2.408 . . . . 0.0 104.499 -141.493 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' MET . . . . . 0.489 ' SD ' ' CD2' ' A' ' 9' ' ' PHE . 0.1 OUTLIER -127.18 116.28 21.74 Favored Pre-proline 0 CA--C 1.559 1.311 0 CA-C-O 116.957 -1.497 . . . . 0.0 110.934 -162.488 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 81.5 Cg_exo -40.04 138.13 1.18 Allowed 'Trans proline' 0 CA--C 1.562 1.914 0 CA-C-N 123.798 2.392 . . . . 0.0 116.074 160.488 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 15.5 tpp -54.84 -25.83 31.18 Favored 'General case' 0 N--CA 1.496 1.836 0 N-CA-C 119.496 3.147 . . . . 0.0 119.496 -160.323 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -58.31 -57.55 12.41 Favored 'General case' 0 CA--C 1.568 1.655 0 N-CA-C 117.353 2.353 . . . . 0.0 117.353 156.976 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -55.42 -45.88 78.38 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.433 0 CA-C-N 121.887 2.13 . . . . 0.0 113.454 173.731 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -77.42 -27.89 52.42 Favored 'General case' 0 N--CA 1.474 0.75 0 CA-C-O 115.792 -2.052 . . . . 0.0 116.137 175.176 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 -65.0 -41.27 95.53 Favored 'General case' 0 N--CA 1.485 1.29 0 CA-C-N 124.252 3.205 . . . . 0.0 113.345 158.684 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . 0.542 32.5 pttt -77.44 -39.41 46.88 Favored 'General case' 0 CA--C 1.563 1.449 0 N-CA-C 116.989 2.218 . . . . 0.0 116.989 179.768 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 12.9 tp -66.27 -36.99 84.41 Favored 'General case' 0 CA--C 1.569 1.674 0 CA-C-N 120.595 1.543 . . . . 0.0 114.885 163.632 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 13.3 ttpt -90.26 -25.22 20.67 Favored 'General case' 0 CA--C 1.574 1.873 0 N-CA-C 114.821 1.415 . . . . 0.0 114.821 -179.825 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 24.1 m-85 -64.98 -69.58 0.28 Allowed 'General case' 0 N--CA 1.494 1.751 0 CA-C-O 113.581 -3.104 . . . . 0.0 110.501 155.974 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . 0.35 2.5 tmt_? -28.84 -44.0 0.03 OUTLIER 'General case' 0 CA--C 1.605 3.074 0 CA-C-N 125.747 3.885 . . . . 0.0 115.272 166.58 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -57.85 -76.28 0.04 OUTLIER 'General case' 0 CA--C 1.582 2.203 0 N-CA-C 117.445 2.387 . . . . 0.0 117.445 157.727 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 37.6 mt-10 -58.99 -46.61 87.7 Favored 'General case' 0 N--CA 1.505 2.276 0 N-CA-C 118.092 2.627 . . . . 0.0 118.092 178.026 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -41.03 -46.52 2.9 Favored 'General case' 0 CA--C 1.585 2.323 0 N-CA-C 116.606 2.076 . . . . 0.0 116.606 160.866 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 81.5 m-20 -78.68 -42.66 27.94 Favored 'General case' 0 N--CA 1.501 2.105 0 N-CA-C 117.554 2.428 . . . . 0.0 117.554 167.711 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 100.38 25.62 8.68 Favored Glycine 0 CA--C 1.559 2.832 0 N-CA-C 118.312 2.085 . . . . 0.0 118.312 -151.422 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 44.4 mtt85 -102.86 155.06 18.6 Favored 'General case' 0 CA--C 1.568 1.654 0 CA-C-N 119.39 1.595 . . . . 0.0 106.762 164.129 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 39.2 t -114.14 118.96 35.5 Favored 'General case' 0 N--CA 1.5 2.064 0 N-CA-C 105.194 -2.15 . . . . 0.0 105.194 -178.893 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 15.1 mtp -47.61 -36.95 11.62 Favored 'General case' 0 N--CA 1.5 2.061 0 N-CA-C 119.25 3.056 . . . . 0.0 119.25 -146.599 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 15.8 t-20 -45.53 -45.65 13.49 Favored 'General case' 0 CA--C 1.598 2.827 0 CA-C-N 125.622 3.828 . . . . 0.0 115.715 161.881 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . 0.35 12.8 t -49.12 -73.73 0.04 OUTLIER 'General case' 0 N--CA 1.499 1.982 0 N-CA-C 117.877 2.547 . . . . 0.0 117.877 145.574 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -57.92 -57.35 13.18 Favored 'General case' 0 N--CA 1.516 2.834 0 CA-C-N 124.017 3.099 . . . . 0.0 116.523 -174.656 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -42.56 -53.2 4.49 Favored 'General case' 0 CA--C 1.555 1.145 0 CA-C-O 115.476 -2.202 . . . . 0.0 107.183 171.164 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 16.0 mt -62.24 -43.85 97.9 Favored 'General case' 0 C--N 1.368 1.388 0 CA-C-N 124.077 3.126 . . . . 0.0 115.954 174.036 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.76 -44.23 93.95 Favored 'General case' 0 N--CA 1.49 1.553 0 N-CA-C 115.37 1.619 . . . . 0.0 115.37 175.106 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 3.4 tt -75.07 -20.79 16.46 Favored 'Isoleucine or valine' 0 CA--C 1.564 1.493 0 CA-C-O 114.667 -2.587 . . . . 0.0 116.056 165.537 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 4.1 t -89.91 -48.53 14.33 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.001 0 CA-C-N 123.222 2.737 . . . . 0.0 109.927 -174.915 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 26.6 mt-30 -55.32 -43.67 75.13 Favored 'General case' 0 CA--C 1.565 1.527 0 O-C-N 121.276 -0.89 . . . . 0.0 112.31 156.953 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . 0.672 0.4 OUTLIER -61.02 -28.02 68.75 Favored 'General case' 0 CA--C 1.571 1.78 0 N-CA-C 118.531 2.789 . . . . 0.0 118.531 157.572 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -74.68 -47.52 31.29 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 119.431 -2.043 . . . . 0.0 114.238 -179.766 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -77.48 -34.54 54.23 Favored 'General case' 0 CA--C 1.572 1.795 0 N-CA-C 114.059 1.133 . . . . 0.0 114.059 175.507 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 88.3 p -130.7 68.31 1.48 Allowed 'General case' 0 CA--C 1.571 1.765 0 N-CA-C 113.167 0.803 . . . . 0.0 113.167 173.069 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . 0.44 0.1 OUTLIER -54.91 -85.61 0.01 OUTLIER Pre-proline 0 CA--C 1.583 2.224 1 N-CA-C 122.787 4.366 . . . . 0.0 122.787 172.878 . . . . . . . . 4 3 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo -81.93 148.12 15.31 Favored 'Trans proline' 0 CA--C 1.558 1.711 0 N-CA-C 119.585 2.879 . . . . 0.0 119.585 -122.733 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 74.3 m -85.85 95.99 0.44 Allowed Pre-proline 0 CA--C 1.58 2.119 0 CA-C-N 115.004 -0.998 . . . . 0.0 109.395 127.088 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -88.61 69.39 2.71 Favored 'Trans proline' 0 C--N 1.372 1.796 0 CA-C-N 123.188 2.174 . . . . 0.0 114.424 -166.832 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . 0.273 12.3 p -137.56 -62.41 0.37 Allowed 'Isoleucine or valine' 0 N--CA 1.505 2.295 0 N-CA-C 115.567 1.692 . . . . 0.0 115.567 -160.586 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . 0.251 5.6 t -94.98 80.97 3.68 Favored 'General case' 0 N--CA 1.493 1.682 0 CA-C-O 122.845 1.307 . . . . 0.0 112.614 -149.764 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 73.25 19.82 79.75 Favored Glycine 0 N--CA 1.497 2.725 0 N-CA-C 119.054 2.381 . . . . 0.0 119.054 -166.908 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 18.3 m-30 -101.55 76.75 1.7 Allowed 'General case' 0 CA--C 1.572 1.817 0 CA-C-N 118.924 1.362 . . . . 0.0 112.318 -164.089 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 78.4 ttt180 -93.04 94.53 8.93 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.109 -0.994 . . . . 0.0 110.825 172.786 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . 0.276 0.4 OUTLIER -161.0 -78.82 0.05 OUTLIER 'General case' 0 CA--C 1.592 2.583 0 N-CA-C 114.388 1.255 . . . . 0.0 114.388 -152.944 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . 1.802 1.1 m-20 119.54 -40.21 0.01 OUTLIER 'General case' 0 N--CA 1.516 2.869 0 N-CA-C 121.194 3.776 . . . . 0.0 121.194 -133.635 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . 0.647 ' O ' ' CA ' ' A' ' 57' ' ' ARG 0.292 . . 40.66 112.5 0.0 OUTLIER 'General case' 0 C--O 1.187 -2.221 2 CA-C-O 102.999 -8.143 . . . . 0.0 123.135 -75.926 . . . . . . . . 4 3 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . 0.79 14.2 tt0 -39.28 55.69 0.0 OUTLIER 'General case' 0 N--CA 1.519 2.979 3 CA-C-N 134.192 7.724 . . . . 0.0 129.45 -166.886 . . . . . . . . 3 2 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.647 ' CA ' ' O ' ' A' ' 55' ' ' ALA 0.484 0.0 OUTLIER 165.15 -137.52 0.0 OUTLIER 'General case' 1 CA--C 1.646 4.659 2 O-C-N 114.204 -5.31 . . . . 0.0 99.378 -105.183 . . . . . . . . 6 4 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . 0.691 0.6 OUTLIER -25.32 53.69 0.0 OUTLIER 'General case' 0 CA--C 1.587 2.387 1 O-C-N 115.488 -4.507 . . . . 0.0 120.437 -58.173 . . . . . . . . 4 3 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . 0.624 ' N ' ' CA ' ' A' ' 57' ' ' ARG 2.674 . . 110.91 54.19 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.603 1 N-CA-C 123.176 4.51 . . . . 0.0 123.176 174.829 . . . . . . . . 4 3 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . 2.253 7.0 t70 47.5 21.95 0.27 Allowed 'General case' 0 N--CA 1.488 1.427 0 CA-C-N 124.692 3.406 . . . . 0.0 116.55 -140.47 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.405 ' O ' ' O ' ' A' ' 59' ' ' ALA 2.214 2.5 mt-10 91.7 164.98 0.03 OUTLIER 'General case' 1 CA--C 1.64 4.437 1 CA-C-O 130.905 5.145 . . . . 0.0 114.587 -138.813 . . . . . . . . 5 3 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 4.03 -26.27 0.0 OUTLIER 'General case' 0 C--N 1.279 -2.47 1 O-C-N 106.065 -10.397 . . . . 0.0 120.439 86.303 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' SER . . . . . 0.443 ' CB ' ' CA ' ' A' ' 64' ' ' GLU 2.052 0.5 OUTLIER 117.81 174.84 0.0 OUTLIER 'General case' 0 N--CA 1.396 -3.17 0 N-CA-C 120.609 3.559 . . . . 0.0 120.609 152.439 . . . . . . . . 4 4 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . 0.443 ' CA ' ' CB ' ' A' ' 63' ' ' SER 0.33 0.1 OUTLIER -3.42 -27.18 0.0 OUTLIER 'General case' 2 CA--C 1.699 6.679 1 N-CA-C 132.817 8.08 . . . . 0.0 132.817 44.05 . . . . . . . . 6 4 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.438 ' N ' ' CB ' ' A' ' 63' ' ' SER . 0.5 OUTLIER -64.24 -51.26 64.53 Favored 'General case' 0 C--N 1.424 3.837 2 CA-C-N 131.168 6.349 . . . . 0.0 112.394 165.206 . . . . . . . . 4 4 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . 0.428 27.8 m . . . . . 0 N--CA 1.497 1.907 1 N-CA-C 122.052 4.093 . . . . 0.0 122.052 156.836 . . . . . . . . 2 1 . 1 . 014 nuclear orig full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.561 1.376 0 N-CA-C 113.43 0.9 . . . . 0.0 113.43 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 2' ' ' ARG . . . . . . . . . . . . . 16.4 mmm180 -81.28 79.19 7.97 Favored 'General case' 0 N--CA 1.494 1.732 0 CA-C-O 122.715 1.245 . . . . 0.0 113.467 -179.837 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . 0.252 5.8 p-10 -162.97 -49.44 0.04 OUTLIER 'General case' 0 N--CA 1.493 1.713 0 C-N-CA 124.666 1.186 . . . . 0.0 112.95 179.787 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 4' ' ' ASP . . . . . . . . . . . . . 6.6 p30 -144.91 85.72 8.14 Favored Pre-proline 0 CA--C 1.566 1.588 0 CA-C-O 118.331 -0.843 . . . . 0.0 111.357 157.766 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 3.3 Cg_exo -89.93 140.93 3.56 Favored 'Trans proline' 0 CA--C 1.552 1.408 0 CA-C-N 122.521 1.936 . . . . 0.0 113.683 -160.507 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 6' ' ' HIS . . . . . . . . . . . . . 78.5 m80 -83.22 128.95 34.94 Favored 'General case' 0 CA--C 1.562 1.44 0 CA-C-N 114.155 -1.384 . . . . 0.0 111.974 -178.171 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 7' ' ' PHE . . . . . . . . . . . . . 4.2 p90 -129.45 146.53 51.28 Favored 'General case' 0 CA--C 1.562 1.406 0 O-C-N 120.599 -1.313 . . . . 0.0 110.754 154.577 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 8' ' ' ASN . . . . . . . . . . . . . 12.6 m120 -70.26 86.42 0.58 Allowed 'General case' 0 N--CA 1.489 1.509 0 O-C-N 120.552 -1.343 . . . . 0.0 111.261 170.369 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 9' ' ' PHE . . . . . . . . . . . . . 5.9 t80 -70.48 153.12 43.27 Favored 'General case' 0 CA--C 1.551 1.006 0 CA-C-O 124.91 2.29 . . . . 0.0 110.745 161.907 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -162.65 126.15 2.93 Favored 'General case' 0 N--CA 1.481 1.114 0 CA-C-N 112.433 -2.167 . . . . 0.0 108.504 -160.752 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 11' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -127.02 115.44 21.96 Favored Pre-proline 0 CA--C 1.562 1.435 0 CA-C-O 117.253 -1.356 . . . . 0.0 110.605 -156.689 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 12' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_exo -41.96 142.99 1.31 Allowed 'Trans proline' 0 C--N 1.374 1.883 0 C-N-CA 122.99 2.46 . . . . 0.0 115.69 160.371 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 13' ' ' MET . . . . . . . . . . . . . 20.2 tpp -61.74 -35.56 78.46 Favored 'General case' 0 N--CA 1.493 1.69 0 N-CA-C 117.403 2.371 . . . . 0.0 117.403 -149.14 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 8.0 pt-20 -59.07 -41.44 88.0 Favored 'General case' 0 CA--C 1.568 1.645 0 N-CA-C 116.649 2.092 . . . . 0.0 116.649 163.564 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -59.65 -48.85 85.93 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.146 0 CA-C-N 122.885 2.584 . . . . 0.0 112.594 171.101 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 16' ' ' ARG . . . . . . . . . . . . 0.259 2.8 ttt180 -72.15 -41.23 67.33 Favored 'General case' 0 C--O 1.216 -0.704 0 CA-C-N 120.69 1.586 . . . . 0.0 114.855 176.986 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 17' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -61.52 -34.82 76.18 Favored 'General case' 0 CA--C 1.571 1.781 0 CA-C-N 122.779 2.536 . . . . 0.0 115.043 166.41 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 55.7 mtmt -66.55 -55.61 14.63 Favored 'General case' 0 CA--C 1.563 1.452 0 CA-C-N 121.34 1.882 . . . . 0.0 114.666 165.31 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 19' ' ' LEU . . . . . . . . . . . . . 11.3 tp -64.71 -37.06 86.31 Favored 'General case' 0 CA--C 1.566 1.572 0 N-CA-C 116.353 1.982 . . . . 0.0 116.353 176.965 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 20' ' ' LYS . . . . . . . . . . . . . 3.8 ttpt -87.22 -25.02 24.21 Favored 'General case' 0 CA--C 1.568 1.655 0 CA-C-O 116.917 -1.516 . . . . 0.0 113.598 176.331 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 13.6 m-30 -65.27 -71.06 0.2 Allowed 'General case' 0 N--CA 1.496 1.85 0 CA-C-O 113.551 -3.118 . . . . 0.0 110.667 158.218 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . 0.273 1.5 tpp180 -13.69 -56.68 0.0 OUTLIER 'General case' 0 CA--C 1.595 2.707 0 CA-C-N 125.263 3.665 . . . . 0.0 115.988 158.273 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 23' ' ' ALA . . . . . . . . . . . . 0.261 . . -57.91 -77.65 0.03 OUTLIER 'General case' 0 CA--C 1.589 2.47 0 N-CA-C 117.653 2.464 . . . . 0.0 117.653 160.664 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 54.5 mt-10 -61.13 -42.83 99.26 Favored 'General case' 0 N--CA 1.503 2.216 0 N-CA-C 118.874 2.916 . . . . 0.0 118.874 179.251 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 25' ' ' ALA . . . . . . . . . . . . . . . -39.63 -50.26 2.25 Favored 'General case' 0 CA--C 1.585 2.322 0 N-CA-C 115.882 1.808 . . . . 0.0 115.882 158.45 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 26' ' ' ASN . . . . . . . . . . . . . 71.2 m-20 -82.11 -49.15 10.5 Favored 'General case' 0 N--CA 1.498 1.952 0 N-CA-C 116.293 1.96 . . . . 0.0 116.293 174.79 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 27' ' ' GLY . . . . . . . . . . . . . . . 109.49 15.06 12.86 Favored Glycine 0 CA--C 1.561 2.964 0 N-CA-C 118.756 2.262 . . . . 0.0 118.756 -148.25 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 28' ' ' ARG . . . . . . . . . . . . . 1.7 mtt85 -98.66 156.04 17.02 Favored 'General case' 0 CA--C 1.573 1.829 0 CA-C-N 120.358 2.079 . . . . 0.0 105.59 162.737 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 29' ' ' SER . . . . . . . . . . . . . 38.9 t -122.14 112.22 17.94 Favored 'General case' 0 N--CA 1.503 2.21 0 O-C-N 117.928 -2.983 . . . . 0.0 105.774 -172.228 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 30' ' ' MET . . . . . . . . . . . . . 20.4 mtp -42.88 -32.12 0.58 Allowed 'General case' 0 N--CA 1.505 2.305 0 N-CA-C 121.46 3.874 . . . . 0.0 121.46 -146.133 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 31' ' ' ASN . . . . . . . . . . . . 0.269 12.5 t-20 -50.46 -52.12 40.86 Favored 'General case' 0 CA--C 1.594 2.659 0 O-C-N 118.34 -2.725 . . . . 0.0 114.414 159.002 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 32' ' ' SER . . . . . . . . . . . . 0.321 30.5 t -45.2 -77.54 0.02 OUTLIER 'General case' 0 N--CA 1.501 2.088 0 N-CA-C 116.793 2.145 . . . . 0.0 116.793 145.223 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 -67.83 -52.52 35.91 Favored 'General case' 0 N--CA 1.505 2.282 0 CA-C-N 123.728 2.967 . . . . 0.0 116.198 -168.095 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . 0.595 0.1 OUTLIER -49.56 -36.76 24.83 Favored 'General case' 0 CA--C 1.569 1.683 0 CA-C-O 114.061 -2.876 . . . . 0.0 107.882 170.833 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 35' ' ' LEU . . . . . . . . . . . . . 19.2 mt -65.56 -51.23 61.36 Favored 'General case' 0 N--CA 1.494 1.757 1 CA-C-N 126.493 4.224 . . . . 0.0 115.317 165.829 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 36' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -62.7 -39.12 93.0 Favored 'General case' 0 N--CA 1.477 0.905 0 CA-C-O 116.569 -1.682 . . . . 0.0 114.892 -177.325 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 37' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -69.36 -33.16 56.3 Favored 'Isoleucine or valine' 0 CA--C 1.572 1.802 0 CA-C-O 114.064 -2.874 . . . . 0.0 116.935 158.231 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 38' ' ' VAL . . . . . . . . . . . . . 2.2 t -77.24 -50.68 20.08 Favored 'Isoleucine or valine' 0 N--CA 1.513 2.706 0 CA-C-N 125.453 3.751 . . . . 0.0 112.259 -178.09 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 23.6 mt-30 -47.38 -44.76 24.53 Favored 'General case' 0 CA--C 1.557 1.226 0 CA-C-O 116.935 -1.507 . . . . 0.0 112.072 153.534 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 40' ' ' ASP . . . . . . . . . . . . 0.671 0.0 OUTLIER -48.0 -57.31 5.93 Favored 'General case' 0 N--CA 1.494 1.73 0 N-CA-C 117.051 2.241 . . . . 0.0 117.051 156.03 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -71.01 -44.64 65.48 Favored 'General case' 0 CA--C 1.543 0.684 0 N-CA-C 115.076 1.51 . . . . 0.0 115.076 -151.153 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . 0.312 0.7 OUTLIER -86.1 -27.09 24.89 Favored 'General case' 0 N--CA 1.49 1.56 0 N-CA-C 118.394 2.738 . . . . 0.0 118.394 157.372 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 43' ' ' SER . . . . . . . . . . . . . 30.5 t -142.9 38.06 1.45 Allowed 'General case' 0 N--CA 1.492 1.657 0 N-CA-C 117.866 2.543 . . . . 0.0 117.866 -166.744 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 44' ' ' LYS . . . . . . . . . . . . 0.345 50.5 mttp -104.42 84.81 0.98 Allowed Pre-proline 0 N--CA 1.522 3.153 0 CA-C-N 122.762 2.528 . . . . 0.0 117.416 163.326 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 38.7 Cg_exo -58.42 96.33 0.08 OUTLIER 'Trans proline' 0 CA--C 1.573 2.453 0 C-N-CA 123.541 2.827 . . . . 0.0 115.342 137.762 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 46' ' ' SER . . . . . . . . . . . . . 97.8 p -146.1 99.17 4.3 Favored Pre-proline 0 CA--C 1.577 1.99 0 CA-C-O 117.262 -1.352 . . . . 0.0 113.251 -165.392 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 34.0 Cg_endo -93.04 62.94 0.33 Allowed 'Cis proline' 0 CA--C 1.572 2.396 0 CA-C-N 124.112 2.504 . . . . 0.0 116.67 -7.996 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 48' ' ' VAL . . . . . . . . . . . . 0.279 2.8 t 61.09 47.68 0.26 Allowed 'Isoleucine or valine' 0 N--CA 1.511 2.597 0 N-CA-C 114.954 1.465 . . . . 0.0 114.954 174.389 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 49' ' ' THR . . . . . . . . . . . . . 29.2 p -100.85 59.73 0.94 Allowed 'General case' 0 N--CA 1.498 1.935 0 O-C-N 120.333 -1.48 . . . . 0.0 113.328 -166.383 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 50' ' ' GLY . . . . . . . . . . . . . . . 146.86 -88.69 0.15 Allowed Glycine 0 N--CA 1.491 2.325 0 CA-C-O 119.221 -0.766 . . . . 0.0 114.476 -175.589 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 51' ' ' TYR . . . . . . . . . . . . . 35.2 t80 -142.24 67.05 1.33 Allowed 'General case' 0 CA--C 1.58 2.101 2 O-C-N 114.871 -4.899 . . . . 0.0 109.479 0.076 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 52' ' ' ARG . . . . . . . . . . . . . 15.8 tpp85 -54.66 136.58 45.45 Favored 'General case' 0 N--CA 1.506 2.344 0 C-N-CA 124.737 1.215 . . . . 0.0 113.464 174.837 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . 0.579 52.4 p30 -137.01 170.35 16.26 Favored 'General case' 0 N--CA 1.493 1.679 1 N-CA-C 122.957 4.429 . . . . 0.0 122.957 -155.745 . . . . . . . . 3 2 . 1 . 014 nuclear orig full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . 0.984 0.0 OUTLIER -134.06 10.21 3.86 Favored 'General case' 0 N--CA 1.499 1.999 1 N-CA-C 125.339 5.311 . . . . 0.0 125.339 -177.681 . . . . . . . . 4 3 . 1 . 014 nuclear orig full ' B' B ' 55' ' ' ALA . . . . . 0.441 ' O ' ' O ' ' B' ' 57' ' ' ARG 0.277 . . 28.05 -85.1 0.0 OUTLIER 'General case' 0 CA--C 1.579 2.073 2 N-CA-C 123.13 4.492 . . . . 0.0 123.13 62.462 . . . . . . . . 4 3 . 1 . 014 nuclear orig full ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 10.3 tt0 -84.98 -7.0 59.33 Favored 'General case' 0 CA--C 1.589 2.464 0 N-CA-C 120.051 3.352 . . . . 0.0 120.051 165.727 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 57' ' ' ARG . . . . . 0.441 ' O ' ' O ' ' B' ' 55' ' ' ALA . 0.2 OUTLIER -67.76 -128.86 0.0 OUTLIER 'General case' 0 CA--C 1.553 1.074 0 O-C-N 117.066 -3.521 . . . . 0.0 106.507 111.811 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 58' ' ' LEU . . . . . . . . . . . . 2.386 0.2 OUTLIER 45.67 -55.18 0.0 OUTLIER 'General case' 0 N--CA 1.513 2.688 1 CA-C-N 129.763 5.71 . . . . 0.0 116.493 -143.838 . . . . . . . . 4 3 . 1 . 014 nuclear orig full ' B' B ' 59' ' ' ALA . . . . . 0.433 ' N ' ' O ' ' B' ' 57' ' ' ARG 1.993 . . 168.11 71.4 0.0 OUTLIER 'General case' 0 N--CA 1.501 2.115 0 O-C-N 118.771 -2.456 . . . . 0.0 111.121 123.815 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . 2.54 0.0 OUTLIER 93.38 -13.07 0.15 Allowed 'General case' 0 CA--C 1.593 2.606 0 N-CA-C 115.953 1.834 . . . . 0.0 115.953 -143.593 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 61' ' ' GLU . . . . . 0.45 ' O ' ' N ' ' B' ' 63' ' ' SER 0.389 48.9 mm-40 62.78 125.65 0.01 OUTLIER 'General case' 0 N--CA 1.5 2.032 0 O-C-N 117.356 -3.34 . . . . 0.0 110.461 -102.674 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 62' ' ' GLN . . . . . . . . . . . . 0.496 0.0 OUTLIER -50.8 28.59 0.0 OUTLIER 'General case' 0 N--CA 1.504 2.261 2 CA-C-N 127.403 4.638 . . . . 0.0 123.421 -166.622 . . . . . . . . 4 3 . 1 . 014 nuclear orig full ' B' B ' 63' ' ' SER . . . . . 0.45 ' N ' ' O ' ' B' ' 61' ' ' GLU 0.485 3.6 t 161.86 -33.37 0.0 OUTLIER 'General case' 0 N--CA 1.508 2.443 1 N-CA-C 121.828 4.01 . . . . 0.0 121.828 -86.692 . . . . . . . . 4 3 . 1 . 014 nuclear orig full ' B' B ' 64' ' ' GLU . . . . . . . . . . . . . 15.4 tt0 -83.64 8.86 13.04 Favored 'General case' 0 CA--C 1.581 2.156 0 O-C-N 117.575 -3.203 . . . . 0.0 116.556 119.02 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 84.3 mt -92.2 -87.03 0.22 Allowed 'General case' 0 N--CA 1.5 2.053 0 O-C-N 119.459 -2.026 . . . . 0.0 114.427 146.695 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 66' ' ' VAL . . . . . . . . . . . . 0.448 33.4 m . . . . . 0 N--CA 1.516 2.841 0 N-CA-C 119.965 3.32 . . . . 0.0 119.965 -172.507 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.558 1.288 0 N-CA-C 113.435 0.902 . . . . 0.0 113.435 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 56.8 mtt180 -79.33 87.39 5.0 Favored 'General case' 0 CA--C 1.571 1.785 0 O-C-N 121.153 -0.967 . . . . 0.0 112.118 175.347 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -159.41 -45.83 0.05 Allowed 'General case' 0 N--CA 1.493 1.706 0 O-C-N 120.821 -1.175 . . . . 0.0 113.705 170.532 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 52.8 p-10 -145.5 84.75 8.26 Favored Pre-proline 0 CA--C 1.57 1.714 0 O-C-N 120.878 -1.139 . . . . 0.0 110.685 158.677 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 5.9 Cg_exo -101.12 144.98 0.29 Allowed 'Trans proline' 0 CA--C 1.559 1.733 0 CA-C-N 122.293 1.855 . . . . 0.0 114.619 -156.717 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 75.2 m80 -85.78 129.73 34.75 Favored 'General case' 0 CA--C 1.577 1.985 0 CA-C-N 115.011 -0.995 . . . . 0.0 112.144 179.754 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 8.3 p90 -129.42 152.95 48.41 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 119.329 -2.107 . . . . 0.0 111.115 147.871 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 14.2 m120 -71.17 87.05 0.78 Allowed 'General case' 0 N--CA 1.491 1.602 0 O-C-N 120.059 -1.651 . . . . 0.0 112.614 172.49 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 2.8 t80 -74.19 138.0 43.48 Favored 'General case' 0 CA--C 1.556 1.18 0 CA-C-O 125.573 2.606 . . . . 0.0 110.271 163.075 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -163.29 120.37 1.85 Allowed 'General case' 0 N--CA 1.487 1.422 0 CA-C-N 112.003 -2.362 . . . . 0.0 107.955 -153.002 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 2.5 mpt? -131.27 119.32 17.57 Favored Pre-proline 0 N--CA 1.485 1.278 0 CA-C-O 116.845 -1.55 . . . . 0.0 113.199 -142.162 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 75.5 Cg_exo -42.73 142.78 1.91 Allowed 'Trans proline' 0 C--N 1.372 1.807 0 C-N-CA 123.082 2.521 . . . . 0.0 115.529 165.003 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -57.19 -36.41 70.78 Favored 'General case' 0 N--CA 1.493 1.691 0 N-CA-C 117.227 2.306 . . . . 0.0 117.227 -152.405 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -62.28 -43.58 98.5 Favored 'General case' 0 CA--C 1.565 1.521 0 N-CA-C 116.969 2.211 . . . . 0.0 116.969 165.03 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -58.76 -50.64 78.58 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.355 0 CA-C-N 124.087 3.131 . . . . 0.0 113.158 174.584 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -67.37 -41.99 84.14 Favored 'General case' 0 C--O 1.214 -0.767 0 CA-C-O 116.041 -1.933 . . . . 0.0 115.789 171.284 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 51.0 mt-10 -59.04 -36.06 74.36 Favored 'General case' 0 CA--C 1.573 1.831 0 CA-C-N 123.935 3.061 . . . . 0.0 114.132 165.889 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . 0.276 42.3 mtmt -69.86 -54.71 12.25 Favored 'General case' 0 CA--C 1.564 1.492 0 CA-C-N 121.705 2.048 . . . . 0.0 115.138 171.909 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 10.8 mt -57.99 -45.63 86.51 Favored 'General case' 0 CA--C 1.57 1.723 0 N-CA-C 117.248 2.314 . . . . 0.0 117.248 167.565 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 17.1 ttpt -85.91 -24.46 26.61 Favored 'General case' 0 CA--C 1.569 1.681 0 C-N-CA 124.941 1.296 . . . . 0.0 113.486 -176.281 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 16.9 m-30 -67.44 -64.35 0.87 Allowed 'General case' 0 N--CA 1.492 1.662 0 CA-C-O 114.54 -2.647 . . . . 0.0 110.739 159.138 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . 0.305 12.1 tpp180 -25.22 -45.41 0.02 OUTLIER 'General case' 0 CA--C 1.614 3.406 0 CA-C-N 125.294 3.679 . . . . 0.0 116.089 159.086 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . 0.281 . . -64.45 -69.03 0.31 Allowed 'General case' 0 CA--C 1.59 2.492 0 O-C-N 117.618 -3.177 . . . . 0.0 116.265 163.442 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 39.8 mt-10 -75.49 -42.92 51.66 Favored 'General case' 0 N--CA 1.501 2.075 0 N-CA-C 118.458 2.762 . . . . 0.0 118.458 -179.427 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -42.21 -48.99 4.97 Favored 'General case' 0 CA--C 1.579 2.064 0 N-CA-C 116.638 2.088 . . . . 0.0 116.638 157.869 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . 0.314 0.6 OUTLIER -121.97 -41.99 2.42 Favored 'General case' 0 CA--C 1.573 1.834 0 N-CA-C 114.676 1.361 . . . . 0.0 114.676 -150.659 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 149.02 47.57 0.02 OUTLIER Glycine 0 N--CA 1.499 2.849 0 N-CA-C 118.128 2.011 . . . . 0.0 118.128 167.421 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -150.27 172.39 15.43 Favored 'General case' 0 CA--C 1.573 1.837 0 CA-C-O 122.622 1.201 . . . . 0.0 108.608 -179.789 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 37.5 t -125.61 116.88 22.42 Favored 'General case' 0 N--CA 1.499 2.018 0 O-C-N 119.413 -2.054 . . . . 0.0 105.91 173.174 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 15.2 mtp -46.3 -30.7 2.16 Favored 'General case' 0 N--CA 1.501 2.109 0 N-CA-C 121.705 3.965 . . . . 0.0 121.705 -146.1 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . 0.251 4.0 t-20 -51.3 -49.68 60.83 Favored 'General case' 0 CA--C 1.584 2.281 0 O-C-N 118.512 -2.618 . . . . 0.0 114.164 160.538 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . 0.328 29.6 t -45.63 -71.42 0.08 Allowed 'General case' 0 N--CA 1.499 1.985 0 N-CA-C 117.335 2.346 . . . . 0.0 117.335 145.405 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -66.3 -60.24 2.96 Favored 'General case' 0 N--CA 1.503 2.217 0 CA-C-N 122.977 2.626 . . . . 0.0 114.547 -168.541 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . 0.573 0.1 OUTLIER -50.46 -34.25 24.17 Favored 'General case' 0 CA--C 1.575 1.907 0 CA-C-O 113.67 -3.062 . . . . 0.0 106.33 175.059 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 17.7 mt -66.4 -49.93 65.16 Favored 'General case' 0 C--N 1.378 1.812 1 CA-C-N 127.288 4.585 . . . . 0.0 116.8 164.227 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -58.43 -41.36 84.85 Favored 'General case' 0 N--CA 1.492 1.627 0 N-CA-C 114.983 1.475 . . . . 0.0 114.983 178.393 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 2.6 tt -71.8 -31.07 40.03 Favored 'Isoleucine or valine' 0 CA--C 1.567 1.622 0 CA-C-O 114.066 -2.873 . . . . 0.0 116.972 161.398 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 3.3 t -77.9 -45.72 27.48 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.291 0 CA-C-N 124.717 3.417 . . . . 0.0 112.156 -179.979 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 23.8 mt-30 -52.74 -43.25 65.6 Favored 'General case' 0 CA--C 1.565 1.54 0 C-N-CA 124.362 1.065 . . . . 0.0 113.14 155.272 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . 0.494 2.8 m-20 -57.65 -32.65 67.5 Favored 'General case' 0 N--CA 1.5 2.055 0 N-CA-C 118.938 2.94 . . . . 0.0 118.938 155.089 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -76.87 -52.7 8.99 Favored 'General case' 0 CA--C 1.551 1.001 0 O-C-N 119.635 -1.916 . . . . 0.0 112.803 -167.372 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . 0.26 3.2 pp -87.53 -8.08 56.8 Favored 'General case' 0 N--CA 1.496 1.853 0 N-CA-C 118.772 2.879 . . . . 0.0 118.772 163.48 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 34.3 t -146.15 43.88 1.23 Allowed 'General case' 0 CA--C 1.576 1.976 0 CA-C-N 121.972 2.169 . . . . 0.0 116.224 177.332 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . 0.292 8.1 ptmt -50.74 -47.96 84.31 Favored Pre-proline 0 N--CA 1.507 2.398 1 N-CA-C 124.369 4.951 . . . . 0.0 124.369 172.024 . . . . . . . . 3 2 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 14.0 Cg_exo -80.16 120.69 4.19 Favored 'Trans proline' 0 CA--C 1.562 1.917 0 CA-C-N 125.88 3.136 . . . . 0.0 118.014 -148.76 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 22.2 t -75.33 143.86 77.19 Favored Pre-proline 0 CA--C 1.585 2.308 0 CA-C-O 117.886 -1.055 . . . . 0.0 111.096 134.204 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 79.9 Cg_endo -72.54 82.62 1.4 Allowed 'Trans proline' 0 CA--C 1.57 2.32 0 C-N-CA 122.664 2.242 . . . . 0.0 115.152 -175.984 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 9.9 p -141.23 -18.49 0.31 Allowed 'Isoleucine or valine' 0 N--CA 1.51 2.575 0 N-CA-C 116.385 1.994 . . . . 0.0 116.385 -171.113 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . 0.286 1.3 t -107.92 99.87 9.28 Favored 'General case' 0 CA--C 1.571 1.759 0 O-C-N 119.664 -1.897 . . . . 0.0 113.645 -127.487 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -152.48 95.71 0.16 Allowed Glycine 0 N--CA 1.491 2.308 0 CA-C-O 117.668 -1.629 . . . . 0.0 113.348 178.372 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . 0.322 0.0 OUTLIER -0.66 122.87 0.0 OUTLIER 'General case' 0 CA--C 1.586 2.339 3 CA-C-N 129.859 6.829 . . . . 0.0 123.776 -1.688 . . . . . . . . 4 3 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . 0.275 25.8 tpt180 -129.52 107.8 9.75 Favored 'General case' 0 N--CA 1.512 2.669 0 CA-C-N 122.159 2.254 . . . . 0.0 115.789 -175.332 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -131.32 172.95 11.56 Favored 'General case' 0 CA--C 1.608 3.203 0 C-N-CA 128.436 2.694 . . . . 0.0 107.063 156.674 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . 0.338 0.0 OUTLIER -82.56 84.91 7.08 Favored 'General case' 0 CA--C 1.553 1.071 2 O-C-N 111.419 -7.05 . . . . 0.0 108.259 -2.087 . . . . . . . . 4 3 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -97.96 -89.8 0.29 Allowed 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 113.802 -1.545 . . . . 0.0 110.528 -156.644 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 29.0 tt0 -14.55 -55.25 0.0 OUTLIER 'General case' 0 CA--C 1.574 1.879 1 N-CA-C 122.013 4.079 . . . . 0.0 122.013 121.186 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . 1.317 0.6 OUTLIER -41.45 -58.01 2.02 Favored 'General case' 0 CA--C 1.551 0.987 1 N-CA-C 124.82 5.118 . . . . 0.0 124.82 166.283 . . . . . . . . 4 3 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . 0.561 96.0 mt -110.98 -2.08 16.1 Favored 'General case' 0 CA--C 1.588 2.408 0 O-C-N 120.524 -1.36 . . . . 0.0 113.195 177.155 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -54.23 -6.43 0.1 Allowed 'General case' 0 N--CA 1.488 1.439 0 O-C-N 116.36 -3.962 . . . . 0.0 120.08 117.48 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . 1.364 11.0 t70 -98.15 -12.98 21.17 Favored 'General case' 0 CA--C 1.586 2.363 0 CA-C-O 127.303 3.43 . . . . 0.0 116.943 163.358 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -56.86 -24.49 51.91 Favored 'General case' 0 CA--C 1.59 2.489 0 CA-C-N 112.151 -2.295 . . . . 0.0 114.846 133.717 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . 0.529 0.0 OUTLIER -71.99 -19.51 61.86 Favored 'General case' 0 CA--C 1.58 2.105 0 CA-C-O 113.458 -3.163 . . . . 0.0 118.198 145.312 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' SER . . . . . . . . . . . . 0.399 0.5 OUTLIER -42.47 -69.59 0.13 Allowed 'General case' 0 N--CA 1.537 3.893 1 CA-C-N 127.314 4.597 . . . . 0.0 113.208 157.025 . . . . . . . . 4 3 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . 0.387 9.4 tp10 -24.74 -21.11 0.0 OUTLIER 'General case' 0 CA--C 1.583 2.216 1 N-CA-C 123.878 4.77 . . . . 0.0 123.878 143.5 . . . . . . . . 3 2 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -129.36 32.66 4.64 Favored 'General case' 0 CA--C 1.603 2.998 0 N-CA-C 118.301 2.704 . . . . 0.0 118.301 148.375 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 33.4 m . . . . . 0 N--CA 1.516 2.842 0 O-C-N 118.356 -2.715 . . . . 0.0 113.098 178.032 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.563 1.456 0 N-CA-C 113.476 0.917 . . . . 0.0 113.476 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 2' ' ' ARG . . . . . . . . . . . . . 34.3 mmt180 -76.01 81.99 2.88 Favored 'General case' 0 N--CA 1.495 1.806 0 CA-C-O 123.166 1.46 . . . . 0.0 113.772 -178.325 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -92.67 0.34 57.41 Favored 'General case' 0 CA--C 1.563 1.448 0 N-CA-C 116.39 1.996 . . . . 0.0 116.39 -178.701 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 4' ' ' ASP . . . . . . . . . . . . 0.32 14.6 p-10 -131.0 72.69 81.71 Favored Pre-proline 0 N--CA 1.492 1.669 0 CA-C-N 121.572 1.987 . . . . 0.0 115.833 178.527 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -60.97 158.81 32.19 Favored 'Trans proline' 0 CA--C 1.569 2.23 0 C-N-CA 123.071 2.514 . . . . 0.0 117.207 163.595 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 6' ' ' HIS . . . . . . . . . . . . . 70.5 m80 -106.6 143.52 34.59 Favored 'General case' 0 CA--C 1.56 1.341 0 CA-C-N 113.555 -1.657 . . . . 0.0 112.402 -167.004 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 7' ' ' PHE . . . . . . . . . . . . . 8.9 p90 -140.63 155.71 46.46 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 120.411 -1.43 . . . . 0.0 111.1 149.166 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 8' ' ' ASN . . . . . . . . . . . . . 14.7 m120 -71.04 90.04 0.83 Allowed 'General case' 0 N--CA 1.489 1.494 0 O-C-N 120.218 -1.551 . . . . 0.0 111.659 168.537 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 9' ' ' PHE . . . . . . . . . . . . . 6.8 t80 -73.31 149.24 42.81 Favored 'General case' 0 CA--C 1.561 1.397 0 CA-C-O 125.121 2.391 . . . . 0.0 110.428 156.822 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 10' ' ' ARG . . . . . . . . . . . . . 34.0 tpt85 -179.78 93.3 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.651 0 O-C-N 119.718 -1.863 . . . . 0.0 107.869 -123.991 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 11' ' ' MET . . . . . . . . . . . . . 1.2 mpt? -130.09 129.88 23.01 Favored Pre-proline 0 CA--C 1.567 1.625 0 CA-C-O 117.302 -1.332 . . . . 0.0 112.805 -153.68 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 12' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_exo -44.89 146.14 2.57 Favored 'Trans proline' 0 CA--C 1.564 2.012 0 C-N-CA 123.082 2.521 . . . . 0.0 116.976 166.867 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 13' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -48.87 -37.53 19.87 Favored 'General case' 0 N--CA 1.496 1.827 0 N-CA-C 118.348 2.721 . . . . 0.0 118.348 -165.554 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 14' ' ' GLU . . . . . . . . . . . . 0.262 8.6 pt-20 -64.29 -48.08 77.05 Favored 'General case' 0 CA--C 1.566 1.572 0 N-CA-C 115.64 1.719 . . . . 0.0 115.64 170.028 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -59.6 -46.97 92.65 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.067 0 CA-C-N 123.408 2.822 . . . . 0.0 112.385 172.052 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.25 -33.86 63.45 Favored 'General case' 0 N--CA 1.475 0.781 0 N-CA-C 116.455 2.02 . . . . 0.0 116.455 177.184 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 17' ' ' GLU . . . . . . . . . . . . . 74.5 mm-40 -65.32 -41.89 93.54 Favored 'General case' 0 N--CA 1.491 1.623 0 CA-C-N 123.611 2.914 . . . . 0.0 113.896 159.742 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . 0.289 50.9 mtmt -62.56 -45.79 91.3 Favored 'General case' 0 CA--C 1.566 1.561 0 CA-C-N 121.912 2.142 . . . . 0.0 115.361 172.241 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 19' ' ' LEU . . . . . . . . . . . . . 13.9 tp -72.65 -34.94 67.61 Favored 'General case' 0 CA--C 1.569 1.696 0 CA-C-N 120.739 1.608 . . . . 0.0 114.399 176.585 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 20' ' ' LYS . . . . . . . . . . . . . 8.5 ttpt -88.21 -30.3 19.83 Favored 'General case' 0 CA--C 1.564 1.488 0 C-N-CA 125.635 1.574 . . . . 0.0 114.388 178.468 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 15.1 m-85 -56.82 -73.59 0.06 Allowed 'General case' 0 N--CA 1.491 1.599 0 CA-C-O 113.581 -3.104 . . . . 0.0 110.46 148.915 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . 0.406 4.9 tmm_? -31.34 -41.68 0.04 OUTLIER 'General case' 0 CA--C 1.594 2.655 0 CA-C-N 125.829 3.922 . . . . 0.0 116.869 173.66 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -57.46 -74.48 0.06 Allowed 'General case' 0 CA--C 1.585 2.316 0 N-CA-C 118.856 2.91 . . . . 0.0 118.856 154.357 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -59.92 -45.82 91.37 Favored 'General case' 0 N--CA 1.504 2.274 0 N-CA-C 118.826 2.899 . . . . 0.0 118.826 175.363 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 25' ' ' ALA . . . . . . . . . . . . . . . -38.98 -51.92 1.79 Allowed 'General case' 0 CA--C 1.587 2.378 0 N-CA-C 116.824 2.157 . . . . 0.0 116.824 159.42 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 26' ' ' ASN . . . . . . . . . . . . . 34.8 m-20 -87.53 -51.75 5.74 Favored 'General case' 0 CA--C 1.575 1.936 0 N-CA-C 115.236 1.569 . . . . 0.0 115.236 179.67 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 27' ' ' GLY . . . . . . . . . . . . . . . 128.61 19.76 1.62 Allowed Glycine 0 CA--C 1.56 2.875 0 N-CA-C 119.275 2.47 . . . . 0.0 119.275 -161.054 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 28' ' ' ARG . . . . . . . . . . . . . 80.0 mtt-85 -116.22 166.49 11.97 Favored 'General case' 0 N--CA 1.495 1.778 0 CA-C-N 121.049 2.425 . . . . 0.0 106.957 167.535 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 29' ' ' SER . . . . . . . . . . . . . 91.1 p -121.14 112.55 18.82 Favored 'General case' 0 N--CA 1.5 2.049 0 O-C-N 118.742 -2.474 . . . . 0.0 105.491 -173.115 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 30' ' ' MET . . . . . . . . . . . . . 38.3 mtp -41.88 -46.14 3.91 Favored 'General case' 0 N--CA 1.499 2.002 0 N-CA-C 119.438 3.125 . . . . 0.0 119.438 -141.436 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 31' ' ' ASN . . . . . . . . . . . . . 25.2 t-20 -43.43 -44.52 5.83 Favored 'General case' 0 CA--C 1.598 2.796 0 CA-C-N 125.245 3.657 . . . . 0.0 115.712 164.179 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 32' ' ' SER . . . . . . . . . . . . 0.282 62.9 m -58.01 -58.23 9.33 Favored 'General case' 0 N--CA 1.498 1.96 0 N-CA-C 120.914 3.672 . . . . 0.0 120.914 149.688 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -64.9 -61.99 1.83 Allowed 'General case' 0 N--CA 1.515 2.795 0 CA-C-N 123.76 2.982 . . . . 0.0 114.835 177.637 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -38.8 -53.96 1.64 Allowed 'General case' 0 CA--C 1.549 0.915 0 CA-C-O 115.004 -2.426 . . . . 0.0 107.934 170.726 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 35' ' ' LEU . . . . . . . . . . . . . 11.1 mt -65.09 -60.31 3.16 Favored 'General case' 0 N--CA 1.485 1.293 0 CA-C-N 124.448 3.295 . . . . 0.0 115.665 -178.156 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 36' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -53.0 -41.46 64.66 Favored 'General case' 0 CA--C 1.558 1.253 0 CA-C-O 117.213 -1.375 . . . . 0.0 113.932 175.073 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 37' ' ' ILE . . . . . . . . . . . . . 1.6 tp -75.08 -24.91 18.0 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.405 0 N-CA-C 116.37 1.989 . . . . 0.0 116.37 173.165 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 38' ' ' VAL . . . . . . . . . . . . . 2.2 t -81.15 -49.76 17.65 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.809 0 C-N-CA 127.487 2.315 . . . . 0.0 111.03 175.643 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 9.7 tt0 -44.27 -47.88 9.45 Favored 'General case' 0 CA--C 1.559 1.3 0 C-N-CA 124.771 1.229 . . . . 0.0 113.649 153.814 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 40' ' ' ASP . . . . . . . . . . . . 0.582 0.7 OUTLIER -53.09 -59.01 5.09 Favored 'General case' 0 CA--C 1.553 1.081 0 N-CA-C 116.092 1.886 . . . . 0.0 116.092 157.317 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -67.4 -37.34 82.96 Favored 'General case' 0 CA--C 1.555 1.147 0 N-CA-C 116.591 2.071 . . . . 0.0 116.591 -159.465 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . 0.331 1.2 pp -89.05 -25.28 22.03 Favored 'General case' 0 N--CA 1.49 1.553 0 N-CA-C 119.321 3.082 . . . . 0.0 119.321 157.418 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 43' ' ' SER . . . . . . . . . . . . . 49.4 m -150.54 53.01 0.88 Allowed 'General case' 0 N--CA 1.496 1.828 0 CA-C-N 123.116 2.689 . . . . 0.0 116.831 -176.09 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 44' ' ' LYS . . . . . . . . . . . . 0.275 67.3 mttm -131.58 104.66 14.48 Favored Pre-proline 0 N--CA 1.518 2.939 0 N-CA-C 117.521 2.415 . . . . 0.0 117.521 158.229 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 8.3 Cg_exo -66.64 163.35 33.25 Favored 'Trans proline' 0 CA--C 1.572 2.397 0 C-N-CA 122.453 2.102 . . . . 0.0 115.032 143.427 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 46' ' ' SER . . . . . . . . . . . . . 57.9 m -147.55 -77.16 0.01 OUTLIER Pre-proline 0 N--CA 1.497 1.882 0 CA-C-O 115.519 -2.182 . . . . 0.0 110.837 163.271 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 78.6 Cg_endo -74.98 77.51 3.1 Favored 'Trans proline' 0 CA--C 1.567 2.154 0 CA-C-N 125.978 3.171 . . . . 0.0 111.608 164.597 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 48' ' ' VAL . . . . . . . . . . . . 0.295 12.0 p -81.93 68.38 0.52 Allowed 'Isoleucine or valine' 0 N--CA 1.5 2.05 0 CA-C-O 123.924 1.821 . . . . 0.0 114.54 -166.163 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 49' ' ' THR . . . . . . . . . . . . . 44.0 p -121.33 71.52 0.96 Allowed 'General case' 0 N--CA 1.496 1.847 0 CA-C-N 114.051 -1.431 . . . . 0.0 109.68 -163.517 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 50' ' ' GLY . . . . . . . . . . . . . . . 78.36 45.87 9.51 Favored Glycine 0 N--CA 1.497 2.741 0 N-CA-C 116.65 1.42 . . . . 0.0 116.65 -164.81 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 51' ' ' TYR . . . . . . . . . . . . 0.375 0.0 OUTLIER -88.29 -28.99 20.71 Favored 'General case' 0 CA--C 1.593 2.613 0 N-CA-C 116.597 2.073 . . . . 0.0 116.597 -161.225 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 52' ' ' ARG . . . . . . . . . . . . 0.722 39.1 ttt180 127.01 -115.9 0.0 OUTLIER 'General case' 0 N--CA 1.523 3.225 0 N-CA-C 119.331 3.086 . . . . 0.0 119.331 149.919 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 6.7 p-10 178.37 155.07 0.38 Allowed 'General case' 0 N--CA 1.501 2.079 2 O-C-N 110.968 -7.333 . . . . 0.0 120.564 16.8 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . 1.848 0.0 OUTLIER -48.7 19.88 0.0 OUTLIER 'General case' 0 N--CA 1.498 1.974 1 N-CA-C 123.111 4.486 . . . . 0.0 123.111 165.879 . . . . . . . . 4 3 . 1 . 015 nuclear orig full ' B' B ' 55' ' ' ALA . . . . . . . . . . . . 0.309 . . -82.77 -7.84 59.63 Favored 'General case' 0 CA--C 1.574 1.872 0 O-C-N 118.705 -2.497 . . . . 0.0 115.222 142.441 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 -45.88 -3.11 0.01 OUTLIER 'General case' 0 CA--C 1.592 2.588 1 N-CA-C 123.075 4.472 . . . . 0.0 123.075 120.563 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 57' ' ' ARG . . . . . . . . . . . . 0.266 16.9 ttt-85 -112.29 -50.43 2.9 Favored 'General case' 0 N--CA 1.501 2.088 0 O-C-N 119.105 -2.247 . . . . 0.0 111.455 -177.866 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 58' ' ' LEU . . . . . . . . . . . . 0.252 1.7 mt -49.89 -35.53 23.91 Favored 'General case' 0 CA--C 1.586 2.362 0 CA-C-N 114.936 -1.029 . . . . 0.0 112.513 155.701 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 59' ' ' ALA . . . . . . . . . . . . . . . -44.78 -78.27 0.02 OUTLIER 'General case' 0 N--CA 1.488 1.441 0 N-CA-C 117.779 2.511 . . . . 0.0 117.779 143.938 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -87.68 4.13 45.2 Favored 'General case' 0 N--CA 1.489 1.496 0 N-CA-C 117.705 2.483 . . . . 0.0 117.705 -163.586 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 19.1 tt0 -91.9 -28.93 16.96 Favored 'General case' 0 CA--C 1.559 1.293 0 CA-C-O 116.165 -1.874 . . . . 0.0 112.609 150.831 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 62' ' ' GLN . . . . . . . . . . . . 0.29 0.0 OUTLIER -78.69 -59.49 2.76 Favored 'General case' 0 C--N 1.37 1.469 0 CA-C-N 124.982 3.537 . . . . 0.0 109.086 176.551 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 48.3 t -107.58 71.79 0.83 Allowed 'General case' 0 CA--C 1.552 1.046 0 CA-C-O 122.838 1.304 . . . . 0.0 111.81 160.12 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 64' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -82.01 -58.39 2.99 Favored 'General case' 0 CA--C 1.563 1.459 0 O-C-N 118.524 -2.61 . . . . 0.0 116.925 77.254 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 18.2 mt -75.86 -4.96 43.69 Favored 'General case' 0 N--CA 1.506 2.328 0 N-CA-C 118.351 2.723 . . . . 0.0 118.351 -151.781 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 66' ' ' VAL . . . . . . . . . . . . 0.271 32.5 m . . . . . 0 N--CA 1.508 2.444 0 N-CA-C 117.611 2.449 . . . . 0.0 117.611 167.293 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 2.5 p30 . . . . . 0 CA--C 1.567 1.606 0 CA-C-O 118.756 -0.64 . . . . 0.0 112.074 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 5.7 Cg_exo -87.89 148.55 7.04 Favored 'Trans proline' 0 CA--C 1.549 1.247 0 C-N-CA 122.486 2.124 . . . . 0.0 114.676 -170.704 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 37.8 m80 -73.57 141.3 46.66 Favored 'General case' 0 CA--C 1.561 1.394 0 CA-C-N 113.384 -1.734 . . . . 0.0 113.355 173.555 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 7' ' ' PHE . . . . . 0.758 ' CZ ' HD12 ' B' ' 34' ' ' LEU . 24.3 p90 -125.93 163.81 22.15 Favored 'General case' 0 CA--C 1.559 1.317 0 O-C-N 120.035 -1.666 . . . . 0.0 111.2 115.807 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 1.1 p-10 -73.98 91.08 2.0 Favored 'General case' 0 CA--C 1.567 1.604 0 O-C-N 120.106 -1.621 . . . . 0.0 110.398 159.525 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' PHE . . . . . 0.631 ' CD2' HD13 ' B' ' 34' ' ' LEU . 4.1 t80 -66.99 168.07 10.62 Favored 'General case' 0 CA--C 1.559 1.325 0 CA-C-O 124.049 1.88 . . . . 0.0 110.489 154.274 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 9.6 tpt180 163.28 109.03 0.0 OUTLIER 'General case' 0 N--CA 1.488 1.443 0 O-C-N 119.724 -1.86 . . . . 0.0 106.211 -120.173 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' MET . . . . . 0.641 ' SD ' HD23 ' A' ' 19' ' ' LEU . 13.6 mtm -144.73 123.21 6.75 Favored Pre-proline 0 CA--C 1.562 1.438 0 CA-C-N 114.08 -1.418 . . . . 0.0 108.881 -157.228 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_exo -43.66 147.92 0.99 Allowed 'Trans proline' 0 CA--C 1.562 1.9 0 C-N-CA 122.613 2.209 . . . . 0.0 115.952 159.657 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 1.3 tpt -48.99 -40.79 32.02 Favored 'General case' 0 N--CA 1.494 1.749 0 N-CA-C 117.195 2.294 . . . . 0.0 117.195 -166.942 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 1.1 pm0 -56.77 -49.42 75.34 Favored 'General case' 0 CA--C 1.562 1.406 0 N-CA-C 117.774 2.509 . . . . 0.0 117.774 167.092 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -62.33 -45.54 98.53 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.27 0 CA-C-N 122.721 2.51 . . . . 0.0 113.116 173.891 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -78.15 -23.91 47.55 Favored 'General case' 0 CA--C 1.552 1.055 0 N-CA-C 116.51 2.041 . . . . 0.0 116.51 176.532 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 51.0 mt-10 -68.67 -38.52 80.44 Favored 'General case' 0 CA--C 1.559 1.296 0 CA-C-N 121.579 1.99 . . . . 0.0 114.33 154.089 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . 0.608 11.5 pttt -81.39 -35.09 31.19 Favored 'General case' 0 N--CA 1.497 1.907 0 CA-C-N 124.487 3.312 . . . . 0.0 117.142 177.68 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.641 HD23 ' SD ' ' A' ' 11' ' ' MET 0.293 12.6 tp -63.92 -39.13 93.46 Favored 'General case' 0 CA--C 1.567 1.606 0 O-C-N 120.193 -1.567 . . . . 0.0 114.83 159.735 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.576 ' HB2' ' SD ' ' A' ' 30' ' ' MET . 20.0 ttpt -89.08 -20.78 23.91 Favored 'General case' 0 CA--C 1.568 1.656 0 CA-C-O 115.167 -2.349 . . . . 0.0 117.027 175.887 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -102.83 6.5 39.25 Favored 'General case' 0 N--CA 1.529 3.493 0 N-CA-C 119.987 3.329 . . . . 0.0 119.987 164.358 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.509 ' O ' ' N ' ' A' ' 24' ' ' GLU . 2.2 tpp180 -72.71 -140.46 0.01 OUTLIER 'General case' 0 C--N 1.308 -1.205 0 CA-C-O 115.218 -2.325 . . . . 0.0 111.798 106.984 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.585 ' HB2' ' HB3' ' A' ' 33' ' ' GLU 0.66 . . 39.12 -48.32 0.0 OUTLIER 'General case' 0 CA--C 1.593 2.605 1 CA-C-N 127.101 4.5 . . . . 0.0 120.085 -163.865 . . . . . . . . 4 3 . 1 . 001 nuclear build core ' A' A ' 24' ' ' GLU . . . . . 0.509 ' N ' ' O ' ' A' ' 22' ' ' ARG . 2.5 tt0 . . . . . 0 N--CA 1.496 1.857 1 O-C-N 115.878 -4.264 . . . . 0.0 119.987 121.481 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.424 ' O ' ' HB2' ' A' ' 33' ' ' GLU 0.398 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.401 0 N-CA-C 105.864 -1.902 . . . . 0.0 105.864 . . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 29' ' ' SER . . . . . 0.528 ' H ' ' HB3' ' A' ' 32' ' ' SER . 32.6 t -102.0 112.55 25.23 Favored 'General case' 0 N--CA 1.488 1.458 0 CA-C-O 115.107 -2.378 . . . . 0.0 106.307 -118.733 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 30' ' ' MET . . . . . 0.576 ' SD ' ' HB2' ' A' ' 20' ' ' LYS . 21.1 mtp -37.45 -41.2 0.42 Allowed 'General case' 0 N--CA 1.506 2.366 0 N-CA-C 120.165 3.394 . . . . 0.0 120.165 -145.811 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 14.5 t-20 -42.1 -51.75 4.49 Favored 'General case' 0 CA--C 1.597 2.771 0 O-C-N 116.867 -3.646 . . . . 0.0 116.142 159.224 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' SER . . . . . 0.528 ' HB3' ' H ' ' A' ' 29' ' ' SER 0.37 24.4 t -46.12 -65.63 0.52 Allowed 'General case' 0 N--CA 1.5 2.042 0 N-CA-C 119.738 3.236 . . . . 0.0 119.738 144.598 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 33' ' ' GLU . . . . . 0.585 ' HB3' ' HB2' ' A' ' 23' ' ' ALA . 0.1 OUTLIER -71.14 -54.54 10.71 Favored 'General case' 0 N--CA 1.512 2.664 0 N-CA-C 119.269 3.063 . . . . 0.0 119.269 -176.789 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.762 HD12 ' CZ ' ' B' ' 7' ' ' PHE . 0.1 OUTLIER -37.46 -52.84 1.16 Allowed 'General case' 0 CA--C 1.55 0.96 0 CA-C-O 115.586 -2.149 . . . . 0.0 108.814 162.855 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.494 ' HG ' ' CE1' ' B' ' 9' ' ' PHE . 12.9 mt -61.96 -51.32 68.57 Favored 'General case' 0 C--N 1.369 1.444 0 CA-C-N 123.036 2.653 . . . . 0.0 115.098 177.091 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . 0.326 1.4 tm0? -67.04 -36.67 82.58 Favored 'General case' 0 CA--C 1.575 1.922 0 CA-C-O 116.081 -1.914 . . . . 0.0 115.022 -178.979 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 8.7 tt -61.97 -44.67 99.24 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.254 0 CA-C-N 124.133 3.151 . . . . 0.0 115.533 154.049 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.497 HG23 ' O ' ' A' ' 34' ' ' LEU . 2.7 t -65.25 -48.23 84.27 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.117 0 CA-C-N 123.351 2.796 . . . . 0.0 112.782 -172.66 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 30.4 mt-30 -48.71 -47.76 40.9 Favored 'General case' 0 CA--C 1.567 1.631 0 C-N-CA 125.571 1.549 . . . . 0.0 114.226 155.685 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . 0.458 2.1 m-20 -52.83 -34.96 56.46 Favored 'General case' 0 CA--C 1.578 2.035 0 N-CA-C 118.68 2.844 . . . . 0.0 118.68 157.475 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 41' ' ' ALA . . . . . 0.425 ' HB3' ' HA ' ' A' ' 38' ' ' VAL . . . . . . . . 0 CA--C 1.55 0.965 0 N-CA-C 113.606 0.965 . . . . 0.0 113.606 -161.909 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo . . . . . 0 CA--C 1.555 1.543 0 N-CA-C 116.891 1.843 . . . . 0.0 116.891 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' B' B ' 6' ' ' HIS . . . . . . . . . . . . . 71.9 m80 -77.14 136.67 38.61 Favored 'General case' 0 CA--C 1.577 2.0 0 CA-C-N 113.615 -1.63 . . . . 0.0 111.859 164.222 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 7' ' ' PHE . . . . . 0.762 ' CZ ' HD12 ' A' ' 34' ' ' LEU . 1.2 p90 -136.28 158.1 45.22 Favored 'General case' 0 CA--C 1.57 1.746 0 O-C-N 119.869 -1.769 . . . . 0.0 111.87 150.036 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 8' ' ' ASN . . . . . . . . . . . . . 80.8 m-20 -69.35 103.87 2.11 Favored 'General case' 0 CA--C 1.571 1.773 0 O-C-N 120.374 -1.454 . . . . 0.0 113.033 174.622 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 9' ' ' PHE . . . . . 0.636 ' CG ' HD13 ' A' ' 34' ' ' LEU . 6.8 t80 -120.65 104.81 10.22 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 124.31 1.044 . . . . 0.0 108.318 160.334 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 10' ' ' ARG . . . . . . . . . . . . 0.438 0.1 OUTLIER 91.75 86.9 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.737 1 O-C-N 113.503 -5.748 . . . . 0.0 111.2 -9.779 . . . . . . . . 4 3 . 1 . 001 nuclear build core ' B' B ' 11' ' ' MET . . . . . 0.461 ' HE2' ' CD2' ' B' ' 9' ' ' PHE . 16.4 mtm -155.93 126.7 3.5 Favored Pre-proline 0 CA--C 1.572 1.808 0 CA-C-O 116.894 -1.527 . . . . 0.0 110.241 -154.777 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 12' ' ' PRO . . . . . . . . . . . . . 87.0 Cg_exo -42.55 147.55 0.56 Allowed 'Trans proline' 0 C--N 1.373 1.828 0 C-N-CA 123.788 2.992 . . . . 0.0 117.751 168.941 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 13' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -44.33 -53.17 6.99 Favored 'General case' 0 N--CA 1.493 1.723 0 N-CA-C 118.105 2.632 . . . . 0.0 118.105 -162.851 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -62.1 -39.26 91.89 Favored 'General case' 0 CA--C 1.561 1.375 0 N-CA-C 116.793 2.145 . . . . 0.0 116.793 173.034 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -59.98 -52.25 63.34 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.181 0 CA-C-N 123.509 2.868 . . . . 0.0 111.604 170.423 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -72.14 -30.04 64.64 Favored 'General case' 0 CA--C 1.553 1.07 0 N-CA-C 116.364 1.987 . . . . 0.0 116.364 179.152 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 17' ' ' GLU . . . . . . . . . . . . . 38.3 mt-10 -61.54 -49.25 77.45 Favored 'General case' 0 N--CA 1.492 1.674 0 CA-C-N 122.4 2.364 . . . . 0.0 114.086 155.333 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . 0.255 51.0 mtmt -58.48 -49.54 76.98 Favored 'General case' 0 N--CA 1.489 1.492 0 CA-C-N 122.055 2.207 . . . . 0.0 115.748 174.026 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 19' ' ' LEU . . . . . 0.519 ' HB3' ' CE ' ' B' ' 30' ' ' MET 0.266 0.5 OUTLIER -66.21 -35.82 81.44 Favored 'General case' 0 CA--C 1.571 1.761 0 C-N-CA 125.574 1.55 . . . . 0.0 114.766 174.218 . . . . . . . . 4 4 . 1 . 001 nuclear build core ' B' B ' 20' ' ' LYS . . . . . . . . . . . . . 15.9 ttpt -87.33 -31.2 20.3 Favored 'General case' 0 CA--C 1.564 1.492 0 N-CA-C 114.502 1.297 . . . . 0.0 114.502 178.201 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 13.8 m-85 -59.05 -72.29 0.1 Allowed 'General case' 0 N--CA 1.487 1.409 0 CA-C-O 114.855 -2.498 . . . . 0.0 110.956 155.014 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 22' ' ' ARG . . . . . 0.411 ' O ' ' HB3' ' B' ' 26' ' ' ASN 0.299 13.2 ttt85 -23.83 -50.28 0.02 OUTLIER 'General case' 0 CA--C 1.59 2.496 0 CA-C-N 125.098 3.59 . . . . 0.0 117.043 166.514 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 23' ' ' ALA . . . . . 0.448 ' HB2' ' CB ' ' B' ' 33' ' ' GLU 0.272 . . -53.78 -76.23 0.03 OUTLIER 'General case' 0 CA--C 1.587 2.383 0 N-CA-C 119.332 3.086 . . . . 0.0 119.332 154.849 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 51.1 mm-40 -71.11 -39.29 72.16 Favored 'General case' 0 CA--C 1.578 2.027 0 N-CA-C 119.229 3.048 . . . . 0.0 119.229 -178.351 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 25' ' ' ALA . . . . . . . . . . . . . . . -40.72 -49.87 3.08 Favored 'General case' 0 CA--C 1.578 2.053 0 N-CA-C 117.304 2.335 . . . . 0.0 117.304 154.938 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 26' ' ' ASN . . . . . 0.411 ' HB3' ' O ' ' B' ' 22' ' ' ARG 0.303 0.1 OUTLIER -117.3 -36.71 3.68 Favored 'General case' 0 CA--C 1.578 2.028 0 N-CA-C 115.454 1.65 . . . . 0.0 115.454 -156.386 . . . . . . . . 4 4 . 1 . 001 nuclear build core ' B' B ' 27' ' ' GLY . . . . . . . . . . . . . . . 131.64 31.75 0.5 Allowed Glycine 0 N--CA 1.496 2.674 0 N-CA-C 119.041 2.377 . . . . 0.0 119.041 172.825 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 28' ' ' ARG . . . . . 0.646 ' HE ' ' HB3' ' B' ' 36' ' ' GLN 0.343 3.2 mtm-85 -131.09 164.19 25.99 Favored 'General case' 0 CA--C 1.585 2.299 0 N-CA-C 103.647 -2.723 . . . . 0.0 103.647 168.177 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 29' ' ' SER . . . . . . . . . . . . . 89.9 p -127.41 107.59 10.09 Favored 'General case' 0 N--CA 1.511 2.623 1 O-C-N 116.064 -4.148 . . . . 0.0 108.2 -168.053 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 30' ' ' MET . . . . . 0.519 ' CE ' ' HB3' ' B' ' 19' ' ' LEU . 24.2 mtp -42.88 -42.81 3.81 Favored 'General case' 0 N--CA 1.498 1.972 0 N-CA-C 119.476 3.139 . . . . 0.0 119.476 -133.339 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 31' ' ' ASN . . . . . . . . . . . . 0.274 0.1 OUTLIER -49.28 -43.1 42.83 Favored 'General case' 0 CA--C 1.593 2.608 0 O-C-N 116.712 -3.742 . . . . 0.0 114.966 165.383 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 32' ' ' SER . . . . . . . . . . . . 0.29 27.2 t -50.47 -73.38 0.04 OUTLIER 'General case' 0 N--CA 1.501 2.124 0 N-CA-C 117.54 2.422 . . . . 0.0 117.54 141.927 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 33' ' ' GLU . . . . . 0.448 ' CB ' ' HB2' ' B' ' 23' ' ' ALA . 5.2 tm-20 -65.05 -49.0 71.8 Favored 'General case' 0 N--CA 1.506 2.346 0 N-CA-C 119.598 3.184 . . . . 0.0 119.598 -171.274 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 34' ' ' LEU . . . . . 0.758 HD12 ' CZ ' ' A' ' 7' ' ' PHE . 0.1 OUTLIER -41.51 -57.01 2.36 Favored 'General case' 0 CA--C 1.556 1.198 0 CA-C-O 115.495 -2.193 . . . . 0.0 108.628 158.926 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 35' ' ' LEU . . . . . . . . . . . . . 11.9 mt -60.93 -48.34 82.29 Favored 'General case' 0 N--CA 1.491 1.596 0 CA-C-N 124.44 3.291 . . . . 0.0 116.392 179.058 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 36' ' ' GLN . . . . . 0.646 ' HB3' ' HE ' ' B' ' 28' ' ' ARG . 0.0 OUTLIER -68.46 -34.56 76.16 Favored 'General case' 0 N--CA 1.478 0.964 0 CA-C-O 116.748 -1.596 . . . . 0.0 114.023 178.726 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 37' ' ' ILE . . . . . . . . . . . . . 2.0 tp -70.84 -27.94 32.12 Favored 'Isoleucine or valine' 0 CA--C 1.567 1.602 0 CA-C-O 115.836 -2.031 . . . . 0.0 115.363 163.191 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 38' ' ' VAL . . . . . 0.474 HG21 HD22 ' B' ' 34' ' ' LEU . 2.6 t -86.38 -52.96 11.26 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.194 0 C-N-CA 127.812 2.445 . . . . 0.0 110.917 -174.55 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 33.9 mt-30 -52.96 -37.67 61.36 Favored 'General case' 0 CA--C 1.562 1.427 0 CA-C-O 117.922 -1.037 . . . . 0.0 112.901 156.401 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 40' ' ' ASP . . . . . . . . . . . . 0.322 54.0 t0 -55.78 -54.63 42.13 Favored 'General case' 0 N--CA 1.49 1.548 0 N-CA-C 117.567 2.432 . . . . 0.0 117.567 154.516 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 41' ' ' ALA . . . . . . . . . . . . 0.315 . . -64.17 -40.43 96.11 Favored 'General case' 0 CA--C 1.558 1.253 0 N-CA-C 116.215 1.932 . . . . 0.0 116.215 -167.747 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 42' ' ' LEU . . . . . 0.495 ' HB3' HH21 ' A' ' 22' ' ' ARG . 2.6 pp . . . . . 0 N--CA 1.49 1.549 0 N-CA-C 118.176 2.658 . . . . 0.0 118.176 171.65 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 1.8 p30 . . . . . 0 CA--C 1.567 1.601 0 CA-C-O 118.594 -0.717 . . . . 0.0 112.178 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_exo -97.31 136.84 0.43 Allowed 'Trans proline' 0 CA--C 1.552 1.411 0 CA-C-N 122.296 1.856 . . . . 0.0 113.256 -161.995 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 75.2 m80 -81.1 122.01 26.81 Favored 'General case' 0 CA--C 1.573 1.841 0 CA-C-N 114.263 -1.335 . . . . 0.0 110.571 174.539 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 7' ' ' PHE . . . . . 0.781 ' CZ ' HD12 ' B' ' 34' ' ' LEU . 1.5 p90 -125.56 157.82 36.14 Favored 'General case' 0 CA--C 1.567 1.631 0 O-C-N 119.984 -1.698 . . . . 0.0 112.184 159.408 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 83.9 m-20 -68.96 103.45 1.83 Allowed 'General case' 0 CA--C 1.57 1.723 0 O-C-N 120.893 -1.129 . . . . 0.0 112.613 176.034 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 9' ' ' PHE . . . . . 0.622 ' CG ' HD13 ' B' ' 34' ' ' LEU . 5.6 t80 -124.47 104.95 9.03 Favored 'General case' 0 CA--C 1.537 0.48 0 N-CA-C 107.328 -1.36 . . . . 0.0 107.328 162.337 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . 0.478 0.1 OUTLIER 93.93 85.55 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.781 1 O-C-N 113.686 -5.634 . . . . 0.0 110.843 -12.54 . . . . . . . . 4 3 . 1 . 002 nuclear build core ' A' A ' 11' ' ' MET . . . . . 0.482 ' HG2' HD21 ' B' ' 35' ' ' LEU . 15.7 mtt -157.14 134.33 6.74 Favored Pre-proline 0 CA--C 1.57 1.738 0 CA-C-O 117.777 -1.106 . . . . 0.0 111.813 -154.715 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 67.8 Cg_exo -49.4 156.35 2.76 Favored 'Trans proline' 0 CA--C 1.564 2.022 0 C-N-CA 123.106 2.537 . . . . 0.0 118.277 167.191 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 9.0 tpp -62.7 -41.65 99.24 Favored 'General case' 0 N--CA 1.488 1.443 0 N-CA-C 116.793 2.146 . . . . 0.0 116.793 -161.579 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 -61.23 -38.72 87.64 Favored 'General case' 0 CA--C 1.565 1.54 0 N-CA-C 115.991 1.848 . . . . 0.0 115.991 165.635 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.457 ' CG1' HG12 ' B' ' 38' ' ' VAL . 1.5 t -58.46 -43.85 87.64 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.077 0 CA-C-N 122.267 2.303 . . . . 0.0 114.983 175.943 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . 0.535 0.1 OUTLIER -117.73 22.25 12.44 Favored 'General case' 0 N--CA 1.483 1.205 0 N-CA-C 119.35 3.093 . . . . 0.0 119.35 171.922 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -66.75 -45.62 77.99 Favored 'General case' 0 CA--C 1.565 1.537 0 O-C-N 118.54 -2.6 . . . . 0.0 113.278 121.201 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . 0.256 46.2 mtmt -63.8 -52.6 59.54 Favored 'General case' 0 N--CA 1.489 1.494 0 CA-C-N 122.535 2.425 . . . . 0.0 116.079 177.454 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.538 HD21 ' CD2' ' A' ' 34' ' ' LEU . 11.7 tp -68.36 -35.55 77.9 Favored 'General case' 0 CA--C 1.564 1.494 0 C-N-CA 124.945 1.298 . . . . 0.0 113.556 173.078 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 2.3 ttpt -87.02 -24.02 24.79 Favored 'General case' 0 CA--C 1.572 1.813 0 CA-C-N 121.309 1.868 . . . . 0.0 114.31 178.667 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 13.9 m-85 -65.34 -68.87 0.33 Allowed 'General case' 0 N--CA 1.488 1.456 0 CA-C-O 114.365 -2.731 . . . . 0.0 111.15 154.887 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . 0.291 24.4 ttt180 -25.46 -48.53 0.02 OUTLIER 'General case' 0 CA--C 1.591 2.528 0 CA-C-N 125.363 3.71 . . . . 0.0 115.94 165.521 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -57.58 -76.56 0.04 OUTLIER 'General case' 0 CA--C 1.589 2.476 0 N-CA-C 117.523 2.416 . . . . 0.0 117.523 157.446 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 36.7 mt-10 . . . . . 0 N--CA 1.507 2.378 0 N-CA-C 118.512 2.782 . . . . 0.0 118.512 178.201 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 37.5 mtm-85 . . . . . 0 CA--C 1.572 1.797 0 N-CA-C 106.546 -1.649 . . . . 0.0 106.546 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 29' ' ' SER . . . . . 0.434 ' H ' ' HB2' ' A' ' 32' ' ' SER . 33.5 m -122.77 113.34 19.05 Favored 'General case' 0 N--CA 1.503 2.206 0 O-C-N 118.457 -2.652 . . . . 0.0 104.835 -176.478 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 30' ' ' MET . . . . . 0.43 ' HE3' ' HB3' ' A' ' 19' ' ' LEU . 24.4 mtp -44.54 -41.27 6.31 Favored 'General case' 0 N--CA 1.501 2.105 0 N-CA-C 119.486 3.143 . . . . 0.0 119.486 -143.408 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -48.0 -41.53 25.63 Favored 'General case' 0 CA--C 1.595 2.682 0 CA-C-N 124.794 3.452 . . . . 0.0 115.071 165.226 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 32' ' ' SER . . . . . 0.434 ' HB2' ' H ' ' A' ' 29' ' ' SER 0.291 67.3 m -55.31 -61.34 2.4 Favored 'General case' 0 N--CA 1.503 2.201 0 N-CA-C 120.686 3.587 . . . . 0.0 120.686 145.98 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 11.5 tp10 -62.78 -60.56 3.33 Favored 'General case' 0 N--CA 1.523 3.217 0 CA-C-N 125.096 3.589 . . . . 0.0 115.731 178.709 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.733 HD12 ' CZ ' ' B' ' 7' ' ' PHE . 0.1 OUTLIER -41.16 -55.29 2.68 Favored 'General case' 0 CA--C 1.546 0.816 0 CA-C-O 115.587 -2.149 . . . . 0.0 108.214 170.473 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 15.9 mt -61.66 -51.19 69.46 Favored 'General case' 0 C--N 1.37 1.489 0 CA-C-N 123.074 2.67 . . . . 0.0 114.412 176.528 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 1.7 tm0? -54.49 -42.28 70.56 Favored 'General case' 0 CA--C 1.567 1.632 0 N-CA-C 115.675 1.732 . . . . 0.0 115.675 175.68 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 5.3 tp -72.92 -29.16 28.46 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.958 0 CA-C-N 122.301 2.319 . . . . 0.0 116.636 166.484 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.495 ' HA ' ' HB3' ' A' ' 41' ' ' ALA . 8.1 t -80.01 -50.11 18.15 Favored 'Isoleucine or valine' 0 CA--C 1.58 2.118 0 C-N-CA 126.683 1.993 . . . . 0.0 110.042 -178.238 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 26.0 mt-30 -48.09 -40.96 24.96 Favored 'General case' 0 N--CA 1.488 1.429 0 N-CA-C 114.476 1.287 . . . . 0.0 114.476 153.836 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . 0.335 79.2 m-20 -50.5 -62.73 1.42 Allowed 'General case' 0 N--CA 1.491 1.595 0 CA-C-N 120.415 1.461 . . . . 0.0 114.142 154.029 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 41' ' ' ALA . . . . . 0.495 ' HB3' ' HA ' ' A' ' 38' ' ' VAL 0.285 . . . . . . . 0 CA--C 1.562 1.409 0 N-CA-C 119.184 3.031 . . . . 0.0 119.184 -171.326 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 4.8 Cg_exo . . . . . 0 CA--C 1.553 1.461 0 CA-C-O 122.889 1.12 . . . . 0.0 113.123 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' B' B ' 6' ' ' HIS . . . . . . . . . . . . . 76.3 m80 -76.7 141.14 41.02 Favored 'General case' 0 CA--C 1.56 1.347 0 CA-C-N 113.517 -1.674 . . . . 0.0 113.184 -178.157 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 7' ' ' PHE . . . . . 0.733 ' CZ ' HD12 ' A' ' 34' ' ' LEU 0.266 27.7 p90 -121.29 167.54 12.62 Favored 'General case' 0 CA--C 1.564 1.497 0 O-C-N 119.838 -1.789 . . . . 0.0 110.285 116.972 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 8' ' ' ASN . . . . . . . . . . . . . 16.7 m120 -84.39 94.01 8.4 Favored 'General case' 0 N--CA 1.486 1.354 0 O-C-N 119.479 -2.013 . . . . 0.0 108.062 164.211 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 9' ' ' PHE . . . . . 0.642 ' CD2' HD13 ' A' ' 34' ' ' LEU . 5.7 t80 -68.41 162.73 24.79 Favored 'General case' 0 CA--C 1.557 1.229 0 CA-C-O 124.486 2.089 . . . . 0.0 110.824 158.957 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 10' ' ' ARG . . . . . . . . . . . . . 28.1 tpt85 177.08 97.93 0.01 OUTLIER 'General case' 0 N--CA 1.486 1.374 0 CA-C-N 113.385 -1.734 . . . . 0.0 106.713 -126.463 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 11' ' ' MET . . . . . 0.517 ' SD ' ' CD2' ' B' ' 9' ' ' PHE . 0.7 OUTLIER -122.64 120.51 27.81 Favored Pre-proline 0 CA--C 1.563 1.47 0 CA-C-O 117.049 -1.453 . . . . 0.0 110.864 -161.269 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 12' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_exo -44.91 149.78 1.08 Allowed 'Trans proline' 0 CA--C 1.566 2.123 0 CA-C-N 123.702 2.358 . . . . 0.0 116.051 159.942 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 13' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -54.14 -41.96 68.98 Favored 'General case' 0 N--CA 1.498 1.964 0 N-CA-C 117.374 2.361 . . . . 0.0 117.374 -157.501 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 9.1 pt-20 -63.46 -39.26 93.99 Favored 'General case' 0 CA--C 1.564 1.508 0 N-CA-C 116.54 2.052 . . . . 0.0 116.54 168.747 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 15' ' ' VAL . . . . . 0.437 ' CG1' HG12 ' A' ' 38' ' ' VAL . 0.8 OUTLIER -61.16 -46.38 96.75 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.091 0 CA-C-N 123.04 2.655 . . . . 0.0 113.421 172.259 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 2.1 ttt180 -74.7 -39.99 61.62 Favored 'General case' 0 C--O 1.218 -0.592 0 CA-C-O 116.353 -1.784 . . . . 0.0 115.027 174.419 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 17' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -58.91 -38.13 78.21 Favored 'General case' 0 CA--C 1.566 1.585 0 CA-C-N 123.386 2.812 . . . . 0.0 114.371 163.604 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . 0.309 50.5 mtmt -67.93 -50.04 58.37 Favored 'General case' 0 CA--C 1.566 1.591 0 CA-C-N 121.6 2.0 . . . . 0.0 115.227 170.347 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 19' ' ' LEU . . . . . 0.639 ' HG ' ' SD ' ' B' ' 30' ' ' MET 0.322 13.3 tp -67.82 -37.77 82.39 Favored 'General case' 0 CA--C 1.574 1.872 0 CA-C-N 121.024 1.738 . . . . 0.0 114.336 174.458 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 20' ' ' LYS . . . . . . . . . . . . . 29.2 ttpt -88.5 -27.02 21.74 Favored 'General case' 0 CA--C 1.566 1.595 0 O-C-N 120.466 -1.396 . . . . 0.0 113.996 -179.988 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 19.9 m-30 -62.59 -70.5 0.2 Allowed 'General case' 0 N--CA 1.493 1.684 0 CA-C-O 113.607 -3.092 . . . . 0.0 110.27 155.326 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . 0.288 53.5 ttt180 -20.5 -53.07 0.01 OUTLIER 'General case' 0 CA--C 1.593 2.624 0 CA-C-N 125.751 3.887 . . . . 0.0 116.882 165.016 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 23' ' ' ALA . . . . . 0.491 ' HB2' ' CB ' ' B' ' 33' ' ' GLU . . . -54.22 -75.74 0.03 OUTLIER 'General case' 0 CA--C 1.589 2.475 0 N-CA-C 119.06 2.985 . . . . 0.0 119.06 157.091 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 -68.95 -39.13 79.69 Favored 'General case' 0 N--CA 1.502 2.137 0 N-CA-C 118.897 2.925 . . . . 0.0 118.897 -179.55 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 25' ' ' ALA . . . . . . . . . . . . . . . -38.97 -48.96 1.66 Allowed 'General case' 0 CA--C 1.581 2.137 0 N-CA-C 116.92 2.193 . . . . 0.0 116.92 156.08 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 26' ' ' ASN . . . . . . . . . . . . 0.299 0.0 OUTLIER -112.19 -47.8 3.08 Favored 'General case' 0 CA--C 1.578 2.047 0 N-CA-C 115.066 1.506 . . . . 0.0 115.066 -163.036 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 27' ' ' GLY . . . . . . . . . . . . . . . 148.66 44.65 0.03 OUTLIER Glycine 0 N--CA 1.5 2.926 0 N-CA-C 118.189 2.036 . . . . 0.0 118.189 176.472 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 28' ' ' ARG . . . . . 0.429 ' HE ' ' HG2' ' B' ' 33' ' ' GLU 0.334 1.1 ptt180 -156.92 153.44 28.12 Favored 'General case' 0 N--CA 1.495 1.797 0 N-CA-C 105.586 -2.005 . . . . 0.0 105.586 -173.115 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 29' ' ' SER . . . . . . . . . . . . . 75.1 p -119.77 110.5 16.86 Favored 'General case' 0 N--CA 1.502 2.126 0 O-C-N 118.312 -2.743 . . . . 0.0 105.638 -168.547 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 30' ' ' MET . . . . . 0.639 ' SD ' ' HG ' ' B' ' 19' ' ' LEU . 0.0 OUTLIER -39.85 -43.96 1.55 Allowed 'General case' 0 N--CA 1.493 1.703 0 N-CA-C 120.651 3.574 . . . . 0.0 120.651 -143.557 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 31' ' ' ASN . . . . . 0.405 ' O ' ' HB2' ' B' ' 35' ' ' LEU . 12.1 t-20 -44.4 -45.77 9.13 Favored 'General case' 0 CA--C 1.594 2.639 0 CA-C-N 124.029 3.104 . . . . 0.0 114.699 164.42 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 32' ' ' SER . . . . . . . . . . . . 0.326 30.9 t -50.61 -68.54 0.16 Allowed 'General case' 0 N--CA 1.5 2.044 0 N-CA-C 119.591 3.182 . . . . 0.0 119.591 144.561 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 33' ' ' GLU . . . . . 0.491 ' CB ' ' HB2' ' B' ' 23' ' ' ALA . 10.5 tm-20 -60.93 -58.44 8.41 Favored 'General case' 0 N--CA 1.515 2.793 0 N-CA-C 118.508 2.781 . . . . 0.0 118.508 -177.186 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 34' ' ' LEU . . . . . 0.781 HD12 ' CZ ' ' A' ' 7' ' ' PHE . 0.1 OUTLIER -39.91 -54.16 2.22 Favored 'General case' 0 CA--C 1.563 1.448 0 CA-C-O 116.46 -1.733 . . . . 0.0 107.305 166.2 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 35' ' ' LEU . . . . . 0.484 ' HG ' ' CE1' ' A' ' 9' ' ' PHE . 9.3 mt -63.26 -61.79 2.12 Favored 'General case' 0 C--N 1.371 1.53 0 CA-C-N 123.563 2.892 . . . . 0.0 115.977 -174.627 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 36' ' ' GLN . . . . . . . . . . . . 0.489 0.0 OUTLIER -60.76 -25.08 66.23 Favored 'General case' 0 CA--C 1.571 1.757 0 N-CA-C 115.352 1.612 . . . . 0.0 115.352 177.917 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 37' ' ' ILE . . . . . . . . . . . . . 1.9 tp -77.62 -32.57 18.34 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.788 0 CA-C-N 121.788 2.085 . . . . 0.0 116.24 163.833 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 38' ' ' VAL . . . . . 0.623 HG21 HD22 ' B' ' 34' ' ' LEU . 4.3 t -74.38 -50.38 27.45 Favored 'Isoleucine or valine' 0 CA--C 1.572 1.79 0 C-N-CA 127.942 2.497 . . . . 0.0 110.94 178.494 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 30.2 mt-30 -40.1 -49.23 2.57 Favored 'General case' 0 CA--C 1.567 1.601 0 N-CA-C 114.97 1.47 . . . . 0.0 114.97 149.798 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 40' ' ' ASP . . . . . . . . . . . . 0.339 1.5 t0 -57.45 -38.63 74.77 Favored 'General case' 0 CA--C 1.572 1.815 0 N-CA-C 118.241 2.682 . . . . 0.0 118.241 160.903 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 41' ' ' ALA . . . . . 0.555 ' HB3' ' HA ' ' B' ' 38' ' ' VAL . . . -72.99 -34.63 66.54 Favored 'General case' 0 CA--C 1.564 1.515 0 N-CA-C 116.914 2.19 . . . . 0.0 116.914 -176.83 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 42' ' ' LEU . . . . . 0.425 HD11 ' HB2' ' A' ' 19' ' ' LEU . 12.8 mt . . . . . 0 CA--C 1.56 1.334 0 C-N-CA 126.086 1.754 . . . . 0.0 113.185 176.776 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 21.7 p-10 . . . . . 0 CA--C 1.572 1.823 0 CA-C-O 118.72 -0.657 . . . . 0.0 111.241 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 23.6 Cg_exo -84.03 154.75 13.0 Favored 'Trans proline' 0 CA--C 1.557 1.633 0 CA-C-N 122.4 1.893 . . . . 0.0 116.374 -159.661 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 77.1 m80 -86.37 137.08 32.85 Favored 'General case' 0 CA--C 1.561 1.386 0 CA-C-N 114.04 -1.436 . . . . 0.0 113.568 -175.138 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 7' ' ' PHE . . . . . 0.711 ' CZ ' HD12 ' B' ' 34' ' ' LEU . 1.6 p90 -139.28 140.45 37.65 Favored 'General case' 0 N--CA 1.485 1.293 0 O-C-N 120.751 -1.218 . . . . 0.0 108.409 137.583 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 39.9 m-20 -73.92 100.86 3.63 Favored 'General case' 0 CA--C 1.563 1.458 0 O-C-N 120.434 -1.416 . . . . 0.0 111.469 -178.424 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 9' ' ' PHE . . . . . 0.69 ' HD2' HD11 ' A' ' 34' ' ' LEU . 5.3 t80 -79.65 77.0 6.28 Favored 'General case' 0 CA--C 1.576 1.953 0 CA-C-O 127.683 3.611 . . . . 0.0 111.216 169.593 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . 0.283 28.8 ptt180 -47.04 138.65 6.43 Favored 'General case' 0 N--CA 1.478 0.936 0 CA-C-N 109.577 -3.465 . . . . 0.0 118.011 130.238 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 11' ' ' MET . . . . . 0.439 ' HB2' ' HB2' ' A' ' 16' ' ' ARG . 9.1 mtt -147.75 138.07 12.7 Favored Pre-proline 0 CA--C 1.572 1.791 0 CA-C-N 112.928 -1.942 . . . . 0.0 110.204 -176.326 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 87.1 Cg_exo -41.46 142.61 1.08 Allowed 'Trans proline' 0 C--N 1.375 1.944 0 C-N-CA 123.627 2.885 . . . . 0.0 116.497 167.588 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 1.7 tpt -44.3 -38.03 3.64 Favored 'General case' 0 CA--C 1.569 1.711 0 N-CA-C 119.675 3.213 . . . . 0.0 119.675 -167.001 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -61.96 -47.13 86.25 Favored 'General case' 0 N--CA 1.486 1.342 0 N-CA-C 117.548 2.425 . . . . 0.0 117.548 167.734 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.459 HG21 HD22 ' B' ' 35' ' ' LEU . 0.1 OUTLIER -67.37 -42.44 87.43 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.911 0 CA-C-N 122.949 2.613 . . . . 0.0 112.509 173.262 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 16' ' ' ARG . . . . . 0.439 ' HB2' ' HB2' ' A' ' 11' ' ' MET 0.318 0.0 OUTLIER -79.15 -29.24 42.95 Favored 'General case' 0 N--CA 1.486 1.329 0 CA-C-N 123.078 2.672 . . . . 0.0 116.313 176.083 . . . . . . . . 4 4 . 1 . 003 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -67.42 -44.76 77.98 Favored 'General case' 0 N--CA 1.49 1.533 0 CA-C-N 123.38 2.809 . . . . 0.0 113.254 156.926 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . 0.552 8.8 pttt -74.02 -31.73 63.05 Favored 'General case' 0 N--CA 1.484 1.25 0 N-CA-C 116.643 2.09 . . . . 0.0 116.643 179.366 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.507 ' HB3' ' CE ' ' A' ' 30' ' ' MET 0.294 0.9 OUTLIER -69.07 -43.79 73.87 Favored 'General case' 0 N--CA 1.492 1.634 0 CA-C-N 122.764 2.529 . . . . 0.0 113.624 162.004 . . . . . . . . 4 4 . 1 . 003 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 1.5 ttpt -77.38 -38.92 49.01 Favored 'General case' 0 CA--C 1.562 1.428 0 N-CA-C 115.158 1.54 . . . . 0.0 115.158 -177.919 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 29.4 m-85 -55.86 -77.71 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.573 0 CA-C-O 113.408 -3.187 . . . . 0.0 110.832 154.557 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . 0.331 0.0 OUTLIER -28.72 -48.73 0.06 Allowed 'General case' 0 CA--C 1.589 2.463 1 CA-C-N 126.117 4.053 . . . . 0.0 117.113 176.053 . . . . . . . . 4 3 . 1 . 003 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.48 ' HB2' ' HB3' ' A' ' 33' ' ' GLU . . . -47.54 -77.65 0.02 OUTLIER 'General case' 0 CA--C 1.586 2.334 0 N-CA-C 120.54 3.533 . . . . 0.0 120.54 152.254 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 54.2 mm-40 . . . . . 0 N--CA 1.499 2.005 0 N-CA-C 118.603 2.816 . . . . 0.0 118.603 179.188 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.566 ' HE ' ' HB3' ' A' ' 36' ' ' GLN 0.288 18.3 mtm-85 . . . . . 0 N--CA 1.5 2.034 0 N-CA-C 102.688 -3.079 . . . . 0.0 102.688 . . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 23.2 t -115.92 112.71 22.27 Favored 'General case' 0 N--CA 1.509 2.492 0 O-C-N 116.617 -3.802 . . . . 0.0 108.818 -164.8 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' MET . . . . . 0.507 ' CE ' ' HB3' ' A' ' 19' ' ' LEU . 25.6 mtp -42.62 -45.29 4.56 Favored 'General case' 0 N--CA 1.501 2.077 0 N-CA-C 119.474 3.139 . . . . 0.0 119.474 -134.707 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 18.7 t-20 -47.15 -43.56 21.08 Favored 'General case' 0 CA--C 1.6 2.888 1 O-C-N 115.928 -4.233 . . . . 0.0 114.816 165.088 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . 0.291 13.6 t -53.18 -72.24 0.06 Allowed 'General case' 0 N--CA 1.502 2.161 0 N-CA-C 117.306 2.336 . . . . 0.0 117.306 143.384 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 33' ' ' GLU . . . . . 0.48 ' HB3' ' HB2' ' A' ' 23' ' ' ALA . 4.5 tm-20 -68.41 -45.62 72.13 Favored 'General case' 0 N--CA 1.504 2.256 0 CA-C-N 124.471 3.305 . . . . 0.0 119.338 -171.994 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.846 HD12 ' CZ ' ' B' ' 7' ' ' PHE . 0.1 OUTLIER -41.43 -55.99 2.64 Favored 'General case' 0 CA--C 1.557 1.245 0 CA-C-O 114.866 -2.492 . . . . 0.0 108.39 156.762 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 11.8 mt -62.21 -45.94 91.11 Favored 'General case' 0 N--CA 1.493 1.706 0 CA-C-N 125.7 3.864 . . . . 0.0 116.762 177.493 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' GLN . . . . . 0.566 ' HB3' ' HE ' ' A' ' 28' ' ' ARG . 0.1 OUTLIER -70.97 -40.88 71.69 Favored 'General case' 0 N--CA 1.483 1.184 0 CA-C-O 116.705 -1.617 . . . . 0.0 113.48 178.955 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 37' ' ' ILE . . . . . 0.458 ' O ' ' HB2' ' A' ' 41' ' ' ALA . 1.3 tt -61.67 -31.7 51.58 Favored 'Isoleucine or valine' 0 C--O 1.199 -1.593 0 CA-C-O 114.329 -2.748 . . . . 0.0 115.178 160.474 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.457 HG21 HD22 ' A' ' 34' ' ' LEU . 2.6 t -84.38 -51.84 13.4 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.096 0 CA-C-N 123.698 2.954 . . . . 0.0 110.884 -173.57 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 33.9 mt-30 -48.76 -41.57 32.76 Favored 'General case' 0 CA--C 1.568 1.643 0 C-N-CA 124.208 1.003 . . . . 0.0 113.656 155.014 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . 0.352 17.4 t0 -50.31 -57.91 6.83 Favored 'General case' 0 N--CA 1.49 1.526 0 N-CA-C 116.916 2.191 . . . . 0.0 116.916 153.981 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 41' ' ' ALA . . . . . 0.458 ' HB2' ' O ' ' A' ' 37' ' ' ILE . . . . . . . . 0 CA--C 1.551 0.995 0 N-CA-C 116.733 2.124 . . . . 0.0 116.733 -157.496 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 90.0 Cg_endo . . . . . 0 CA--C 1.557 1.636 0 N-CA-C 115.945 1.479 . . . . 0.0 115.945 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' B' B ' 6' ' ' HIS . . . . . . . . . . . . . 54.9 m80 -75.19 154.21 37.75 Favored 'General case' 0 CA--C 1.557 1.231 0 CA-C-N 113.8 -1.546 . . . . 0.0 114.597 174.656 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 7' ' ' PHE . . . . . 0.846 ' CZ ' HD12 ' A' ' 34' ' ' LEU . 17.8 p90 -131.19 162.66 29.45 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 120.197 -1.564 . . . . 0.0 112.395 120.026 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 8' ' ' ASN . . . . . . . . . . . . . 6.1 p-10 -61.73 92.47 0.04 OUTLIER 'General case' 0 CA--C 1.567 1.628 0 N-CA-C 114.422 1.267 . . . . 0.0 114.422 165.403 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 9' ' ' PHE . . . . . 0.65 ' CD2' HD13 ' A' ' 34' ' ' LEU 0.263 0.8 OUTLIER -79.53 164.77 23.62 Favored 'General case' 0 CA--C 1.563 1.476 0 CA-C-O 125.543 2.592 . . . . 0.0 109.511 153.905 . . . . . . . . 4 4 . 1 . 003 nuclear build core ' B' B ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 162.63 103.33 0.0 OUTLIER 'General case' 0 C--N 1.308 -1.231 0 CA-C-N 111.819 -2.446 . . . . 0.0 104.658 -123.846 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 11' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -139.96 128.75 13.37 Favored Pre-proline 0 CA--C 1.567 1.631 0 CA-C-O 117.669 -1.158 . . . . 0.0 110.88 -158.883 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 12' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -59.46 153.42 54.52 Favored 'Trans proline' 0 CA--C 1.562 1.905 0 CA-C-N 123.779 2.385 . . . . 0.0 114.116 169.445 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 13' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -57.84 -36.55 72.44 Favored 'General case' 0 N--CA 1.495 1.821 0 N-CA-C 117.026 2.232 . . . . 0.0 117.026 -155.03 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -60.13 -44.23 95.07 Favored 'General case' 0 CA--C 1.563 1.458 0 N-CA-C 117.146 2.276 . . . . 0.0 117.146 165.705 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 15' ' ' VAL . . . . . 0.406 ' CG1' HG12 ' A' ' 38' ' ' VAL . 0.3 OUTLIER -63.06 -46.33 96.46 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.131 0 CA-C-N 123.57 2.896 . . . . 0.0 112.612 172.921 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 16' ' ' ARG . . . . . . . . . . . . 0.255 0.0 OUTLIER -76.63 -27.87 55.87 Favored 'General case' 0 N--CA 1.479 1.009 0 N-CA-C 116.261 1.949 . . . . 0.0 116.261 177.297 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 17' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -67.44 -44.46 78.65 Favored 'General case' 0 N--CA 1.49 1.573 0 CA-C-N 122.833 2.56 . . . . 0.0 113.699 156.925 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 55.4 mtmt -58.5 -54.89 41.9 Favored 'General case' 0 N--CA 1.49 1.561 0 CA-C-N 122.378 2.354 . . . . 0.0 114.93 171.316 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 19' ' ' LEU . . . . . 0.496 HD21 ' HG ' ' B' ' 34' ' ' LEU . 12.9 tp -63.57 -35.63 81.13 Favored 'General case' 0 CA--C 1.562 1.44 0 N-CA-C 115.124 1.527 . . . . 0.0 115.124 176.453 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 20' ' ' LYS . . . . . 0.444 ' HA ' ' HB3' ' B' ' 23' ' ' ALA . 11.8 ttpt -87.82 -23.0 24.17 Favored 'General case' 0 CA--C 1.572 1.803 0 N-CA-C 114.314 1.228 . . . . 0.0 114.314 176.185 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 21' ' ' PHE . . . . . 0.41 ' O ' ' HB3' ' B' ' 25' ' ' ALA . 11.2 m-85 -64.53 -71.71 0.17 Allowed 'General case' 0 N--CA 1.491 1.62 0 CA-C-O 115.167 -2.349 . . . . 0.0 110.635 154.678 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . 0.369 0.0 OUTLIER -18.58 -52.28 0.01 OUTLIER 'General case' 0 CA--C 1.597 2.754 0 CA-C-N 124.616 3.371 . . . . 0.0 115.106 159.794 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 23' ' ' ALA . . . . . 0.444 ' HB3' ' HA ' ' B' ' 20' ' ' LYS 0.331 . . -55.67 -77.96 0.02 OUTLIER 'General case' 0 CA--C 1.586 2.338 0 N-CA-C 120.202 3.408 . . . . 0.0 120.202 154.182 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 12.6 mm-40 -68.93 -36.59 78.16 Favored 'General case' 0 N--CA 1.502 2.16 0 N-CA-C 119.323 3.083 . . . . 0.0 119.323 -178.719 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 25' ' ' ALA . . . . . 0.41 ' HB3' ' O ' ' B' ' 21' ' ' PHE . . . -42.79 -49.82 5.69 Favored 'General case' 0 CA--C 1.58 2.127 0 N-CA-C 116.496 2.036 . . . . 0.0 116.496 154.413 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 26' ' ' ASN . . . . . . . . . . . . . 6.8 m-20 -82.23 -54.61 5.11 Favored 'General case' 0 CA--C 1.572 1.789 0 N-CA-C 114.275 1.213 . . . . 0.0 114.275 179.131 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 27' ' ' GLY . . . . . . . . . . . . . . . 116.67 23.94 3.86 Favored Glycine 0 N--CA 1.498 2.793 0 N-CA-C 117.835 1.894 . . . . 0.0 117.835 -152.661 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 28' ' ' ARG . . . . . . . . . . . . 0.291 81.7 mtm180 -119.09 155.61 31.22 Favored 'General case' 0 CA--C 1.58 2.106 0 N-CA-C 103.738 -2.69 . . . . 0.0 103.738 170.927 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 29' ' ' SER . . . . . . . . . . . . . 87.5 p -122.98 108.13 12.59 Favored 'General case' 0 N--CA 1.507 2.387 0 O-C-N 116.852 -3.655 . . . . 0.0 107.576 -166.47 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 30' ' ' MET . . . . . . . . . . . . . 23.4 mtp -40.6 -45.93 2.43 Favored 'General case' 0 N--CA 1.5 2.033 0 N-CA-C 119.15 3.019 . . . . 0.0 119.15 -137.592 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 31' ' ' ASN . . . . . . . . . . . . 0.286 0.1 OUTLIER -48.56 -43.65 35.85 Favored 'General case' 0 CA--C 1.601 2.926 0 CA-C-N 125.178 3.626 . . . . 0.0 114.707 167.08 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 32' ' ' SER . . . . . . . . . . . . 0.296 70.0 m -53.04 -63.19 1.23 Allowed 'General case' 0 N--CA 1.508 2.473 0 N-CA-C 119.902 3.297 . . . . 0.0 119.902 145.527 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 33' ' ' GLU . . . . . 0.441 ' HB3' ' HB2' ' B' ' 23' ' ' ALA . 8.5 tm-20 -70.28 -54.76 11.31 Favored 'General case' 0 N--CA 1.504 2.234 0 CA-C-N 123.668 2.94 . . . . 0.0 118.901 -178.707 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 34' ' ' LEU . . . . . 0.711 HD12 ' CZ ' ' A' ' 7' ' ' PHE . 0.1 OUTLIER -36.39 -52.23 0.83 Allowed 'General case' 0 CA--C 1.554 1.111 0 CA-C-O 115.829 -2.034 . . . . 0.0 108.74 161.119 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 35' ' ' LEU . . . . . 0.459 HD22 HG21 ' A' ' 15' ' ' VAL . 19.7 mt -62.67 -47.64 82.78 Favored 'General case' 0 C--N 1.369 1.416 0 CA-C-N 123.689 2.949 . . . . 0.0 116.351 174.075 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 36' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -69.07 -31.42 70.16 Favored 'General case' 0 N--CA 1.49 1.557 0 N-CA-C 116.305 1.965 . . . . 0.0 116.305 179.491 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 37' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -73.38 -34.53 43.56 Favored 'Isoleucine or valine' 0 C--O 1.2 -1.519 0 CA-C-O 114.978 -2.439 . . . . 0.0 113.908 159.526 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 38' ' ' VAL . . . . . 0.402 ' HA ' ' HB3' ' B' ' 41' ' ' ALA . 2.6 t -76.05 -49.31 26.02 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.314 0 CA-C-N 123.969 3.077 . . . . 0.0 112.448 -176.639 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 31.5 mt-30 -55.06 -38.76 68.44 Favored 'General case' 0 CA--C 1.57 1.749 0 CA-C-O 117.631 -1.176 . . . . 0.0 112.908 156.43 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 40' ' ' ASP . . . . . . . . . . . . 0.42 7.1 t0 -52.41 -45.32 65.85 Favored 'General case' 0 N--CA 1.504 2.255 0 N-CA-C 116.737 2.125 . . . . 0.0 116.737 154.485 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 41' ' ' ALA . . . . . 0.402 ' HB3' ' HA ' ' B' ' 38' ' ' VAL 0.296 . . -84.16 -53.78 5.28 Favored 'General case' 0 CA--C 1.553 1.068 0 N-CA-C 115.807 1.78 . . . . 0.0 115.807 -161.136 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . 0.316 1.5 pp . . . . . 0 N--CA 1.494 1.754 0 N-CA-C 117.286 2.328 . . . . 0.0 117.286 160.951 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 7.4 p-10 . . . . . 0 CA--C 1.57 1.737 0 N-CA-C 112.478 0.547 . . . . 0.0 112.478 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 4.4 Cg_exo -99.07 154.01 0.63 Allowed 'Trans proline' 0 C--N 1.362 1.281 0 CA-C-N 121.936 1.727 . . . . 0.0 113.889 -157.743 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 61.7 m80 -72.34 138.42 47.3 Favored 'General case' 0 CA--C 1.562 1.413 0 CA-C-N 113.546 -1.661 . . . . 0.0 113.633 177.356 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 7' ' ' PHE . . . . . 0.806 ' CZ ' HD12 ' B' ' 34' ' ' LEU 0.268 35.5 p90 -116.43 170.97 8.15 Favored 'General case' 0 CA--C 1.565 1.549 0 O-C-N 120.065 -1.647 . . . . 0.0 110.438 113.902 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 93.1 m-20 -89.13 94.53 9.97 Favored 'General case' 0 N--CA 1.485 1.319 0 O-C-N 119.764 -1.835 . . . . 0.0 107.556 162.364 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 9' ' ' PHE . . . . . 0.635 ' CG ' HD13 ' B' ' 34' ' ' LEU . 8.9 t80 -66.9 162.83 20.92 Favored 'General case' 0 CA--C 1.556 1.202 0 CA-C-O 124.344 2.021 . . . . 0.0 111.345 160.904 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 38.3 tpt85 170.96 103.35 0.01 OUTLIER 'General case' 0 N--CA 1.486 1.346 0 O-C-N 119.785 -1.822 . . . . 0.0 106.881 -119.19 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' MET . . . . . 0.595 ' SD ' HD23 ' A' ' 19' ' ' LEU . 11.6 mtm -138.85 122.9 11.3 Favored Pre-proline 0 CA--C 1.561 1.375 0 CA-C-O 117.296 -1.335 . . . . 0.0 110.872 -153.763 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 75.1 Cg_exo -43.0 143.11 1.96 Allowed 'Trans proline' 0 CA--C 1.562 1.923 0 C-N-CA 122.952 2.435 . . . . 0.0 116.013 163.32 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' MET . . . . . 0.403 ' SD ' ' HG3' ' A' ' 17' ' ' GLU . 9.5 tpp -55.34 -28.68 55.35 Favored 'General case' 0 N--CA 1.491 1.609 0 N-CA-C 119.533 3.16 . . . . 0.0 119.533 -163.987 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . 0.268 9.2 pt-20 -62.7 -48.63 78.43 Favored 'General case' 0 CA--C 1.566 1.586 0 N-CA-C 116.411 2.004 . . . . 0.0 116.411 160.959 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -60.13 -44.19 94.61 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.288 0 CA-C-N 123.114 2.688 . . . . 0.0 113.438 174.345 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -80.84 -21.28 40.9 Favored 'General case' 0 CA--C 1.556 1.181 0 N-CA-C 116.63 2.085 . . . . 0.0 116.63 175.759 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 17' ' ' GLU . . . . . 0.403 ' HG3' ' SD ' ' A' ' 13' ' ' MET . 38.9 mt-10 -67.34 -47.61 69.97 Favored 'General case' 0 N--CA 1.49 1.555 0 CA-C-N 123.183 2.719 . . . . 0.0 113.766 151.946 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 46.7 mtmt -57.6 -57.04 14.44 Favored 'General case' 0 N--CA 1.485 1.307 0 CA-C-N 121.609 2.004 . . . . 0.0 114.353 174.157 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.595 HD23 ' SD ' ' A' ' 11' ' ' MET 0.267 12.0 tp -64.18 -40.0 95.18 Favored 'General case' 0 CA--C 1.563 1.445 0 C-N-CA 124.812 1.245 . . . . 0.0 113.499 176.081 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 10.6 ttpt -80.26 -25.12 39.65 Favored 'General case' 0 CA--C 1.569 1.705 0 CA-C-N 120.537 1.517 . . . . 0.0 114.947 176.201 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 18.7 m-30 -70.43 -71.48 0.24 Allowed 'General case' 0 N--CA 1.488 1.468 0 CA-C-O 114.074 -2.869 . . . . 0.0 110.764 162.23 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.644 HH21 HD11 ' A' ' 37' ' ' ILE 0.261 7.3 tpt180 -14.09 -56.26 0.0 OUTLIER 'General case' 0 CA--C 1.595 2.683 0 CA-C-N 125.92 3.964 . . . . 0.0 116.042 159.515 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.512 ' HB2' ' CB ' ' A' ' 33' ' ' GLU . . . -55.77 -79.42 0.02 OUTLIER 'General case' 0 CA--C 1.586 2.329 0 N-CA-C 118.421 2.748 . . . . 0.0 118.421 157.921 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 66.5 mm-40 . . . . . 0 CA--C 1.574 1.904 0 N-CA-C 119.34 3.089 . . . . 0.0 119.34 -175.437 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.511 HH12 HD13 ' A' ' 37' ' ' ILE . 84.4 mtm180 . . . . . 0 CA--C 1.576 1.961 0 N-CA-C 104.748 -2.315 . . . . 0.0 104.748 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 9.4 t -137.76 115.15 11.1 Favored 'General case' 0 N--CA 1.503 2.219 0 O-C-N 117.157 -3.465 . . . . 0.0 107.071 -171.766 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 19.9 mtp -53.05 -40.7 64.17 Favored 'General case' 0 N--CA 1.491 1.62 0 N-CA-C 118.224 2.676 . . . . 0.0 118.224 -126.724 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 13.0 t-20 -45.58 -43.58 12.24 Favored 'General case' 0 CA--C 1.598 2.793 0 CA-C-N 125.505 3.775 . . . . 0.0 114.857 165.151 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . 0.416 89.1 p -56.95 -58.29 8.79 Favored 'General case' 0 N--CA 1.503 2.214 0 N-CA-C 120.348 3.462 . . . . 0.0 120.348 149.555 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 33' ' ' GLU . . . . . 0.512 ' CB ' ' HB2' ' A' ' 23' ' ' ALA . 10.5 tm-20 -64.82 -61.14 2.36 Favored 'General case' 0 N--CA 1.507 2.389 0 CA-C-N 123.127 2.694 . . . . 0.0 117.761 176.804 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.819 HD12 ' CZ ' ' B' ' 7' ' ' PHE . 0.0 OUTLIER -38.23 -53.44 1.45 Allowed 'General case' 0 CA--C 1.545 0.77 0 CA-C-O 115.748 -2.072 . . . . 0.0 108.126 169.019 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.495 ' HG ' ' CE1' ' B' ' 9' ' ' PHE . 11.9 mt -63.99 -56.29 16.17 Favored 'General case' 0 C--N 1.367 1.343 0 CA-C-N 123.03 2.65 . . . . 0.0 115.171 178.848 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . 0.276 1.5 tm0? -58.56 -31.1 67.68 Favored 'General case' 0 CA--C 1.57 1.727 0 CA-C-O 116.612 -1.661 . . . . 0.0 114.626 176.874 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 37' ' ' ILE . . . . . 0.644 HD11 HH21 ' A' ' 22' ' ' ARG . 2.8 tp -79.28 -31.7 14.58 Favored 'Isoleucine or valine' 0 CA--C 1.567 1.62 0 CA-C-N 122.318 2.327 . . . . 0.0 116.414 164.393 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.433 HG21 HD22 ' A' ' 34' ' ' LEU . 3.1 t -77.19 -48.72 24.29 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.911 0 CA-C-N 122.285 2.311 . . . . 0.0 110.934 178.821 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 29.6 mt-30 -51.36 -46.21 62.66 Favored 'General case' 0 CA--C 1.551 0.987 0 CA-C-O 116.198 -1.858 . . . . 0.0 113.005 155.824 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 40' ' ' ASP . . . . . 0.407 ' HB3' ' HA ' ' A' ' 37' ' ' ILE 0.297 42.0 t0 -44.51 -55.24 5.26 Favored 'General case' 0 N--CA 1.502 2.157 0 CA-C-N 121.763 2.074 . . . . 0.0 113.644 158.497 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . 0.283 . . . . . . . 0 CA--C 1.544 0.721 0 N-CA-C 119.324 3.083 . . . . 0.0 119.324 -161.678 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 4.5 Cg_exo . . . . . 0 CA--C 1.557 1.669 0 N-CA-C 114.011 0.735 . . . . 0.0 114.011 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' B' B ' 6' ' ' HIS . . . . . . . . . . . . . 77.5 m80 -85.82 135.28 33.78 Favored 'General case' 0 CA--C 1.579 2.059 0 CA-C-N 114.959 -1.019 . . . . 0.0 112.117 174.647 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 7' ' ' PHE . . . . . 0.819 ' CZ ' HD12 ' A' ' 34' ' ' LEU . 3.0 p90 -135.94 161.7 34.9 Favored 'General case' 0 CA--C 1.571 1.778 0 O-C-N 119.896 -1.752 . . . . 0.0 112.345 151.058 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 8' ' ' ASN . . . . . . . . . . . . . 7.8 p-10 -62.32 102.75 0.33 Allowed 'General case' 0 CA--C 1.575 1.909 0 N-CA-C 116.001 1.852 . . . . 0.0 116.001 171.782 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 9' ' ' PHE . . . . . 0.622 ' CG ' HD13 ' A' ' 34' ' ' LEU . 4.9 t80 -126.81 105.99 9.04 Favored 'General case' 0 CA--C 1.538 0.516 0 N-CA-C 107.661 -1.237 . . . . 0.0 107.661 159.662 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 10' ' ' ARG . . . . . . . . . . . . 0.469 0.0 OUTLIER 92.79 87.45 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.566 1 O-C-N 114.162 -5.337 . . . . 0.0 109.339 -11.415 . . . . . . . . 4 3 . 1 . 004 nuclear build core ' B' B ' 11' ' ' MET . . . . . 0.633 ' SD ' HD23 ' B' ' 19' ' ' LEU . 8.4 mtm -148.87 126.29 5.6 Favored Pre-proline 0 CA--C 1.566 1.565 0 CA-C-O 117.045 -1.455 . . . . 0.0 110.371 -160.261 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 12' ' ' PRO . . . . . . . . . . . . . 76.9 Cg_exo -42.55 140.47 2.68 Favored 'Trans proline' 0 C--N 1.371 1.72 0 C-N-CA 123.242 2.628 . . . . 0.0 116.261 161.944 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 13' ' ' MET . . . . . 0.452 ' SD ' ' HG3' ' B' ' 17' ' ' GLU . 23.4 tpp -54.76 -29.19 53.29 Favored 'General case' 0 N--CA 1.495 1.78 0 N-CA-C 119.006 2.965 . . . . 0.0 119.006 -163.886 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -61.95 -48.25 81.22 Favored 'General case' 0 N--CA 1.492 1.672 0 N-CA-C 117.008 2.225 . . . . 0.0 117.008 163.972 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -58.92 -50.58 79.08 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.138 0 CA-C-N 121.163 1.801 . . . . 0.0 113.001 172.123 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -73.83 -26.09 60.41 Favored 'General case' 0 CA--C 1.545 0.759 0 N-CA-C 116.7 2.111 . . . . 0.0 116.7 175.826 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 17' ' ' GLU . . . . . 0.452 ' HG3' ' SD ' ' B' ' 13' ' ' MET . 43.2 mt-10 -64.13 -48.2 76.98 Favored 'General case' 0 N--CA 1.49 1.565 0 CA-C-N 123.908 3.049 . . . . 0.0 112.959 156.883 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . 0.615 23.5 pttt -67.26 -40.28 86.19 Favored 'General case' 0 N--CA 1.488 1.442 0 N-CA-C 117.415 2.376 . . . . 0.0 117.415 178.963 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 19' ' ' LEU . . . . . 0.633 HD23 ' SD ' ' B' ' 11' ' ' MET . 12.5 tp -69.75 -35.88 75.33 Favored 'General case' 0 CA--C 1.565 1.52 0 N-CA-C 115.081 1.512 . . . . 0.0 115.081 168.234 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 20' ' ' LYS . . . . . . . . . . . . . 14.3 ttpt -86.57 -30.74 21.64 Favored 'General case' 0 CA--C 1.567 1.627 0 N-CA-C 114.721 1.378 . . . . 0.0 114.721 178.814 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 21' ' ' PHE . . . . . 0.438 ' O ' ' HB3' ' B' ' 25' ' ' ALA . 24.5 m-85 -59.66 -68.56 0.27 Allowed 'General case' 0 N--CA 1.492 1.629 0 CA-C-O 114.188 -2.815 . . . . 0.0 111.514 155.23 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . 0.306 13.9 ttm-85 -25.68 -47.79 0.02 OUTLIER 'General case' 0 CA--C 1.597 2.788 0 CA-C-N 125.583 3.811 . . . . 0.0 116.979 163.411 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -61.36 -61.78 2.3 Favored 'General case' 0 CA--C 1.581 2.148 0 N-CA-C 119.936 3.31 . . . . 0.0 119.936 160.668 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 49.4 mt-10 -68.04 -51.34 47.96 Favored 'General case' 0 N--CA 1.502 2.128 0 N-CA-C 116.743 2.127 . . . . 0.0 116.743 175.041 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 25' ' ' ALA . . . . . 0.438 ' HB3' ' O ' ' B' ' 21' ' ' PHE . . . -40.92 -46.57 2.81 Favored 'General case' 0 CA--C 1.586 2.357 0 N-CA-C 117.455 2.391 . . . . 0.0 117.455 162.953 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 26' ' ' ASN . . . . . . . . . . . . . 77.8 m-20 -86.07 -42.23 14.11 Favored 'General case' 0 N--CA 1.503 2.224 0 N-CA-C 117.168 2.284 . . . . 0.0 117.168 170.896 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 27' ' ' GLY . . . . . . . . . . . . . . . 99.53 57.0 0.95 Allowed Glycine 0 N--CA 1.493 2.455 0 N-CA-C 116.174 1.23 . . . . 0.0 116.174 -159.878 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 28' ' ' ARG . . . . . . . . . . . . . 10.7 ptt-85 -156.33 100.48 1.99 Allowed 'General case' 0 N--CA 1.493 1.688 0 N-CA-C 106.683 -1.599 . . . . 0.0 106.683 176.936 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 29' ' ' SER . . . . . . . . . . . . . 31.6 t -79.92 133.38 36.21 Favored 'General case' 0 N--CA 1.5 2.026 0 O-C-N 119.259 -2.151 . . . . 0.0 108.381 -156.322 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 30' ' ' MET . . . . . . . . . . . . . 25.1 mtp -47.21 -41.01 17.47 Favored 'General case' 0 N--CA 1.501 2.111 0 N-CA-C 119.089 2.996 . . . . 0.0 119.089 -143.371 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 31' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -47.91 -40.72 22.68 Favored 'General case' 0 CA--C 1.593 2.609 0 CA-C-N 125.318 3.69 . . . . 0.0 115.392 166.006 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 32' ' ' SER . . . . . . . . . . . . 0.37 37.4 t -54.25 -72.51 0.06 Allowed 'General case' 0 CA--C 1.576 1.946 0 N-CA-C 118.255 2.687 . . . . 0.0 118.255 145.57 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -57.3 -57.2 13.68 Favored 'General case' 0 N--CA 1.522 3.165 0 CA-C-N 125.382 3.719 . . . . 0.0 116.926 -177.693 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 34' ' ' LEU . . . . . 0.806 HD12 ' CZ ' ' A' ' 7' ' ' PHE . 0.1 OUTLIER -40.59 -55.77 2.25 Favored 'General case' 0 CA--C 1.547 0.833 0 CA-C-O 115.698 -2.096 . . . . 0.0 108.382 169.054 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 35' ' ' LEU . . . . . 0.415 HD23 ' HA ' ' B' ' 35' ' ' LEU . 12.8 mt -59.78 -45.83 91.09 Favored 'General case' 0 C--N 1.367 1.365 0 CA-C-N 122.922 2.601 . . . . 0.0 116.135 175.575 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 36' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -56.12 -56.57 19.29 Favored 'General case' 0 CA--C 1.547 0.834 0 CA-C-O 117.534 -1.222 . . . . 0.0 113.276 175.27 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 37' ' ' ILE . . . . . . . . . . . . . 2.9 tp -63.8 -25.14 37.52 Favored 'Isoleucine or valine' 0 CA--C 1.563 1.461 0 CA-C-O 115.006 -2.426 . . . . 0.0 117.379 169.517 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 38' ' ' VAL . . . . . 0.492 HG21 HD22 ' B' ' 34' ' ' LEU . 3.5 t -83.29 -49.56 16.49 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.069 0 C-N-CA 127.311 2.244 . . . . 0.0 111.335 -177.018 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 26.6 mt-30 -49.66 -45.98 49.23 Favored 'General case' 0 CA--C 1.565 1.54 0 CA-C-O 118.286 -0.864 . . . . 0.0 112.214 154.614 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 40' ' ' ASP . . . . . . . . . . . . 0.343 0.2 OUTLIER -53.25 -41.28 65.31 Favored 'General case' 0 N--CA 1.492 1.636 0 N-CA-C 119.029 2.974 . . . . 0.0 119.029 157.759 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -68.3 -47.37 67.78 Favored 'General case' 0 N--CA 1.486 1.35 0 N-CA-C 114.715 1.376 . . . . 0.0 114.715 -165.646 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 1.4 pp . . . . . 0 CA--C 1.567 1.63 0 N-CA-C 117.794 2.516 . . . . 0.0 117.794 171.708 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 2.1 p30 . . . . . 0 CA--C 1.568 1.64 0 N-CA-C 112.969 0.729 . . . . 0.0 112.969 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 6.0 Cg_exo -100.2 155.35 0.5 Allowed 'Trans proline' 0 CA--C 1.553 1.472 0 C-N-CA 121.974 1.783 . . . . 0.0 113.835 -159.382 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 77.5 m80 -76.37 138.31 40.34 Favored 'General case' 0 CA--C 1.56 1.361 0 CA-C-N 113.664 -1.607 . . . . 0.0 113.479 -178.093 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 7' ' ' PHE . . . . . 0.809 ' CZ ' HD12 ' B' ' 34' ' ' LEU 0.274 36.2 p90 -116.03 164.56 14.26 Favored 'General case' 0 CA--C 1.561 1.381 0 CA-C-O 123.927 1.822 . . . . 0.0 110.244 117.003 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 26.6 p-10 -82.1 89.34 6.45 Favored 'General case' 0 CA--C 1.564 1.515 0 O-C-N 119.72 -1.863 . . . . 0.0 109.385 161.803 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 9' ' ' PHE . . . . . 0.598 ' CG ' HD13 ' B' ' 34' ' ' LEU . 9.0 t80 -66.39 167.93 9.75 Favored 'General case' 0 CA--C 1.557 1.24 0 CA-C-O 123.96 1.838 . . . . 0.0 110.334 159.243 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 38.8 tpt85 159.85 110.03 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.482 0 O-C-N 119.411 -2.056 . . . . 0.0 106.128 -116.23 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 2.2 mpt? -119.26 -168.66 0.13 Allowed Pre-proline 0 CA--C 1.576 1.949 0 C-N-CA 120.0 -0.68 . . . . 0.0 112.711 -168.048 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -98.11 161.57 0.81 Allowed 'Trans proline' 0 CA--C 1.566 2.09 0 CA-C-O 123.393 1.331 . . . . 0.0 114.119 133.098 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' MET . . . . . 0.441 ' SD ' ' HG3' ' A' ' 17' ' ' GLU . 22.3 tpp -58.86 -33.81 70.89 Favored 'General case' 0 N--CA 1.497 1.911 0 N-CA-C 117.432 2.382 . . . . 0.0 117.432 -162.235 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . 0.25 9.1 pt-20 -62.26 -42.35 99.25 Favored 'General case' 0 N--CA 1.49 1.551 0 N-CA-C 116.39 1.996 . . . . 0.0 116.39 166.043 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.427 ' CG1' HG12 ' B' ' 38' ' ' VAL . 0.4 OUTLIER -61.0 -48.84 87.26 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.211 0 CA-C-N 122.566 2.439 . . . . 0.0 112.872 173.358 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 4.8 ttt180 -71.7 -33.76 69.05 Favored 'General case' 0 CA--C 1.547 0.85 0 CA-C-O 116.153 -1.88 . . . . 0.0 115.635 174.185 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' GLU . . . . . 0.441 ' HG3' ' SD ' ' A' ' 13' ' ' MET . 40.7 mt-10 -59.44 -42.92 93.02 Favored 'General case' 0 N--CA 1.492 1.628 0 CA-C-N 123.986 3.085 . . . . 0.0 114.671 159.997 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . 0.271 39.9 mtmt -63.95 -49.57 72.05 Favored 'General case' 0 CA--C 1.566 1.582 0 CA-C-N 120.724 1.602 . . . . 0.0 115.142 172.054 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.644 ' HG ' ' SD ' ' A' ' 30' ' ' MET 0.303 13.3 tp -67.35 -38.84 85.47 Favored 'General case' 0 CA--C 1.57 1.745 0 C-N-CA 125.824 1.65 . . . . 0.0 114.616 173.173 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 31.9 ttpt -88.0 -25.97 22.86 Favored 'General case' 0 CA--C 1.561 1.403 0 CA-C-O 117.261 -1.352 . . . . 0.0 113.663 -179.743 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 19.1 m-85 -64.04 -74.48 0.1 Allowed 'General case' 0 N--CA 1.489 1.492 0 CA-C-O 112.211 -3.756 . . . . 0.0 109.822 154.104 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . 0.275 6.0 tpp180 -14.31 -60.17 0.01 OUTLIER 'General case' 0 CA--C 1.589 2.468 1 CA-C-N 126.402 4.183 . . . . 0.0 115.473 165.754 . . . . . . . . 3 2 . 1 . 005 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.513 ' HB2' ' HB3' ' A' ' 33' ' ' GLU . . . -50.38 -78.95 0.02 OUTLIER 'General case' 0 CA--C 1.584 2.257 0 N-CA-C 120.375 3.472 . . . . 0.0 120.375 156.592 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 30.4 mt-10 . . . . . 0 N--CA 1.503 2.201 0 N-CA-C 118.969 2.951 . . . . 0.0 118.969 -179.277 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 75.8 mtm180 . . . . . 0 N--CA 1.497 1.907 0 N-CA-C 105.608 -1.997 . . . . 0.0 105.608 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 35.3 t -121.64 106.01 10.95 Favored 'General case' 0 N--CA 1.502 2.143 0 O-C-N 118.14 -2.85 . . . . 0.0 106.477 -168.346 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' MET . . . . . 0.644 ' SD ' ' HG ' ' A' ' 19' ' ' LEU . 0.0 OUTLIER -38.85 -44.89 1.09 Allowed 'General case' 0 N--CA 1.494 1.729 0 N-CA-C 120.785 3.624 . . . . 0.0 120.785 -140.156 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 6.5 t-20 -45.96 -47.05 16.57 Favored 'General case' 0 CA--C 1.599 2.854 0 O-C-N 117.459 -3.276 . . . . 0.0 114.3 165.552 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . 0.332 31.2 t -47.35 -73.43 0.04 OUTLIER 'General case' 0 N--CA 1.504 2.245 0 N-CA-C 118.069 2.618 . . . . 0.0 118.069 142.929 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 33' ' ' GLU . . . . . 0.513 ' HB3' ' HB2' ' A' ' 23' ' ' ALA . 8.4 tm-20 -64.17 -55.23 23.24 Favored 'General case' 0 N--CA 1.501 2.103 0 N-CA-C 119.347 3.092 . . . . 0.0 119.347 -172.913 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.752 HD12 ' CZ ' ' B' ' 7' ' ' PHE . 0.2 OUTLIER -36.88 -52.8 0.94 Allowed 'General case' 0 CA--C 1.554 1.116 0 CA-C-O 115.764 -2.065 . . . . 0.0 107.341 163.691 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.471 HD22 HG21 ' B' ' 15' ' ' VAL . 14.0 mt -62.58 -51.99 65.18 Favored 'General case' 0 C--N 1.372 1.561 0 CA-C-N 122.925 2.602 . . . . 0.0 115.896 177.534 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -63.7 -36.05 82.57 Favored 'General case' 0 N--CA 1.484 1.257 0 N-CA-C 114.5 1.296 . . . . 0.0 114.5 -177.824 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 12.7 tt -73.01 -43.26 58.98 Favored 'Isoleucine or valine' 0 C--O 1.189 -2.099 0 CA-C-O 113.108 -3.33 . . . . 0.0 114.198 160.347 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.592 HG21 HD22 ' A' ' 34' ' ' LEU . 3.1 t -65.09 -50.17 75.74 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.647 1 CA-C-N 126.61 4.277 . . . . 0.0 113.888 -177.457 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 38.0 mt-30 -46.49 -57.93 4.25 Favored 'General case' 0 C--N 1.365 1.24 0 CA-C-O 114.131 -2.842 . . . . 0.0 108.949 158.377 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . 0.548 4.6 t70 -36.68 -56.2 0.84 Allowed 'General case' 0 N--CA 1.496 1.827 0 N-CA-C 118.301 2.704 . . . . 0.0 118.301 161.997 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . 0.261 . . . . . . . 0 CA--C 1.544 0.713 0 N-CA-C 118.013 2.597 . . . . 0.0 118.013 -149.2 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 21.7 Cg_exo . . . . . 0 CA--C 1.572 2.412 0 N-CA-C 115.921 1.47 . . . . 0.0 115.921 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' B' B ' 6' ' ' HIS . . . . . . . . . . . . . 80.1 m80 -96.02 145.52 25.38 Favored 'General case' 0 CA--C 1.581 2.153 0 CA-C-N 113.154 -1.839 . . . . 0.0 111.287 177.978 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 7' ' ' PHE . . . . . 0.752 ' CZ ' HD12 ' A' ' 34' ' ' LEU . 2.3 p90 -128.93 162.46 27.51 Favored 'General case' 0 CA--C 1.574 1.868 0 O-C-N 119.188 -2.195 . . . . 0.0 112.838 144.108 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 8' ' ' ASN . . . . . . . . . . . . . 7.9 p-10 -64.05 103.54 0.61 Allowed 'General case' 0 CA--C 1.572 1.789 0 O-C-N 120.153 -1.592 . . . . 0.0 115.134 171.646 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 9' ' ' PHE . . . . . 0.633 ' CG ' HD13 ' A' ' 34' ' ' LEU . 3.7 t80 -126.02 105.72 9.1 Favored 'General case' 0 CA--C 1.539 0.543 0 O-C-N 120.971 -1.08 . . . . 0.0 108.135 160.88 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 10' ' ' ARG . . . . . . . . . . . . 0.467 0.1 OUTLIER 94.64 87.39 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.596 1 O-C-N 114.081 -5.387 . . . . 0.0 109.519 -12.543 . . . . . . . . 4 3 . 1 . 005 nuclear build core ' B' B ' 11' ' ' MET . . . . . 0.599 ' SD ' HD23 ' B' ' 19' ' ' LEU . 8.5 mtm -148.84 123.85 4.94 Favored Pre-proline 0 CA--C 1.566 1.568 0 CA-C-O 117.152 -1.404 . . . . 0.0 110.201 -159.133 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 12' ' ' PRO . . . . . . . . . . . . . 77.9 Cg_exo -40.76 143.16 0.62 Allowed 'Trans proline' 0 C--N 1.371 1.76 0 C-N-CA 123.467 2.778 . . . . 0.0 116.935 162.688 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 13' ' ' MET . . . . . 0.417 ' SD ' ' HG3' ' B' ' 17' ' ' GLU . 15.4 tpp -56.35 -32.47 64.74 Favored 'General case' 0 N--CA 1.493 1.691 0 N-CA-C 118.449 2.759 . . . . 0.0 118.449 -160.712 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 14' ' ' GLU . . . . . . . . . . . . 0.281 10.3 pt-20 -60.47 -50.92 71.64 Favored 'General case' 0 N--CA 1.49 1.534 0 N-CA-C 115.87 1.804 . . . . 0.0 115.87 162.36 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 15' ' ' VAL . . . . . 0.471 HG21 HD22 ' A' ' 35' ' ' LEU . 0.2 OUTLIER -58.35 -45.21 89.57 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.265 0 CA-C-N 122.924 2.602 . . . . 0.0 113.972 177.854 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 1.1 ttt180 -74.98 -34.4 61.99 Favored 'General case' 0 CA--C 1.544 0.727 0 CA-C-O 115.912 -1.994 . . . . 0.0 116.099 173.709 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 17' ' ' GLU . . . . . 0.417 ' HG3' ' SD ' ' B' ' 13' ' ' MET . 43.4 mt-10 -63.61 -39.37 94.2 Favored 'General case' 0 N--CA 1.497 1.886 0 CA-C-N 124.206 3.185 . . . . 0.0 114.052 161.632 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 44.5 mtmt -61.52 -60.55 3.52 Favored 'General case' 0 CA--C 1.568 1.641 0 CA-C-N 120.572 1.533 . . . . 0.0 114.199 169.913 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 19' ' ' LEU . . . . . 0.607 HD21 ' HG ' ' B' ' 34' ' ' LEU . 13.9 tp -60.86 -37.72 83.1 Favored 'General case' 0 N--CA 1.488 1.469 0 N-CA-C 115.249 1.574 . . . . 0.0 115.249 175.324 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 20' ' ' LYS . . . . . . . . . . . . . 19.8 ttpt -85.51 -30.87 23.09 Favored 'General case' 0 CA--C 1.561 1.366 0 CA-C-O 117.242 -1.361 . . . . 0.0 114.252 179.949 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 20.9 m-30 -64.91 -77.04 0.06 Allowed 'General case' 0 N--CA 1.491 1.598 0 CA-C-O 113.193 -3.289 . . . . 0.0 109.668 157.62 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 22' ' ' ARG . . . . . 0.514 ' HE ' HD12 ' B' ' 37' ' ' ILE 0.316 0.0 OUTLIER -19.89 -53.44 0.01 OUTLIER 'General case' 0 CA--C 1.585 2.327 0 CA-C-N 125.776 3.898 . . . . 0.0 116.39 171.022 . . . . . . . . 4 4 . 1 . 005 nuclear build core ' B' B ' 23' ' ' ALA . . . . . 0.498 ' HB2' ' CB ' ' B' ' 33' ' ' GLU . . . -51.85 -80.63 0.01 OUTLIER 'General case' 0 CA--C 1.587 2.395 0 N-CA-C 118.978 2.955 . . . . 0.0 118.978 154.966 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 64.3 mm-40 -65.34 -35.28 80.5 Favored 'General case' 0 N--CA 1.501 2.099 0 N-CA-C 119.123 3.009 . . . . 0.0 119.123 -179.546 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 25' ' ' ALA . . . . . . . . . . . . . . . -39.25 -50.25 1.95 Allowed 'General case' 0 CA--C 1.588 2.43 0 N-CA-C 116.288 1.958 . . . . 0.0 116.288 153.38 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 26' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -95.65 -47.14 6.33 Favored 'General case' 0 CA--C 1.576 1.951 0 N-CA-C 116.592 2.071 . . . . 0.0 116.592 -174.059 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 27' ' ' GLY . . . . . . . . . . . . . . . 128.29 14.86 2.35 Favored Glycine 0 N--CA 1.498 2.822 0 N-CA-C 119.024 2.37 . . . . 0.0 119.024 -161.227 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 28' ' ' ARG . . . . . . . . . . . . . 79.0 mtm-85 -112.26 149.23 32.63 Favored 'General case' 0 N--CA 1.492 1.643 0 N-CA-C 104.779 -2.304 . . . . 0.0 104.779 168.766 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 29' ' ' SER . . . . . . . . . . . . . 92.3 p -117.93 109.58 16.68 Favored 'General case' 0 N--CA 1.503 2.185 0 O-C-N 118.053 -2.905 . . . . 0.0 105.786 -167.89 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 30' ' ' MET . . . . . . . . . . . . . 18.5 mtp -42.35 -42.73 3.27 Favored 'General case' 0 N--CA 1.499 1.985 0 N-CA-C 118.8 2.889 . . . . 0.0 118.8 -140.457 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 31' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -47.02 -42.63 18.53 Favored 'General case' 0 CA--C 1.592 2.586 0 CA-C-N 125.727 3.876 . . . . 0.0 115.556 165.444 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 32' ' ' SER . . . . . . . . . . . . 0.294 32.1 t -53.33 -67.8 0.23 Allowed 'General case' 0 N--CA 1.499 2.002 0 N-CA-C 119.048 2.981 . . . . 0.0 119.048 144.829 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 33' ' ' GLU . . . . . 0.498 ' CB ' ' HB2' ' B' ' 23' ' ' ALA . 0.1 OUTLIER -62.36 -59.85 4.4 Favored 'General case' 0 N--CA 1.513 2.687 0 CA-C-N 124.112 3.142 . . . . 0.0 117.066 -178.569 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 34' ' ' LEU . . . . . 0.809 HD12 ' CZ ' ' A' ' 7' ' ' PHE . 0.1 OUTLIER -34.74 -56.96 0.54 Allowed 'General case' 0 CA--C 1.547 0.832 0 CA-C-O 115.413 -2.232 . . . . 0.0 109.61 164.426 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 35' ' ' LEU . . . . . 0.412 ' HA ' HD23 ' B' ' 35' ' ' LEU . 10.1 mt -61.55 -49.28 77.31 Favored 'General case' 0 C--N 1.367 1.359 0 CA-C-N 123.145 2.702 . . . . 0.0 116.164 177.055 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 36' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -54.92 -52.88 61.58 Favored 'General case' 0 CA--C 1.574 1.901 0 CA-C-O 116.874 -1.536 . . . . 0.0 114.026 173.95 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 37' ' ' ILE . . . . . 0.514 HD12 ' HE ' ' B' ' 22' ' ' ARG . 4.3 tt -64.29 -30.71 50.88 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.861 0 CA-C-N 122.546 2.43 . . . . 0.0 115.957 168.821 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 38' ' ' VAL . . . . . 0.538 HG13 HD22 ' A' ' 19' ' ' LEU . 3.5 t -73.96 -46.75 45.19 Favored 'Isoleucine or valine' 0 CA--C 1.575 1.923 0 CA-C-N 121.441 1.928 . . . . 0.0 110.967 -179.71 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 31.2 mt-30 -52.08 -43.07 63.68 Favored 'General case' 0 CA--C 1.572 1.801 0 N-CA-C 114.13 1.159 . . . . 0.0 114.13 155.413 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 40' ' ' ASP . . . . . . . . . . . . 0.385 15.6 m-20 -53.53 -42.01 66.99 Favored 'General case' 0 N--CA 1.495 1.817 0 N-CA-C 116.782 2.141 . . . . 0.0 116.782 156.055 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 41' ' ' ALA . . . . . 0.505 ' HB3' ' HA ' ' B' ' 38' ' ' VAL . . . -70.34 -38.2 74.82 Favored 'General case' 0 CA--C 1.562 1.427 0 N-CA-C 115.27 1.581 . . . . 0.0 115.27 -171.609 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 42' ' ' LEU . . . . . 0.493 HD11 ' HB2' ' A' ' 19' ' ' LEU . 3.8 mt . . . . . 0 CA--C 1.565 1.535 0 C-N-CA 125.635 1.574 . . . . 0.0 114.258 174.066 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 6.7 p-10 . . . . . 0 CA--C 1.567 1.601 0 CA-C-O 119.226 -0.416 . . . . 0.0 111.155 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 5.5 Cg_exo -100.19 146.1 0.39 Allowed 'Trans proline' 0 C--N 1.366 1.476 0 C-N-CA 122.065 1.844 . . . . 0.0 112.618 -160.58 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 66.1 m80 -68.31 146.79 52.96 Favored 'General case' 0 N--CA 1.485 1.294 0 N-CA-C 114.415 1.265 . . . . 0.0 114.415 -179.971 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 7' ' ' PHE . . . . . 0.846 ' CZ ' HD12 ' B' ' 34' ' ' LEU . 20.2 p90 -138.62 160.12 40.4 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 120.918 -1.114 . . . . 0.0 112.336 135.275 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 21.1 m120 -55.22 100.81 0.04 OUTLIER 'General case' 0 CA--C 1.572 1.808 0 N-CA-C 114.869 1.433 . . . . 0.0 114.869 174.168 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' PHE . . . . . 0.643 ' CD2' HD13 ' B' ' 34' ' ' LEU . 10.1 t80 -130.97 103.78 6.74 Favored 'General case' 0 C--N 1.34 0.179 0 N-CA-C 106.685 -1.598 . . . . 0.0 106.685 165.479 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . 0.495 0.0 OUTLIER 88.42 68.66 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.691 1 O-C-N 114.367 -5.208 . . . . 0.0 112.533 -9.774 . . . . . . . . 4 3 . 1 . 006 nuclear build core ' A' A ' 11' ' ' MET . . . . . 0.611 ' SD ' HD23 ' A' ' 19' ' ' LEU . 8.4 ptp -144.02 116.77 5.71 Favored Pre-proline 0 CA--C 1.571 1.779 0 CA-C-O 115.114 -2.374 . . . . 0.0 109.27 -164.545 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 63.3 Cg_exo -34.69 143.94 0.06 OUTLIER 'Trans proline' 0 C--N 1.379 2.176 0 C-N-CA 124.667 3.578 . . . . 0.0 119.631 -172.564 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' MET . . . . . 0.408 ' SD ' ' HG3' ' A' ' 17' ' ' GLU . 4.4 tpp -44.35 -41.59 6.2 Favored 'General case' 0 CA--C 1.581 2.141 0 N-CA-C 116.598 2.073 . . . . 0.0 116.598 -161.042 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -63.43 -44.29 95.01 Favored 'General case' 0 CA--C 1.571 1.788 0 N-CA-C 117.379 2.363 . . . . 0.0 117.379 167.979 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 1.6 t -54.56 -45.15 71.21 Favored 'Isoleucine or valine' 0 N--CA 1.513 2.705 0 CA-C-N 122.935 2.607 . . . . 0.0 113.301 169.63 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 7.1 ttt180 -74.87 -43.25 55.43 Favored 'General case' 0 C--O 1.212 -0.918 0 CA-C-O 116.107 -1.902 . . . . 0.0 115.093 174.908 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' GLU . . . . . 0.408 ' HG3' ' SD ' ' A' ' 13' ' ' MET . 47.9 mt-10 -58.26 -32.1 68.05 Favored 'General case' 0 N--CA 1.493 1.681 0 CA-C-N 124.126 3.148 . . . . 0.0 115.266 163.296 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . 0.292 54.1 mtmt -67.82 -54.0 22.52 Favored 'General case' 0 CA--C 1.564 1.516 0 CA-C-N 121.112 1.778 . . . . 0.0 114.737 166.182 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.663 HD21 ' HG ' ' A' ' 34' ' ' LEU 0.288 14.9 tp -67.08 -33.84 76.37 Favored 'General case' 0 CA--C 1.574 1.874 0 N-CA-C 115.254 1.576 . . . . 0.0 115.254 175.632 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.496 ' HB2' ' SD ' ' A' ' 30' ' ' MET . 15.0 ttpt -91.71 -28.58 17.34 Favored 'General case' 0 CA--C 1.555 1.162 0 C-N-CA 126.788 2.035 . . . . 0.0 114.143 -178.671 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 22.1 m-30 -63.18 -71.21 0.17 Allowed 'General case' 0 N--CA 1.49 1.526 0 CA-C-O 113.265 -3.255 . . . . 0.0 109.383 153.841 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . 0.304 0.0 OUTLIER -25.09 -53.35 0.04 OUTLIER 'General case' 0 CA--C 1.587 2.399 0 CA-C-N 125.71 3.868 . . . . 0.0 116.158 171.393 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.524 ' HB2' ' HB3' ' A' ' 33' ' ' GLU . . . -50.61 -79.22 0.02 OUTLIER 'General case' 0 CA--C 1.585 2.296 0 N-CA-C 119.806 3.261 . . . . 0.0 119.806 154.557 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 75.2 mm-40 . . . . . 0 N--CA 1.499 2.007 0 N-CA-C 118.809 2.892 . . . . 0.0 118.809 -177.251 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 32.4 mtm-85 . . . . . 0 N--CA 1.492 1.653 0 CA-C-O 122.42 1.105 . . . . 0.0 108.17 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 8.6 t -123.76 116.78 23.57 Favored 'General case' 0 N--CA 1.496 1.841 0 N-CA-C 105.206 -2.146 . . . . 0.0 105.206 -177.952 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' MET . . . . . 0.496 ' SD ' ' HB2' ' A' ' 20' ' ' LYS . 13.2 mtp -43.38 -42.57 4.7 Favored 'General case' 0 N--CA 1.497 1.908 0 N-CA-C 119.101 3.0 . . . . 0.0 119.101 -143.886 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . 0.258 0.1 OUTLIER -48.09 -41.97 27.65 Favored 'General case' 0 CA--C 1.592 2.594 0 CA-C-N 125.255 3.661 . . . . 0.0 114.957 166.522 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . 0.333 34.8 t -52.6 -64.04 0.95 Allowed 'General case' 0 N--CA 1.499 2.005 0 N-CA-C 120.507 3.521 . . . . 0.0 120.507 145.569 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 33' ' ' GLU . . . . . 0.524 ' HB3' ' HB2' ' A' ' 23' ' ' ALA . 2.8 tp10 -72.48 -53.24 12.66 Favored 'General case' 0 N--CA 1.512 2.639 0 CA-C-N 123.461 2.846 . . . . 0.0 117.852 -177.523 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.663 ' HG ' HD21 ' A' ' 19' ' ' LEU . 0.2 OUTLIER -38.47 -54.18 1.5 Allowed 'General case' 0 CA--C 1.554 1.133 0 CA-C-O 115.773 -2.06 . . . . 0.0 109.429 162.097 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.518 HD21 ' HG2' ' B' ' 11' ' ' MET . 15.1 mt -63.38 -54.96 28.66 Favored 'General case' 0 C--N 1.37 1.481 0 CA-C-N 123.51 2.868 . . . . 0.0 114.935 176.398 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -52.4 -44.32 65.29 Favored 'General case' 0 CA--C 1.564 1.512 0 CA-C-O 116.818 -1.563 . . . . 0.0 115.04 175.868 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -68.58 -41.08 82.71 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.533 0 CA-C-N 121.946 2.157 . . . . 0.0 114.532 169.928 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.407 HG21 HD22 ' A' ' 34' ' ' LEU . 3.8 t -71.76 -46.24 62.37 Favored 'Isoleucine or valine' 0 CA--C 1.583 2.218 0 CA-C-N 121.393 1.906 . . . . 0.0 111.241 -178.108 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 26.5 mt-30 -51.8 -43.05 62.92 Favored 'General case' 0 N--CA 1.488 1.465 0 C-N-CA 124.65 1.18 . . . . 0.0 114.134 156.261 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . 0.459 24.2 m-20 -46.5 -56.47 5.93 Favored 'General case' 0 N--CA 1.488 1.461 0 N-CA-C 114.225 1.195 . . . . 0.0 114.225 155.622 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . 0.362 . . . . . . . 0 CA--C 1.543 0.704 0 N-CA-C 118.526 2.787 . . . . 0.0 118.526 -154.634 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 5' ' ' PRO . . . . . . . . . . . . 0.619 7.6 Cg_exo . . . . . 0 N--CA 1.492 1.407 1 N-CA-C 126.262 5.447 . . . . 0.0 126.262 . . . . . . . . . 2 1 . 1 . 006 nuclear build core ' B' B ' 6' ' ' HIS . . . . . . . . . . . . . 72.0 m-70 -75.17 111.73 10.71 Favored 'General case' 0 CA--C 1.564 1.503 0 N-CA-C 115.508 1.67 . . . . 0.0 115.508 -149.396 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 7' ' ' PHE . . . . . 0.607 ' CZ ' HD12 ' A' ' 34' ' ' LEU 0.292 30.7 p90 -122.09 -166.22 1.37 Allowed 'General case' 0 CA--C 1.563 1.462 0 O-C-N 120.35 -1.469 . . . . 0.0 108.919 128.772 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 8' ' ' ASN . . . . . . . . . . . . . 34.6 m-20 -116.09 105.65 12.85 Favored 'General case' 0 CA--C 1.555 1.166 0 O-C-N 120.102 -1.624 . . . . 0.0 107.37 166.598 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 9' ' ' PHE . . . . . 0.632 ' CE2' HD22 ' A' ' 34' ' ' LEU 0.25 5.0 t80 -71.75 92.72 1.22 Allowed 'General case' 0 CA--C 1.576 1.977 0 CA-C-O 126.676 3.131 . . . . 0.0 113.256 176.126 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 10' ' ' ARG . . . . . . . . . . . . . 28.5 ptt85 -81.9 130.14 34.98 Favored 'General case' 0 N--CA 1.48 1.05 1 CA-C-N 108.291 -4.05 . . . . 0.0 111.256 168.498 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 11' ' ' MET . . . . . 0.551 ' HE2' ' CD2' ' B' ' 9' ' ' PHE . 28.3 mtm -136.44 121.91 13.31 Favored Pre-proline 0 CA--C 1.565 1.527 0 CA-C-O 117.509 -1.234 . . . . 0.0 111.7 -163.703 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 12' ' ' PRO . . . . . . . . . . . . . 80.3 Cg_exo -43.66 145.03 1.95 Allowed 'Trans proline' 0 C--N 1.378 2.123 0 C-N-CA 123.913 3.076 . . . . 0.0 116.02 169.23 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 13' ' ' MET . . . . . . . . . . . . . 15.7 tpp -60.8 -34.06 73.93 Favored 'General case' 0 N--CA 1.492 1.655 0 N-CA-C 117.083 2.253 . . . . 0.0 117.083 -150.559 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -59.7 -49.31 78.23 Favored 'General case' 0 CA--C 1.573 1.861 0 N-CA-C 117.688 2.477 . . . . 0.0 117.688 161.335 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -58.28 -48.06 85.91 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.453 0 CA-C-N 123.369 2.804 . . . . 0.0 113.331 174.253 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 4.2 ttt180 -71.21 -37.23 72.08 Favored 'General case' 0 C--O 1.216 -0.703 0 CA-C-O 115.951 -1.976 . . . . 0.0 115.519 173.024 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 17' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -60.6 -35.81 77.02 Favored 'General case' 0 CA--C 1.569 1.709 0 CA-C-N 124.119 3.145 . . . . 0.0 114.185 161.578 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . 0.291 44.1 mtmt -67.79 -48.71 65.54 Favored 'General case' 0 CA--C 1.566 1.574 0 CA-C-N 121.443 1.929 . . . . 0.0 115.483 169.55 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 19' ' ' LEU . . . . . 0.451 ' HB3' ' CE ' ' B' ' 30' ' ' MET 0.278 0.4 OUTLIER -70.49 -36.29 73.73 Favored 'General case' 0 CA--C 1.574 1.891 0 CA-C-N 120.904 1.684 . . . . 0.0 115.06 173.604 . . . . . . . . 4 4 . 1 . 006 nuclear build core ' B' B ' 20' ' ' LYS . . . . . 0.439 ' HB2' ' SD ' ' B' ' 30' ' ' MET . 15.8 ttpt -88.34 -27.89 21.35 Favored 'General case' 0 CA--C 1.555 1.168 0 C-N-CA 125.822 1.649 . . . . 0.0 113.682 178.729 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 22.1 m-30 -64.09 -72.89 0.13 Allowed 'General case' 0 N--CA 1.49 1.545 1 CA-C-O 111.469 -4.11 . . . . 0.0 109.598 156.052 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . 0.253 12.0 tpp180 -13.19 -61.04 0.01 OUTLIER 'General case' 0 CA--C 1.592 2.558 1 CA-C-N 127.07 4.487 . . . . 0.0 116.34 164.519 . . . . . . . . 3 2 . 1 . 006 nuclear build core ' B' B ' 23' ' ' ALA . . . . . 0.426 ' HB2' ' CB ' ' B' ' 33' ' ' GLU . . . -54.96 -75.86 0.03 OUTLIER 'General case' 0 CA--C 1.59 2.486 0 N-CA-C 119.29 3.07 . . . . 0.0 119.29 160.561 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 52.6 mt-10 -68.46 -34.77 76.54 Favored 'General case' 0 N--CA 1.504 2.263 0 N-CA-C 118.819 2.896 . . . . 0.0 118.819 -179.345 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 25' ' ' ALA . . . . . . . . . . . . . . . -38.31 -46.87 1.15 Allowed 'General case' 0 CA--C 1.579 2.062 0 N-CA-C 115.973 1.842 . . . . 0.0 115.973 152.321 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 26' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -98.66 -51.21 3.99 Favored 'General case' 0 CA--C 1.577 1.984 0 N-CA-C 117.458 2.392 . . . . 0.0 117.458 -173.651 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 27' ' ' GLY . . . . . . . . . . . . . . . 117.69 23.47 3.68 Favored Glycine 0 CA--C 1.563 3.082 0 N-CA-C 119.575 2.59 . . . . 0.0 119.575 -151.251 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 28' ' ' ARG . . . . . 0.517 HH21 ' HG3' ' B' ' 36' ' ' GLN . 16.8 mtt85 -112.47 147.44 36.52 Favored 'General case' 0 CA--C 1.572 1.821 0 N-CA-C 103.769 -2.678 . . . . 0.0 103.769 158.984 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 29' ' ' SER . . . . . . . . . . . . . 35.6 t -113.42 112.18 23.2 Favored 'General case' 0 N--CA 1.505 2.302 0 O-C-N 117.793 -3.067 . . . . 0.0 105.67 -172.884 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 30' ' ' MET . . . . . 0.451 ' CE ' ' HB3' ' B' ' 19' ' ' LEU . 22.7 mtp -40.65 -45.61 2.4 Favored 'General case' 0 N--CA 1.5 2.038 0 N-CA-C 118.822 2.897 . . . . 0.0 118.822 -144.364 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 31' ' ' ASN . . . . . . . . . . . . . 20.0 t-20 -44.44 -44.03 8.18 Favored 'General case' 0 CA--C 1.594 2.673 0 CA-C-N 125.494 3.77 . . . . 0.0 115.576 165.045 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 32' ' ' SER . . . . . . . . . . . . 0.279 56.3 m -57.36 -60.42 3.67 Favored 'General case' 0 N--CA 1.5 2.034 0 N-CA-C 120.7 3.593 . . . . 0.0 120.7 148.464 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 33' ' ' GLU . . . . . 0.426 ' CB ' ' HB2' ' B' ' 23' ' ' ALA . 0.1 OUTLIER -67.49 -61.64 1.8 Allowed 'General case' 0 N--CA 1.51 2.542 0 CA-C-N 123.666 2.939 . . . . 0.0 115.293 177.667 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 34' ' ' LEU . . . . . 0.846 HD12 ' CZ ' ' A' ' 7' ' ' PHE . 0.0 OUTLIER -32.17 -53.78 0.3 Allowed 'General case' 0 N--CA 1.481 1.091 0 CA-C-O 115.289 -2.291 . . . . 0.0 109.266 163.967 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 35' ' ' LEU . . . . . 0.59 HD21 ' HB2' ' A' ' 11' ' ' MET . 11.8 mt -62.28 -54.42 41.01 Favored 'General case' 0 C--N 1.368 1.382 0 CA-C-N 123.528 2.876 . . . . 0.0 115.053 176.275 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 36' ' ' GLN . . . . . 0.517 ' HG3' HH21 ' B' ' 28' ' ' ARG . 0.9 OUTLIER -59.86 -39.46 85.29 Favored 'General case' 0 CA--C 1.569 1.679 0 CA-C-O 116.302 -1.809 . . . . 0.0 115.582 175.479 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 37' ' ' ILE . . . . . 0.454 ' HA ' ' HB3' ' B' ' 40' ' ' ASP . 10.4 tt -68.55 -26.3 33.02 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.622 0 CA-C-N 123.452 2.842 . . . . 0.0 115.253 162.668 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 38' ' ' VAL . . . . . 0.507 ' CG1' HD22 ' A' ' 19' ' ' LEU . 4.3 t -86.68 -47.05 16.36 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.094 0 CA-C-N 125.037 3.562 . . . . 0.0 112.77 -178.891 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 27.8 mt-30 -46.07 -49.37 16.5 Favored 'General case' 0 N--CA 1.484 1.269 0 CA-C-O 116.119 -1.896 . . . . 0.0 113.068 150.961 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 40' ' ' ASP . . . . . 0.454 ' HB3' ' HA ' ' B' ' 37' ' ' ILE 0.374 50.1 t0 -44.01 -61.3 1.5 Allowed 'General case' 0 N--CA 1.494 1.76 0 CA-C-N 120.892 1.678 . . . . 0.0 114.638 154.533 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -82.62 19.21 1.33 Allowed 'General case' 0 CA--C 1.55 0.98 0 N-CA-C 120.556 3.539 . . . . 0.0 120.556 -162.39 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.484 1.232 0 N-CA-C 116.358 1.985 . . . . 0.0 116.358 143.772 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 . . . . . 0 CA--C 1.57 1.717 0 N-CA-C 108.12 -1.067 . . . . 0.0 108.12 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 5.7 Cg_exo -99.74 146.61 0.45 Allowed 'Trans proline' 0 C--N 1.366 1.473 0 CA-C-N 122.688 1.996 . . . . 0.0 113.782 -154.049 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 73.5 m80 -67.56 137.35 55.64 Favored 'General case' 0 CA--C 1.564 1.508 0 CA-C-N 114.377 -1.283 . . . . 0.0 113.383 173.031 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 7' ' ' PHE . . . . . 0.726 ' CZ ' HD12 ' B' ' 34' ' ' LEU 0.267 27.5 p90 -120.52 167.74 12.08 Favored 'General case' 0 CA--C 1.562 1.415 0 O-C-N 119.557 -1.965 . . . . 0.0 110.576 115.314 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 98.5 m-20 -89.99 90.87 8.34 Favored 'General case' 0 N--CA 1.487 1.411 0 O-C-N 119.695 -1.878 . . . . 0.0 108.059 166.365 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 9' ' ' PHE . . . . . 0.658 ' CD2' HD13 ' B' ' 34' ' ' LEU . 8.5 t80 -63.67 150.77 43.57 Favored 'General case' 0 CA--C 1.557 1.217 0 CA-C-O 125.457 2.551 . . . . 0.0 112.344 168.749 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -154.32 94.55 1.73 Allowed 'General case' 0 C--N 1.307 -1.28 0 CA-C-N 111.616 -2.538 . . . . 0.0 107.825 -139.539 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 11' ' ' MET . . . . . 0.504 ' SD ' ' CD2' ' A' ' 9' ' ' PHE . 0.8 OUTLIER -114.77 115.59 43.71 Favored Pre-proline 0 CA--C 1.56 1.352 0 CA-C-O 117.219 -1.372 . . . . 0.0 111.785 -158.796 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 80.8 Cg_exo -42.47 140.61 2.55 Favored 'Trans proline' 0 CA--C 1.56 1.81 0 C-N-CA 122.79 2.327 . . . . 0.0 115.772 161.233 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' MET . . . . . 0.409 ' SD ' ' HG3' ' A' ' 17' ' ' GLU . 22.9 tpp -55.68 -32.36 63.19 Favored 'General case' 0 N--CA 1.492 1.668 0 N-CA-C 118.376 2.732 . . . . 0.0 118.376 -157.671 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . 0.256 9.4 pt-20 -60.9 -46.49 90.45 Favored 'General case' 0 CA--C 1.568 1.66 0 N-CA-C 116.568 2.062 . . . . 0.0 116.568 162.186 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.432 ' CG1' HG12 ' B' ' 38' ' ' VAL . 0.6 OUTLIER -57.24 -49.6 79.35 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.234 0 CA-C-N 122.925 2.602 . . . . 0.0 112.82 172.7 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 1.4 ttt180 -72.39 -33.95 67.56 Favored 'General case' 0 C--O 1.216 -0.703 0 CA-C-O 116.086 -1.911 . . . . 0.0 115.433 175.39 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' GLU . . . . . 0.409 ' HG3' ' SD ' ' A' ' 13' ' ' MET . 39.6 mt-10 -61.89 -40.32 95.01 Favored 'General case' 0 CA--C 1.566 1.563 0 CA-C-N 124.062 3.119 . . . . 0.0 114.53 161.093 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . 0.255 46.3 mtmt -67.92 -48.5 65.79 Favored 'General case' 0 CA--C 1.564 1.484 0 CA-C-N 121.577 1.989 . . . . 0.0 115.366 173.024 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.614 ' HB3' ' CE ' ' A' ' 30' ' ' MET 0.365 0.2 OUTLIER -68.16 -37.3 80.86 Favored 'General case' 0 CA--C 1.574 1.876 0 C-N-CA 124.791 1.236 . . . . 0.0 112.461 172.362 . . . . . . . . 4 4 . 1 . 007 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.523 ' HA ' ' HB3' ' A' ' 23' ' ' ALA . 27.8 ttpt -90.17 -22.83 21.52 Favored 'General case' 0 CA--C 1.567 1.612 0 O-C-N 119.155 -2.216 . . . . 0.0 115.382 179.534 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 14.8 m-85 -62.8 -68.02 0.37 Allowed 'General case' 0 N--CA 1.492 1.657 0 CA-C-O 114.009 -2.901 . . . . 0.0 110.511 151.88 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.417 ' HE ' HG13 ' A' ' 37' ' ' ILE 0.349 32.2 ttt85 -28.45 -45.19 0.03 OUTLIER 'General case' 0 CA--C 1.601 2.933 0 CA-C-N 125.682 3.856 . . . . 0.0 116.917 166.635 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.523 ' HB3' ' HA ' ' A' ' 20' ' ' LYS 0.288 . . -54.2 -80.29 0.02 OUTLIER 'General case' 0 CA--C 1.58 2.103 0 N-CA-C 118.111 2.634 . . . . 0.0 118.111 153.796 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 51.8 mm-40 . . . . . 0 CA--C 1.578 2.049 0 N-CA-C 118.742 2.867 . . . . 0.0 118.742 -178.3 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 75.7 mtm180 . . . . . 0 CA--C 1.576 1.975 0 N-CA-C 104.308 -2.479 . . . . 0.0 104.308 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 77.3 p -126.03 109.85 12.88 Favored 'General case' 0 N--CA 1.509 2.508 0 O-C-N 117.47 -3.269 . . . . 0.0 107.654 -171.822 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' MET . . . . . 0.614 ' CE ' ' HB3' ' A' ' 19' ' ' LEU . 0.1 OUTLIER -45.56 -38.52 6.53 Favored 'General case' 0 N--CA 1.496 1.863 0 N-CA-C 120.265 3.432 . . . . 0.0 120.265 -137.739 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 11.0 t-20 -47.3 -46.51 25.14 Favored 'General case' 0 CA--C 1.597 2.771 0 CA-C-N 124.931 3.514 . . . . 0.0 114.411 163.808 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . 0.314 17.5 t -48.77 -76.22 0.02 OUTLIER 'General case' 0 N--CA 1.5 2.05 0 N-CA-C 117.582 2.438 . . . . 0.0 117.582 143.923 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 33' ' ' GLU . . . . . 0.458 ' HB3' ' HB2' ' A' ' 23' ' ' ALA . 10.6 tm-20 -60.74 -53.58 55.66 Favored 'General case' 0 N--CA 1.506 2.351 0 CA-C-N 123.559 2.89 . . . . 0.0 118.745 -172.104 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.644 HD13 ' CG ' ' B' ' 9' ' ' PHE . 0.2 OUTLIER -42.99 -53.98 4.49 Favored 'General case' 0 CA--C 1.567 1.618 0 CA-C-O 115.699 -2.096 . . . . 0.0 106.244 167.52 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.481 ' HG ' ' CE1' ' B' ' 9' ' ' PHE . 19.7 mt -62.93 -44.56 95.75 Favored 'General case' 0 C--N 1.375 1.701 0 CA-C-N 124.093 3.133 . . . . 0.0 115.759 177.545 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 36' ' ' GLN . . . . . 0.437 ' O ' ' HB2' ' A' ' 40' ' ' ASP . 0.0 OUTLIER -61.47 -44.46 97.06 Favored 'General case' 0 N--CA 1.48 1.046 0 CA-C-O 115.632 -2.128 . . . . 0.0 113.8 177.892 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 37' ' ' ILE . . . . . 0.417 HG13 ' HE ' ' A' ' 22' ' ' ARG . 0.4 OUTLIER -69.79 -35.12 63.74 Favored 'Isoleucine or valine' 0 CA--C 1.564 1.504 0 CA-C-N 121.278 1.853 . . . . 0.0 115.027 165.95 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.584 HG21 HD22 ' A' ' 34' ' ' LEU . 6.6 t -76.51 -46.56 31.55 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.839 0 CA-C-N 121.93 2.15 . . . . 0.0 111.641 -173.147 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 14.0 tp60 -62.61 -36.77 83.82 Favored 'General case' 0 CA--C 1.567 1.613 0 O-C-N 121.142 -0.974 . . . . 0.0 112.957 160.58 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 40' ' ' ASP . . . . . 0.437 ' HB2' ' O ' ' A' ' 36' ' ' GLN 0.446 0.3 OUTLIER -41.35 -53.4 3.3 Favored 'General case' 0 N--CA 1.502 2.164 0 N-CA-C 116.467 2.025 . . . . 0.0 116.467 149.101 . . . . . . . . 4 4 . 1 . 007 nuclear build core ' A' A ' 41' ' ' ALA . . . . . 0.408 ' HB3' ' HA ' ' A' ' 38' ' ' VAL . . . . . . . . 0 CA--C 1.553 1.092 0 N-CA-C 118.031 2.604 . . . . 0.0 118.031 -164.722 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 7.3 Cg_exo . . . . . 0 CA--C 1.553 1.442 0 N-CA-C 115.514 1.313 . . . . 0.0 115.514 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' B' B ' 6' ' ' HIS . . . . . . . . . . . . . 80.3 m80 -79.51 126.19 30.55 Favored 'General case' 0 CA--C 1.566 1.575 0 CA-C-N 113.99 -1.459 . . . . 0.0 112.277 175.278 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 7' ' ' PHE . . . . . 0.591 ' CZ ' HD12 ' A' ' 34' ' ' LEU . 0.8 OUTLIER -128.93 155.61 45.04 Favored 'General case' 0 CA--C 1.567 1.609 0 O-C-N 120.655 -1.278 . . . . 0.0 111.067 154.322 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 8' ' ' ASN . . . . . . . . . . . . . 6.7 p-10 -59.18 103.27 0.17 Allowed 'General case' 0 CA--C 1.575 1.904 0 N-CA-C 115.709 1.744 . . . . 0.0 115.709 171.15 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 9' ' ' PHE . . . . . 0.644 ' CG ' HD13 ' A' ' 34' ' ' LEU . 2.6 t80 -126.49 104.95 8.42 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 124.515 1.126 . . . . 0.0 108.557 158.365 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 10' ' ' ARG . . . . . . . . . . . . 0.472 34.8 tpt85 97.66 83.55 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.784 1 O-C-N 113.746 -5.596 . . . . 0.0 111.297 -19.161 . . . . . . . . 3 2 . 1 . 007 nuclear build core ' B' B ' 11' ' ' MET . . . . . 0.455 ' HG2' HD21 ' A' ' 35' ' ' LEU . 16.1 mtt -151.5 130.13 6.25 Favored Pre-proline 0 CA--C 1.567 1.621 0 CA-C-O 117.26 -1.352 . . . . 0.0 110.46 -155.842 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 12' ' ' PRO . . . . . . . . . . . . . 83.8 Cg_exo -43.92 147.87 1.16 Allowed 'Trans proline' 0 CA--C 1.559 1.734 0 C-N-CA 123.172 2.582 . . . . 0.0 117.971 168.101 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 13' ' ' MET . . . . . . . . . . . . . 2.0 tpt -47.27 -39.84 15.4 Favored 'General case' 0 CA--C 1.575 1.917 0 N-CA-C 117.867 2.543 . . . . 0.0 117.867 -166.393 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -63.85 -50.92 66.97 Favored 'General case' 0 N--CA 1.487 1.421 0 N-CA-C 116.722 2.119 . . . . 0.0 116.722 171.15 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 15' ' ' VAL . . . . . 0.466 HG12 HG12 ' A' ' 38' ' ' VAL . 0.0 OUTLIER -59.35 -51.15 76.04 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.612 0 CA-C-N 121.145 1.793 . . . . 0.0 113.65 176.522 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -67.0 -31.63 72.32 Favored 'General case' 0 CA--C 1.547 0.847 0 CA-C-O 115.987 -1.959 . . . . 0.0 116.266 170.811 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 17' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -60.23 -47.47 85.82 Favored 'General case' 0 N--CA 1.492 1.629 0 CA-C-N 123.775 2.989 . . . . 0.0 113.822 160.691 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . 0.671 3.9 pttt -72.13 -35.43 69.1 Favored 'General case' 0 CA--C 1.568 1.641 0 N-CA-C 118.359 2.726 . . . . 0.0 118.359 177.459 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 19' ' ' LEU . . . . . 0.646 ' HB3' ' HE1' ' B' ' 30' ' ' MET 0.361 0.4 OUTLIER -68.81 -40.13 79.7 Favored 'General case' 0 CA--C 1.587 2.37 0 O-C-N 120.753 -1.217 . . . . 0.0 113.637 164.568 . . . . . . . . 4 4 . 1 . 007 nuclear build core ' B' B ' 20' ' ' LYS . . . . . . . . . . . . . 28.8 ttpt -88.75 -30.39 19.09 Favored 'General case' 0 CA--C 1.56 1.358 0 O-C-N 120.135 -1.603 . . . . 0.0 115.09 -177.368 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 35.5 m-85 -58.52 -69.61 0.18 Allowed 'General case' 0 N--CA 1.49 1.526 0 CA-C-O 112.211 -3.757 . . . . 0.0 110.387 153.708 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . 0.295 23.5 ttt180 -21.99 -56.76 0.03 OUTLIER 'General case' 0 CA--C 1.589 2.46 1 CA-C-N 126.717 4.326 . . . . 0.0 116.579 168.219 . . . . . . . . 3 2 . 1 . 007 nuclear build core ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -51.99 -71.94 0.06 Allowed 'General case' 0 CA--C 1.575 1.927 0 N-CA-C 121.199 3.778 . . . . 0.0 121.199 157.544 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 66.7 mm-40 -73.25 -32.11 64.52 Favored 'General case' 0 N--CA 1.497 1.917 0 N-CA-C 118.019 2.6 . . . . 0.0 118.019 -177.996 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 25' ' ' ALA . . . . . . . . . . . . . . . -41.71 -48.36 4.17 Favored 'General case' 0 CA--C 1.578 2.023 0 N-CA-C 116.775 2.139 . . . . 0.0 116.775 151.462 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 26' ' ' ASN . . . . . . . . . . . . 0.253 0.1 OUTLIER -93.82 -41.2 9.77 Favored 'General case' 0 CA--C 1.581 2.169 0 N-CA-C 116.862 2.171 . . . . 0.0 116.862 -179.349 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 27' ' ' GLY . . . . . . . . . . . . . . . 113.94 49.98 0.52 Allowed Glycine 0 N--CA 1.497 2.72 0 N-CA-C 116.152 1.221 . . . . 0.0 116.152 -167.218 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 28' ' ' ARG . . . . . . . . . . . . . 5.2 ttt85 -156.24 86.95 1.03 Allowed 'General case' 0 N--CA 1.496 1.837 0 N-CA-C 106.817 -1.549 . . . . 0.0 106.817 -164.826 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 29' ' ' SER . . . . . . . . . . . . . 12.3 t -81.9 129.57 34.8 Favored 'General case' 0 N--CA 1.5 2.027 0 O-C-N 118.58 -2.575 . . . . 0.0 107.747 -150.95 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 30' ' ' MET . . . . . 0.646 ' HE1' ' HB3' ' B' ' 19' ' ' LEU . 0.0 OUTLIER -46.62 -39.79 11.84 Favored 'General case' 0 N--CA 1.496 1.871 0 N-CA-C 119.546 3.165 . . . . 0.0 119.546 -143.349 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 31' ' ' ASN . . . . . . . . . . . . 0.261 0.1 OUTLIER -48.55 -39.38 23.37 Favored 'General case' 0 CA--C 1.589 2.456 0 CA-C-N 125.781 3.9 . . . . 0.0 114.997 166.332 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 32' ' ' SER . . . . . . . . . . . . 0.319 33.5 t -56.77 -67.19 0.33 Allowed 'General case' 0 CA--C 1.576 1.952 0 N-CA-C 119.39 3.108 . . . . 0.0 119.39 147.385 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . 0.25 6.2 tp10 -66.23 -55.1 17.83 Favored 'General case' 0 N--CA 1.52 3.068 0 CA-C-N 124.963 3.529 . . . . 0.0 115.809 -178.298 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 34' ' ' LEU . . . . . 0.726 HD12 ' CZ ' ' A' ' 7' ' ' PHE . 0.1 OUTLIER -39.71 -54.91 2.0 Favored 'General case' 0 CA--C 1.553 1.086 0 CA-C-O 115.057 -2.401 . . . . 0.0 108.086 167.239 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 35' ' ' LEU . . . . . . . . . . . . . 11.6 mt -63.08 -54.66 34.5 Favored 'General case' 0 C--N 1.373 1.622 0 CA-C-N 124.485 3.312 . . . . 0.0 115.124 177.533 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 36' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -56.59 -38.13 71.59 Favored 'General case' 0 CA--C 1.566 1.592 0 N-CA-C 115.484 1.661 . . . . 0.0 115.484 177.858 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 37' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -69.66 -38.05 75.48 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.474 0 N-CA-C 115.658 1.725 . . . . 0.0 115.658 164.885 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 38' ' ' VAL . . . . . 0.477 HG21 HD22 ' B' ' 34' ' ' LEU . 3.1 t -73.83 -48.07 40.87 Favored 'Isoleucine or valine' 0 CA--C 1.577 1.989 0 C-N-CA 127.14 2.176 . . . . 0.0 111.732 -178.849 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -47.17 -51.44 18.28 Favored 'General case' 0 CA--C 1.556 1.208 0 CA-C-O 117.508 -1.234 . . . . 0.0 113.427 153.416 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 40' ' ' ASP . . . . . . . . . . . . 0.936 0.5 OUTLIER -52.14 -37.41 54.32 Favored 'General case' 0 CA--C 1.573 1.833 0 N-CA-C 118.879 2.918 . . . . 0.0 118.879 160.706 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 41' ' ' ALA . . . . . 0.428 ' HB3' ' HA ' ' B' ' 38' ' ' VAL . . . -68.86 -49.01 61.94 Favored 'General case' 0 CA--C 1.554 1.126 0 N-CA-C 115.892 1.812 . . . . 0.0 115.892 -170.263 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 1.4 pp . . . . . 0 CA--C 1.566 1.585 0 N-CA-C 117.534 2.42 . . . . 0.0 117.534 178.364 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 23.8 p-10 . . . . . 0 CA--C 1.57 1.745 0 N-CA-C 113.18 0.807 . . . . 0.0 113.18 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 65.2 Cg_endo -67.5 157.7 60.54 Favored 'Trans proline' 0 CA--C 1.564 2.024 0 C-N-CA 123.044 2.496 . . . . 0.0 117.566 175.949 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 6' ' ' HIS . . . . . 0.444 ' HA ' ' HA ' ' B' ' 10' ' ' ARG . 76.0 m80 -85.1 145.13 27.81 Favored 'General case' 0 CA--C 1.565 1.538 0 N-CA-C 115.296 1.591 . . . . 0.0 115.296 -171.28 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 7' ' ' PHE . . . . . 0.793 ' CZ ' HD12 ' B' ' 34' ' ' LEU . 1.3 p90 -128.31 136.78 51.46 Favored 'General case' 0 N--CA 1.487 1.407 0 O-C-N 120.094 -1.629 . . . . 0.0 109.351 135.987 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 58.5 m-20 -73.53 92.47 1.91 Allowed 'General case' 0 CA--C 1.558 1.257 0 O-C-N 120.953 -1.092 . . . . 0.0 110.748 175.75 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 9' ' ' PHE . . . . . 0.696 ' CD2' HD13 ' B' ' 34' ' ' LEU . 3.9 t80 -68.87 163.35 24.51 Favored 'General case' 0 CA--C 1.562 1.423 0 CA-C-O 124.69 2.186 . . . . 0.0 110.466 164.347 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 173.18 98.74 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.783 0 CA-C-N 113.114 -1.857 . . . . 0.0 107.135 -124.304 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 7.3 mtt -145.75 131.74 9.54 Favored Pre-proline 0 N--CA 1.496 1.852 0 CA-C-O 116.751 -1.595 . . . . 0.0 112.275 -153.125 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 79.9 Cg_exo -43.27 150.16 0.43 Allowed 'Trans proline' 0 CA--C 1.561 1.846 0 C-N-CA 123.113 2.542 . . . . 0.0 116.936 170.585 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 21.2 tpp -64.38 -28.72 69.89 Favored 'General case' 0 N--CA 1.491 1.619 0 N-CA-C 116.987 2.217 . . . . 0.0 116.987 -164.192 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 9.1 pm0 -57.54 -48.01 80.46 Favored 'General case' 0 CA--C 1.566 1.571 0 N-CA-C 116.973 2.212 . . . . 0.0 116.973 156.365 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.401 ' CG1' HG12 ' B' ' 38' ' ' VAL . 2.0 t -60.97 -47.28 94.26 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.047 0 CA-C-N 122.019 2.19 . . . . 0.0 115.25 -179.747 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . 0.509 0.1 OUTLIER -114.87 27.43 9.43 Favored 'General case' 0 N--CA 1.485 1.314 0 N-CA-C 118.376 2.732 . . . . 0.0 118.376 170.979 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 5.5 pt-20 -71.61 -45.96 60.62 Favored 'General case' 0 N--CA 1.483 1.222 0 O-C-N 119.141 -2.224 . . . . 0.0 113.517 119.856 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . 0.297 56.0 mtmt -60.98 -52.26 65.77 Favored 'General case' 0 CA--C 1.563 1.469 0 N-CA-C 116.338 1.977 . . . . 0.0 116.338 177.986 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.744 ' HB3' ' CE ' ' A' ' 30' ' ' MET . 6.9 mt -65.67 -43.93 87.79 Favored 'General case' 0 CA--C 1.576 1.946 0 CA-C-N 120.291 1.405 . . . . 0.0 114.326 166.898 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 5.7 ttpt -77.7 -29.36 51.33 Favored 'General case' 0 CA--C 1.572 1.806 0 CA-C-N 123.296 2.771 . . . . 0.0 113.69 -178.499 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 17.3 m-30 -63.71 -67.86 0.39 Allowed 'General case' 0 N--CA 1.485 1.317 0 CA-C-O 115.627 -2.13 . . . . 0.0 111.725 159.792 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . 0.307 14.1 ttt180 -26.06 -49.19 0.03 OUTLIER 'General case' 0 CA--C 1.595 2.697 0 CA-C-N 124.626 3.376 . . . . 0.0 115.889 164.782 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . 0.293 . . -55.26 -76.53 0.03 OUTLIER 'General case' 0 CA--C 1.591 2.52 0 O-C-N 117.174 -3.454 . . . . 0.0 118.225 156.278 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 38.8 mt-10 . . . . . 0 N--CA 1.504 2.238 0 N-CA-C 119.342 3.09 . . . . 0.0 119.342 -179.182 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . 0.396 36.6 mtm105 . . . . . 0 N--CA 1.498 1.945 0 N-CA-C 107.39 -1.337 . . . . 0.0 107.39 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' SER . . . . . 0.449 ' H ' ' HB3' ' A' ' 32' ' ' SER . 80.2 p -131.4 105.81 7.84 Favored 'General case' 0 N--CA 1.502 2.171 0 O-C-N 117.487 -3.258 . . . . 0.0 105.757 -172.0 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 30' ' ' MET . . . . . 0.744 ' CE ' ' HB3' ' A' ' 19' ' ' LEU . 0.0 OUTLIER -38.26 -45.65 1.0 Allowed 'General case' 0 N--CA 1.495 1.81 0 N-CA-C 120.336 3.458 . . . . 0.0 120.336 -139.947 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 15.0 t-20 -42.63 -47.59 5.3 Favored 'General case' 0 CA--C 1.597 2.763 0 O-C-N 117.758 -3.089 . . . . 0.0 115.293 162.788 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' SER . . . . . 0.449 ' HB3' ' H ' ' A' ' 29' ' ' SER 0.277 42.8 t -54.0 -63.94 0.99 Allowed 'General case' 0 N--CA 1.501 2.119 0 N-CA-C 120.073 3.36 . . . . 0.0 120.073 147.052 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 5.9 tm-20 -69.35 -51.77 33.65 Favored 'General case' 0 N--CA 1.515 2.79 0 CA-C-N 123.042 2.655 . . . . 0.0 116.986 -175.598 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.767 HD12 ' CZ ' ' B' ' 7' ' ' PHE . 0.0 OUTLIER -44.08 -54.8 5.21 Favored 'General case' 0 CA--C 1.561 1.387 0 CA-C-O 115.535 -2.174 . . . . 0.0 107.59 162.793 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.423 ' HG ' ' CE1' ' B' ' 9' ' ' PHE . 10.9 mt -64.3 -56.2 16.1 Favored 'General case' 0 N--CA 1.491 1.622 0 CA-C-N 124.759 3.436 . . . . 0.0 115.099 -176.598 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 2.1 tm0? -57.73 -38.59 75.58 Favored 'General case' 0 CA--C 1.563 1.45 0 CA-C-O 115.928 -1.987 . . . . 0.0 113.366 177.206 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -69.59 -33.3 56.19 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.668 0 CA-C-N 122.485 2.402 . . . . 0.0 115.441 166.972 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.691 HG13 HD12 ' B' ' 19' ' ' LEU . 2.3 t -74.98 -49.49 28.35 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.544 0 C-N-CA 128.535 2.734 . . . . 0.0 112.974 178.906 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 34.3 mt-30 -43.34 -55.13 4.25 Favored 'General case' 0 N--CA 1.484 1.254 0 CA-C-O 116.695 -1.622 . . . . 0.0 112.294 151.531 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . 0.429 0.9 OUTLIER -41.6 -49.81 4.1 Favored 'General case' 0 N--CA 1.495 1.812 0 N-CA-C 118.072 2.619 . . . . 0.0 118.072 158.789 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . 0.331 . . . . . . . 0 CA--C 1.548 0.875 0 N-CA-C 117.784 2.513 . . . . 0.0 117.784 -159.361 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo . . . . . 0 CA--C 1.568 2.196 0 N-CA-C 116.991 1.881 . . . . 0.0 116.991 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' B' B ' 6' ' ' HIS . . . . . . . . . . . . . 76.6 m80 -88.27 153.46 21.2 Favored 'General case' 0 CA--C 1.569 1.711 0 CA-C-N 111.723 -2.49 . . . . 0.0 112.429 169.544 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 7' ' ' PHE . . . . . 0.767 ' CZ ' HD12 ' A' ' 34' ' ' LEU . 10.0 p90 -130.43 159.69 36.29 Favored 'General case' 0 CA--C 1.568 1.647 0 O-C-N 119.491 -2.006 . . . . 0.0 112.047 129.782 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 8' ' ' ASN . . . . . . . . . . . . . 14.6 p-10 -65.74 87.69 0.09 Allowed 'General case' 0 CA--C 1.567 1.626 0 N-CA-C 114.279 1.214 . . . . 0.0 114.279 168.937 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 9' ' ' PHE . . . . . 0.678 ' CD2' HD13 ' A' ' 34' ' ' LEU 0.254 1.9 t80 -79.76 179.44 7.53 Favored 'General case' 0 CA--C 1.556 1.177 0 CA-C-O 123.724 1.726 . . . . 0.0 110.361 158.932 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 10' ' ' ARG . . . . . 0.444 ' HA ' ' HA ' ' A' ' 6' ' ' HIS 0.425 67.4 mtt180 -127.16 -136.94 0.25 Allowed 'General case' 0 N--CA 1.477 0.886 0 CA-C-N 114.246 -1.343 . . . . 0.0 110.832 -164.418 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 11' ' ' MET . . . . . 0.523 ' SD ' ' CD2' ' B' ' 9' ' ' PHE . 5.1 mmt -146.12 171.14 6.8 Favored Pre-proline 0 CA--C 1.579 2.071 0 O-C-N 117.301 -3.375 . . . . 0.0 110.683 63.331 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 12' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -45.76 131.92 13.31 Favored 'Trans proline' 0 C--N 1.371 1.721 0 O-C-N 117.103 -2.104 . . . . 0.0 113.328 147.882 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 13' ' ' MET . . . . . . . . . . . . . 22.5 tpp -60.17 -27.12 66.86 Favored 'General case' 0 CA--C 1.568 1.637 0 N-CA-C 118.14 2.644 . . . . 0.0 118.14 -154.335 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 14' ' ' GLU . . . . . . . . . . . . 0.271 11.1 pt-20 -57.14 -50.07 73.96 Favored 'General case' 0 CA--C 1.565 1.546 0 N-CA-C 117.001 2.223 . . . . 0.0 117.001 162.309 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 15' ' ' VAL . . . . . 0.471 ' CG1' HG12 ' A' ' 38' ' ' VAL . 0.1 OUTLIER -63.52 -43.06 98.17 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.884 0 CA-C-N 121.037 1.744 . . . . 0.0 114.375 173.756 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 16' ' ' ARG . . . . . . . . . . . . 0.261 4.8 ttt180 -78.97 -32.22 45.26 Favored 'General case' 0 N--CA 1.478 0.943 0 CA-C-O 116.058 -1.925 . . . . 0.0 114.518 175.404 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 17' ' ' GLU . . . . . . . . . . . . . 5.3 pt-20 -64.77 -43.97 91.53 Favored 'General case' 0 N--CA 1.484 1.26 0 CA-C-N 124.0 3.091 . . . . 0.0 113.305 163.209 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . 0.615 16.5 pttt -70.14 -33.25 71.57 Favored 'General case' 0 CA--C 1.565 1.551 0 N-CA-C 117.858 2.54 . . . . 0.0 117.858 173.712 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 19' ' ' LEU . . . . . 0.691 HD12 HG13 ' A' ' 38' ' ' VAL 0.367 0.7 OUTLIER -76.59 -40.27 50.01 Favored 'General case' 0 CA--C 1.567 1.617 0 CA-C-N 121.016 1.735 . . . . 0.0 114.021 166.689 . . . . . . . . 4 4 . 1 . 008 nuclear build core ' B' B ' 20' ' ' LYS . . . . . . . . . . . . . 3.0 ttpt -79.71 -32.77 41.32 Favored 'General case' 0 CA--C 1.563 1.458 0 O-C-N 119.861 -1.774 . . . . 0.0 114.556 179.174 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 18.9 m-85 -60.78 -73.86 0.09 Allowed 'General case' 0 N--CA 1.491 1.619 1 CA-C-O 111.613 -4.042 . . . . 0.0 109.951 155.213 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . 0.276 17.9 ttt180 -22.81 -54.82 0.03 OUTLIER 'General case' 0 N--CA 1.506 2.334 1 CA-C-N 127.601 4.728 . . . . 0.0 117.066 170.655 . . . . . . . . 3 2 . 1 . 008 nuclear build core ' B' B ' 23' ' ' ALA . . . . . 0.516 ' HB2' ' CB ' ' B' ' 33' ' ' GLU . . . -48.63 -79.8 0.01 OUTLIER 'General case' 0 CA--C 1.58 2.102 0 N-CA-C 118.489 2.774 . . . . 0.0 118.489 156.592 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 46.4 mm-40 -65.82 -34.22 77.65 Favored 'General case' 0 N--CA 1.498 1.93 0 N-CA-C 118.978 2.955 . . . . 0.0 118.978 -178.429 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 25' ' ' ALA . . . . . . . . . . . . . . . -41.96 -48.1 4.47 Favored 'General case' 0 CA--C 1.578 2.052 0 N-CA-C 117.536 2.421 . . . . 0.0 117.536 153.712 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 26' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -97.97 -44.52 6.63 Favored 'General case' 0 CA--C 1.576 1.951 0 N-CA-C 116.64 2.089 . . . . 0.0 116.64 -173.614 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 27' ' ' GLY . . . . . . . . . . . . . . . 122.62 13.7 4.58 Favored Glycine 0 N--CA 1.498 2.798 0 N-CA-C 119.05 2.38 . . . . 0.0 119.05 -159.584 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 28' ' ' ARG . . . . . 0.675 ' HE ' ' HG2' ' B' ' 33' ' ' GLU . 61.8 mtm-85 -109.54 154.72 22.31 Favored 'General case' 0 CA--C 1.575 1.924 0 N-CA-C 103.981 -2.6 . . . . 0.0 103.981 167.302 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 29' ' ' SER . . . . . . . . . . . . . 79.1 p -129.35 112.35 13.76 Favored 'General case' 0 N--CA 1.505 2.311 0 O-C-N 117.049 -3.532 . . . . 0.0 106.001 -169.737 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 30' ' ' MET . . . . . 0.468 ' CE ' ' HB3' ' B' ' 19' ' ' LEU . 24.1 mtp -47.15 -38.58 11.95 Favored 'General case' 0 N--CA 1.497 1.915 0 N-CA-C 118.772 2.878 . . . . 0.0 118.772 -135.198 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 31' ' ' ASN . . . . . . . . . . . . 0.26 0.1 OUTLIER -48.21 -43.27 31.85 Favored 'General case' 0 CA--C 1.598 2.816 0 O-C-N 116.906 -3.622 . . . . 0.0 115.315 164.425 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 32' ' ' SER . . . . . . . . . . . . 0.461 75.4 p -54.84 -63.5 1.13 Allowed 'General case' 0 N--CA 1.505 2.319 0 N-CA-C 118.755 2.872 . . . . 0.0 118.755 145.262 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 33' ' ' GLU . . . . . 0.675 ' HG2' ' HE ' ' B' ' 28' ' ' ARG . 3.0 tm-20 -67.18 -50.15 62.11 Favored 'General case' 0 N--CA 1.511 2.624 0 N-CA-C 120.35 3.463 . . . . 0.0 120.35 -177.052 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 34' ' ' LEU . . . . . 0.793 HD12 ' CZ ' ' A' ' 7' ' ' PHE . 0.1 OUTLIER -42.07 -54.69 3.48 Favored 'General case' 0 CA--C 1.554 1.126 0 CA-C-O 114.881 -2.485 . . . . 0.0 107.756 159.807 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 35' ' ' LEU . . . . . 0.415 HD23 ' HA ' ' B' ' 35' ' ' LEU . 12.2 mt -60.38 -40.11 89.71 Favored 'General case' 0 N--CA 1.492 1.633 0 CA-C-N 124.75 3.432 . . . . 0.0 116.766 176.028 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 36' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.22 -46.07 74.94 Favored 'General case' 0 N--CA 1.488 1.438 0 N-CA-C 115.017 1.488 . . . . 0.0 115.017 176.145 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 37' ' ' ILE . . . . . . . . . . . . . 5.3 tt -63.12 -30.2 49.11 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.408 0 CA-C-O 114.858 -2.496 . . . . 0.0 116.101 161.89 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 38' ' ' VAL . . . . . 0.616 ' HA ' ' HB3' ' B' ' 41' ' ' ALA . 2.2 t -83.63 -46.21 18.4 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.923 0 CA-C-N 121.893 2.133 . . . . 0.0 112.704 -172.301 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 33.5 mt-30 -57.28 -38.89 74.63 Favored 'General case' 0 CA--C 1.572 1.82 0 O-C-N 121.148 -0.97 . . . . 0.0 112.497 157.291 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 40' ' ' ASP . . . . . . . . . . . . 0.528 5.2 m-20 -52.93 -41.45 64.46 Favored 'General case' 0 CA--C 1.58 2.103 0 N-CA-C 119.264 3.061 . . . . 0.0 119.264 151.168 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 41' ' ' ALA . . . . . 0.616 ' HB3' ' HA ' ' B' ' 38' ' ' VAL . . . -75.68 -20.62 58.3 Favored 'General case' 0 N--CA 1.493 1.715 0 N-CA-C 116.695 2.109 . . . . 0.0 116.695 -175.663 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 22.4 mt . . . . . 0 N--CA 1.488 1.464 0 C-N-CA 125.057 1.343 . . . . 0.0 113.673 170.743 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 26.3 p-10 . . . . . 0 CA--C 1.57 1.736 0 N-CA-C 113.715 1.006 . . . . 0.0 113.715 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 1.9 Cg_endo -109.55 173.51 0.07 OUTLIER 'Trans proline' 0 CA--C 1.556 1.619 0 C-N-CA 121.94 1.76 . . . . 0.0 112.964 -157.554 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . 0.268 1.8 p-80 -143.61 148.35 35.73 Favored 'General case' 0 N--CA 1.486 1.347 0 N-CA-C 118.173 2.657 . . . . 0.0 118.173 -144.581 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 7' ' ' PHE . . . . . 0.53 ' CZ ' HD23 ' B' ' 34' ' ' LEU . 25.5 p90 -131.71 166.18 22.08 Favored 'General case' 0 CA--C 1.561 1.393 0 CA-C-N 113.806 -1.543 . . . . 0.0 109.033 168.91 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 14.1 m120 -74.39 98.39 3.26 Favored 'General case' 0 CA--C 1.563 1.467 0 O-C-N 119.641 -1.912 . . . . 0.0 110.872 162.67 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 9' ' ' PHE . . . . . 0.436 ' HD2' HD11 ' A' ' 34' ' ' LEU . 3.6 t80 -69.97 157.61 37.15 Favored 'General case' 0 CA--C 1.568 1.662 0 CA-C-O 124.26 1.981 . . . . 0.0 109.873 147.283 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 12.3 tpt180 169.27 87.34 0.0 OUTLIER 'General case' 0 N--CA 1.502 2.137 0 O-C-N 119.264 -2.147 . . . . 0.0 106.904 -124.283 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -136.79 121.7 12.79 Favored Pre-proline 0 CA--C 1.575 1.909 0 CA-C-O 117.248 -1.358 . . . . 0.0 112.886 -149.172 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 98.9 Cg_exo -43.26 150.91 0.35 Allowed 'Trans proline' 0 C--N 1.379 2.142 0 C-N-CA 123.875 3.05 . . . . 0.0 118.969 -179.904 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -50.94 -40.19 56.72 Favored 'General case' 0 N--CA 1.499 1.994 0 N-CA-C 117.983 2.586 . . . . 0.0 117.983 -165.805 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 9.6 pt-20 -63.37 -43.25 98.15 Favored 'General case' 0 CA--C 1.564 1.492 0 N-CA-C 116.287 1.958 . . . . 0.0 116.287 165.428 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.429 ' CG1' HG12 ' B' ' 38' ' ' VAL . 1.2 t -59.96 -48.91 86.0 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.064 0 CA-C-N 123.002 2.637 . . . . 0.0 112.637 172.457 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 3.4 ttt180 -69.7 -41.29 75.59 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-N 121.13 1.786 . . . . 0.0 115.797 174.111 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -60.91 -37.68 83.08 Favored 'General case' 0 CA--C 1.565 1.543 0 CA-C-N 123.289 2.768 . . . . 0.0 114.378 166.237 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 48.4 mtmt -62.47 -62.76 1.53 Allowed 'General case' 0 CA--C 1.564 1.488 0 CA-C-N 121.229 1.832 . . . . 0.0 114.481 166.7 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.541 HD21 ' HG ' ' A' ' 34' ' ' LEU . 12.5 tp -56.89 -36.19 69.84 Favored 'General case' 0 N--CA 1.491 1.578 0 N-CA-C 115.855 1.798 . . . . 0.0 115.855 176.319 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 12.1 ttpt -89.29 -27.85 20.28 Favored 'General case' 0 CA--C 1.568 1.656 0 C-N-CA 125.143 1.377 . . . . 0.0 114.046 179.081 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 13.2 m-30 -65.31 -70.67 0.22 Allowed 'General case' 0 N--CA 1.493 1.681 0 CA-C-O 115.103 -2.38 . . . . 0.0 110.926 156.887 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' ARG . . . . . 0.574 ' HE ' HD12 ' A' ' 37' ' ' ILE 0.35 0.0 OUTLIER -23.55 -47.71 0.01 OUTLIER 'General case' 0 CA--C 1.6 2.869 0 CA-C-N 124.631 3.378 . . . . 0.0 115.102 163.794 . . . . . . . . 4 4 . 1 . 009 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.407 ' HB2' ' CB ' ' A' ' 33' ' ' GLU . . . -57.94 -76.96 0.03 OUTLIER 'General case' 0 CA--C 1.587 2.377 0 N-CA-C 117.61 2.448 . . . . 0.0 117.61 156.726 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 . . . . . 0 N--CA 1.503 2.198 0 N-CA-C 118.948 2.944 . . . . 0.0 118.948 179.102 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 29.1 mtm-85 . . . . . 0 CA--C 1.569 1.689 0 N-CA-C 106.532 -1.655 . . . . 0.0 106.532 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 38.1 t -119.6 115.0 23.09 Favored 'General case' 0 N--CA 1.501 2.105 0 O-C-N 118.842 -2.411 . . . . 0.0 105.411 -177.681 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 22.7 mtp -43.72 -40.93 4.54 Favored 'General case' 0 N--CA 1.5 2.068 0 N-CA-C 119.109 3.003 . . . . 0.0 119.109 -146.175 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -46.17 -44.63 16.14 Favored 'General case' 0 CA--C 1.601 2.906 0 CA-C-N 125.683 3.856 . . . . 0.0 115.371 163.721 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . 0.356 28.7 t -49.07 -75.59 0.03 OUTLIER 'General case' 0 N--CA 1.503 2.191 0 N-CA-C 118.338 2.718 . . . . 0.0 118.338 143.608 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 33' ' ' GLU . . . . . 0.407 ' CB ' ' HB2' ' A' ' 23' ' ' ALA . 10.4 tp10 -60.6 -55.01 38.45 Favored 'General case' 0 N--CA 1.516 2.87 0 CA-C-N 124.217 3.19 . . . . 0.0 116.191 -173.208 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.788 HD12 ' CZ ' ' B' ' 7' ' ' PHE . 0.1 OUTLIER -39.88 -53.9 2.23 Favored 'General case' 0 CA--C 1.55 0.972 0 CA-C-O 115.805 -2.045 . . . . 0.0 108.3 167.481 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.428 HD23 ' HA ' ' A' ' 35' ' ' LEU . 13.1 mt -61.1 -47.24 87.21 Favored 'General case' 0 N--CA 1.486 1.348 0 CA-C-N 123.263 2.756 . . . . 0.0 115.913 174.75 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.56 -44.71 93.21 Favored 'General case' 0 N--CA 1.479 0.989 0 CA-C-O 116.748 -1.596 . . . . 0.0 114.269 177.472 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 37' ' ' ILE . . . . . 0.574 HD12 ' HE ' ' A' ' 22' ' ' ARG . 3.8 tt -69.94 -32.68 52.46 Favored 'Isoleucine or valine' 0 C--O 1.199 -1.598 0 CA-C-O 114.989 -2.434 . . . . 0.0 114.719 166.168 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.478 HG21 HD22 ' A' ' 34' ' ' LEU . 3.0 t -78.21 -48.36 23.09 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.179 0 CA-C-N 123.581 2.9 . . . . 0.0 112.156 -174.435 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 27.2 mt-30 -49.4 -46.15 47.03 Favored 'General case' 0 CA--C 1.563 1.462 0 C-N-CA 123.77 0.828 . . . . 0.0 112.153 154.507 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . 0.422 3.9 t0 -51.55 -41.65 61.25 Favored 'General case' 0 N--CA 1.488 1.439 0 N-CA-C 118.913 2.931 . . . . 0.0 118.913 158.444 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . 0.275 . . . . . . . 0 N--CA 1.479 0.978 0 N-CA-C 115.465 1.654 . . . . 0.0 115.465 -155.494 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 7.2 Cg_exo . . . . . 0 CA--C 1.552 1.379 0 CA-C-O 121.601 0.584 . . . . 0.0 113.183 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' B' B ' 6' ' ' HIS . . . . . . . . . . . . . 67.5 m80 -72.29 128.13 34.69 Favored 'General case' 0 CA--C 1.575 1.923 0 CA-C-N 114.852 -1.067 . . . . 0.0 111.784 173.008 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 7' ' ' PHE . . . . . 0.788 ' CZ ' HD12 ' A' ' 34' ' ' LEU 0.252 2.5 p90 -131.92 149.47 52.43 Favored 'General case' 0 CA--C 1.565 1.529 0 O-C-N 119.882 -1.761 . . . . 0.0 111.036 147.877 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 8' ' ' ASN . . . . . . . . . . . . . 12.9 m120 -71.86 84.69 0.94 Allowed 'General case' 0 N--CA 1.491 1.606 0 O-C-N 120.521 -1.362 . . . . 0.0 112.234 176.727 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 9' ' ' PHE . . . . . 0.673 ' CD2' HD13 ' A' ' 34' ' ' LEU . 9.0 t80 -81.23 149.75 28.9 Favored 'General case' 0 CA--C 1.561 1.374 0 CA-C-O 126.151 2.881 . . . . 0.0 111.306 171.033 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 10' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -172.6 112.5 0.26 Allowed 'General case' 0 C--N 1.307 -1.243 0 CA-C-N 111.5 -2.591 . . . . 0.0 105.54 -129.351 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 11' ' ' MET . . . . . 0.408 ' SD ' ' CD2' ' B' ' 9' ' ' PHE . 0.9 OUTLIER -133.71 117.91 14.31 Favored Pre-proline 0 CA--C 1.564 1.487 0 CA-C-O 117.375 -1.298 . . . . 0.0 110.032 -153.176 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 12' ' ' PRO . . . . . . . . . . . . . 76.1 Cg_exo -42.92 145.59 1.09 Allowed 'Trans proline' 0 C--N 1.374 1.869 0 C-N-CA 123.249 2.633 . . . . 0.0 116.1 163.886 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 13' ' ' MET . . . . . . . . . . . . . 3.5 tpt -51.56 -41.18 60.94 Favored 'General case' 0 N--CA 1.494 1.736 0 N-CA-C 118.551 2.797 . . . . 0.0 118.551 -154.632 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -63.39 -43.29 98.0 Favored 'General case' 0 CA--C 1.563 1.457 0 N-CA-C 116.722 2.119 . . . . 0.0 116.722 166.708 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -57.43 -47.25 85.22 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.39 0 CA-C-N 124.394 3.27 . . . . 0.0 112.951 172.576 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 1.9 ttt180 -75.13 -37.84 61.26 Favored 'General case' 0 N--CA 1.475 0.818 0 CA-C-O 116.6 -1.666 . . . . 0.0 115.236 176.381 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 17' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -61.74 -37.37 83.99 Favored 'General case' 0 CA--C 1.569 1.676 0 CA-C-N 123.12 2.691 . . . . 0.0 114.056 163.405 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . 0.269 43.2 mtmt -66.3 -49.93 65.36 Favored 'General case' 0 CA--C 1.563 1.461 0 CA-C-N 122.018 2.19 . . . . 0.0 115.112 170.416 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 19' ' ' LEU . . . . . 0.53 HD21 HD22 ' B' ' 34' ' ' LEU 0.27 11.8 tp -70.12 -39.22 75.59 Favored 'General case' 0 N--CA 1.487 1.391 0 C-N-CA 124.98 1.312 . . . . 0.0 114.526 176.374 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 20' ' ' LYS . . . . . 0.402 ' HB2' ' SD ' ' B' ' 30' ' ' MET . 13.4 ttpt -84.92 -28.6 25.81 Favored 'General case' 0 CA--C 1.565 1.525 0 CA-C-O 117.423 -1.275 . . . . 0.0 114.271 177.597 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 18.5 m-30 -67.03 -70.72 0.23 Allowed 'General case' 0 N--CA 1.492 1.644 0 CA-C-O 113.093 -3.337 . . . . 0.0 109.945 160.337 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . 0.275 37.2 ttt85 -20.26 -53.78 0.02 OUTLIER 'General case' 0 CA--C 1.587 2.391 1 CA-C-N 126.284 4.129 . . . . 0.0 116.372 165.399 . . . . . . . . 3 2 . 1 . 009 nuclear build core ' B' B ' 23' ' ' ALA . . . . . 0.494 ' HB2' ' CB ' ' B' ' 33' ' ' GLU . . . -54.32 -79.53 0.02 OUTLIER 'General case' 0 CA--C 1.588 2.438 0 N-CA-C 117.288 2.329 . . . . 0.0 117.288 159.023 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 66.7 mm-40 -71.49 -32.58 68.4 Favored 'General case' 0 CA--C 1.575 1.934 0 N-CA-C 119.361 3.097 . . . . 0.0 119.361 -176.41 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 25' ' ' ALA . . . . . . . . . . . . . . . -41.56 -49.99 4.05 Favored 'General case' 0 CA--C 1.58 2.1 0 N-CA-C 116.549 2.055 . . . . 0.0 116.549 153.131 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 26' ' ' ASN . . . . . . . . . . . . 0.264 0.0 OUTLIER -107.6 -42.27 4.81 Favored 'General case' 0 CA--C 1.576 1.972 0 N-CA-C 116.09 1.885 . . . . 0.0 116.09 -163.975 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 27' ' ' GLY . . . . . . . . . . . . . . . 134.27 12.24 1.46 Allowed Glycine 0 N--CA 1.498 2.824 0 N-CA-C 119.232 2.453 . . . . 0.0 119.232 -167.097 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 28' ' ' ARG . . . . . 0.408 ' HE ' ' HG2' ' B' ' 33' ' ' GLU . 72.4 mtm-85 -111.35 165.75 11.69 Favored 'General case' 0 CA--C 1.575 1.922 0 CA-C-N 120.39 2.095 . . . . 0.0 105.424 168.087 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 29' ' ' SER . . . . . . . . . . . . . 8.8 t -133.7 113.62 12.54 Favored 'General case' 0 N--CA 1.506 2.361 0 O-C-N 117.103 -3.498 . . . . 0.0 107.129 -177.247 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 30' ' ' MET . . . . . 0.402 ' SD ' ' HB2' ' B' ' 20' ' ' LYS . 25.6 mtp -44.8 -34.46 2.32 Favored 'General case' 0 N--CA 1.5 2.029 0 N-CA-C 121.338 3.829 . . . . 0.0 121.338 -139.533 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 31' ' ' ASN . . . . . . . . . . . . 0.26 8.8 t-20 -49.75 -49.64 47.42 Favored 'General case' 0 CA--C 1.591 2.543 0 O-C-N 118.572 -2.58 . . . . 0.0 113.882 161.318 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 32' ' ' SER . . . . . . . . . . . . 0.29 27.6 t -49.43 -64.26 0.86 Allowed 'General case' 0 N--CA 1.501 2.115 0 N-CA-C 119.649 3.203 . . . . 0.0 119.649 146.955 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 33' ' ' GLU . . . . . 0.494 ' CB ' ' HB2' ' B' ' 23' ' ' ALA . 0.0 OUTLIER -67.55 -60.47 2.53 Favored 'General case' 0 N--CA 1.516 2.863 0 CA-C-N 123.45 2.841 . . . . 0.0 116.156 -176.449 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 34' ' ' LEU . . . . . 0.53 HD22 HD21 ' B' ' 19' ' ' LEU 0.543 0.1 OUTLIER -49.06 -37.06 19.83 Favored 'General case' 0 CA--C 1.563 1.48 0 CA-C-O 114.184 -2.817 . . . . 0.0 108.207 172.009 . . . . . . . . 4 4 . 1 . 009 nuclear build core ' B' B ' 35' ' ' LEU . . . . . 0.405 ' HA ' HD23 ' B' ' 35' ' ' LEU . 13.9 mt -64.67 -56.73 11.92 Favored 'General case' 0 N--CA 1.491 1.613 1 CA-C-N 126.158 4.072 . . . . 0.0 115.725 167.559 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 36' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -50.64 -40.26 52.78 Favored 'General case' 0 CA--C 1.58 2.101 0 N-CA-C 115.784 1.772 . . . . 0.0 115.784 175.734 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 37' ' ' ILE . . . . . 0.423 ' HA ' ' HB3' ' B' ' 40' ' ' ASP . 0.5 OUTLIER -74.03 -35.62 42.28 Favored 'Isoleucine or valine' 0 CA--C 1.571 1.762 0 N-CA-C 116.164 1.913 . . . . 0.0 116.164 166.47 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 38' ' ' VAL . . . . . 0.518 ' HA ' ' HB3' ' B' ' 41' ' ' ALA . 3.3 t -72.5 -46.76 54.47 Favored 'Isoleucine or valine' 0 CA--C 1.575 1.941 0 O-C-N 119.041 -2.287 . . . . 0.0 110.796 177.699 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 23.7 mt-30 -51.38 -40.85 60.06 Favored 'General case' 0 CA--C 1.562 1.427 0 N-CA-C 114.539 1.311 . . . . 0.0 114.539 155.517 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 40' ' ' ASP . . . . . 0.423 ' HB3' ' HA ' ' B' ' 37' ' ' ILE . 44.8 t0 -53.32 -47.71 69.07 Favored 'General case' 0 N--CA 1.492 1.634 0 N-CA-C 116.518 2.044 . . . . 0.0 116.518 156.102 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 41' ' ' ALA . . . . . 0.518 ' HB3' ' HA ' ' B' ' 38' ' ' VAL 0.263 . . -69.6 -26.86 64.65 Favored 'General case' 0 CA--C 1.564 1.514 0 N-CA-C 117.462 2.393 . . . . 0.0 117.462 -174.618 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.573 1.856 0 C-N-CA 124.687 1.195 . . . . 0.0 112.993 175.356 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 2.1 p30 . . . . . 0 CA--C 1.568 1.67 0 CA-C-O 118.652 -0.689 . . . . 0.0 112.1 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 3.7 Cg_exo -98.06 148.74 0.75 Allowed 'Trans proline' 0 CA--C 1.551 1.343 0 CA-C-N 122.363 1.88 . . . . 0.0 114.131 -155.246 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 80.8 m80 -84.9 130.42 34.65 Favored 'General case' 0 CA--C 1.566 1.577 0 CA-C-N 113.946 -1.479 . . . . 0.0 112.369 178.476 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 7' ' ' PHE . . . . . 0.482 ' CZ ' HD23 ' B' ' 34' ' ' LEU . 3.2 p90 -132.45 159.56 38.99 Favored 'General case' 0 CA--C 1.567 1.625 0 CA-C-O 122.704 1.24 . . . . 0.0 111.048 153.896 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 70.7 m-80 -66.18 101.73 0.75 Allowed 'General case' 0 CA--C 1.573 1.847 0 O-C-N 120.877 -1.14 . . . . 0.0 112.68 173.999 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 9' ' ' PHE . . . . . 0.457 ' CE1' ' HG ' ' B' ' 35' ' ' LEU . 5.2 t80 -120.18 110.08 16.19 Favored 'General case' 0 CA--C 1.547 0.838 0 N-CA-C 106.372 -1.714 . . . . 0.0 106.372 157.839 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . 0.383 0.0 OUTLIER 98.66 89.05 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.633 1 O-C-N 113.897 -5.502 . . . . 0.0 110.098 -17.654 . . . . . . . . 4 3 . 1 . 010 nuclear build core ' A' A ' 11' ' ' MET . . . . . 0.496 ' SD ' ' HG3' ' A' ' 16' ' ' ARG . 1.6 mpt? -147.74 149.57 33.91 Favored Pre-proline 0 CA--C 1.567 1.632 0 CA-C-O 118.086 -0.959 . . . . 0.0 111.976 -170.237 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_exo -44.85 141.94 5.56 Favored 'Trans proline' 0 CA--C 1.567 2.155 0 C-N-CA 122.436 2.091 . . . . 0.0 115.989 154.783 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' MET . . . . . 0.433 ' SD ' ' HG3' ' A' ' 17' ' ' GLU . 13.7 tpp -56.07 -27.79 54.96 Favored 'General case' 0 N--CA 1.496 1.847 0 N-CA-C 118.934 2.939 . . . . 0.0 118.934 -169.811 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 7.6 pt-20 -65.93 -47.62 74.12 Favored 'General case' 0 CA--C 1.57 1.712 0 N-CA-C 115.957 1.836 . . . . 0.0 115.957 165.304 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -60.37 -49.07 85.72 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.216 0 CA-C-N 122.263 2.301 . . . . 0.0 112.513 174.402 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 16' ' ' ARG . . . . . 0.496 ' HG3' ' SD ' ' A' ' 11' ' ' MET . 5.8 ttt180 -69.8 -33.11 71.91 Favored 'General case' 0 CA--C 1.548 0.894 0 CA-C-O 116.047 -1.93 . . . . 0.0 115.562 173.8 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 17' ' ' GLU . . . . . 0.433 ' HG3' ' SD ' ' A' ' 13' ' ' MET . 37.1 mt-10 -60.19 -48.1 83.16 Favored 'General case' 0 N--CA 1.491 1.615 0 CA-C-N 123.941 3.064 . . . . 0.0 114.197 160.312 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 18' ' ' LYS . . . . . 0.405 ' HB3' HD13 ' B' ' 42' ' ' LEU . 53.0 mtmt -61.89 -45.66 92.79 Favored 'General case' 0 CA--C 1.562 1.436 0 N-CA-C 116.134 1.902 . . . . 0.0 116.134 174.529 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.589 ' CD2' HD22 ' A' ' 34' ' ' LEU 0.258 14.0 tp -69.0 -40.55 78.65 Favored 'General case' 0 CA--C 1.565 1.544 0 N-CA-C 115.01 1.485 . . . . 0.0 115.01 172.195 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.453 ' HB2' ' SD ' ' A' ' 30' ' ' MET . 16.1 ttpt -85.22 -26.2 26.87 Favored 'General case' 0 CA--C 1.567 1.603 0 N-CA-C 114.259 1.207 . . . . 0.0 114.259 179.757 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 13.1 m-85 -61.94 -69.31 0.26 Allowed 'General case' 0 N--CA 1.49 1.554 0 CA-C-O 114.05 -2.881 . . . . 0.0 110.722 155.224 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . 0.304 1.9 ttt85 -23.22 -49.21 0.02 OUTLIER 'General case' 0 CA--C 1.598 2.8 0 CA-C-N 125.363 3.711 . . . . 0.0 116.53 163.406 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . 0.268 . . -58.13 -77.43 0.03 OUTLIER 'General case' 0 CA--C 1.59 2.502 0 N-CA-C 117.301 2.334 . . . . 0.0 117.301 158.482 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 87.9 mt-10 . . . . . 0 N--CA 1.503 2.193 0 N-CA-C 118.774 2.879 . . . . 0.0 118.774 178.606 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 12.0 mtt85 . . . . . 0 CA--C 1.57 1.746 0 N-CA-C 106.03 -1.841 . . . . 0.0 106.03 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 29' ' ' SER . . . . . 0.491 ' H ' ' HB3' ' A' ' 32' ' ' SER . 41.3 t -119.71 115.14 23.32 Favored 'General case' 0 N--CA 1.503 2.184 0 O-C-N 118.377 -2.702 . . . . 0.0 105.096 -178.948 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 30' ' ' MET . . . . . 0.453 ' SD ' ' HB2' ' A' ' 20' ' ' LYS . 8.3 mtp -43.22 -36.71 1.86 Allowed 'General case' 0 N--CA 1.502 2.145 0 N-CA-C 121.405 3.854 . . . . 0.0 121.405 -148.282 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 31' ' ' ASN . . . . . 0.421 ' O ' ' HB2' ' A' ' 35' ' ' LEU . 11.5 t-20 -48.71 -46.36 40.63 Favored 'General case' 0 CA--C 1.592 2.586 0 O-C-N 118.572 -2.58 . . . . 0.0 114.457 162.0 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 32' ' ' SER . . . . . 0.491 ' HB3' ' H ' ' A' ' 29' ' ' SER 0.287 46.6 t -51.78 -66.41 0.39 Allowed 'General case' 0 N--CA 1.499 2.004 0 N-CA-C 119.908 3.299 . . . . 0.0 119.908 146.918 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 -64.49 -59.92 3.76 Favored 'General case' 0 N--CA 1.515 2.801 0 CA-C-N 123.895 3.043 . . . . 0.0 114.774 -176.042 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.589 HD22 ' CD2' ' A' ' 19' ' ' LEU 0.477 0.3 OUTLIER -51.17 -41.36 60.11 Favored 'General case' 0 CA--C 1.56 1.365 0 CA-C-O 113.55 -3.119 . . . . 0.0 106.692 174.912 . . . . . . . . 4 4 . 1 . 010 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.451 HD23 ' HA ' ' A' ' 35' ' ' LEU . 12.9 mt -62.99 -55.36 26.39 Favored 'General case' 0 N--CA 1.495 1.813 1 CA-C-N 127.281 4.582 . . . . 0.0 115.403 169.59 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . 0.276 8.6 tm0? -55.75 -49.81 72.1 Favored 'General case' 0 CA--C 1.566 1.561 0 CA-C-O 116.25 -1.833 . . . . 0.0 113.764 179.559 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 1.6 tt -60.11 -39.48 80.59 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.843 0 CA-C-N 122.619 2.463 . . . . 0.0 115.124 165.421 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.45 ' CG1' HD22 ' B' ' 19' ' ' LEU . 2.4 t -70.1 -49.97 51.36 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.994 0 CA-C-N 123.418 2.826 . . . . 0.0 112.696 -178.015 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 24.8 mt-30 -43.46 -46.7 6.91 Favored 'General case' 0 N--CA 1.489 1.522 0 C-N-CA 124.781 1.233 . . . . 0.0 113.724 152.995 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . 0.372 28.7 m-20 -58.46 -42.59 87.78 Favored 'General case' 0 CA--C 1.558 1.285 0 N-CA-C 117.356 2.354 . . . . 0.0 117.356 163.928 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . 0.265 . . . . . . . 0 CA--C 1.553 1.095 0 N-CA-C 115.955 1.835 . . . . 0.0 115.955 -159.589 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 95.2 Cg_endo . . . . . 0 CA--C 1.567 2.169 0 CA-C-O 124.543 1.81 . . . . 0.0 116.128 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' B' B ' 6' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -154.15 148.1 25.59 Favored 'General case' 0 CA--C 1.548 0.873 0 CA-C-N 112.745 -2.025 . . . . 0.0 114.663 -153.175 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 7' ' ' PHE . . . . . 0.552 ' CZ ' HD23 ' A' ' 34' ' ' LEU . 17.3 p90 -122.53 170.36 10.08 Favored 'General case' 0 CA--C 1.561 1.371 0 CA-C-O 122.978 1.371 . . . . 0.0 109.961 153.18 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 8' ' ' ASN . . . . . . . . . . . . . 20.7 m-80 -85.18 92.52 8.42 Favored 'General case' 0 N--CA 1.485 1.291 0 O-C-N 119.894 -1.754 . . . . 0.0 108.06 160.616 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 9' ' ' PHE . . . . . . . . . . . . . 16.0 t80 -69.55 159.04 34.09 Favored 'General case' 0 CA--C 1.561 1.39 0 CA-C-O 125.296 2.474 . . . . 0.0 110.809 162.002 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 10' ' ' ARG . . . . . . . . . . . . . 2.3 tmm_? -176.35 107.76 0.08 Allowed 'General case' 0 C--N 1.304 -1.386 0 N-CA-C 103.399 -2.815 . . . . 0.0 103.399 -122.643 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 11' ' ' MET . . . . . 0.556 ' SD ' HD23 ' B' ' 19' ' ' LEU . 13.4 mtm -134.43 119.59 14.28 Favored Pre-proline 0 N--CA 1.484 1.235 0 CA-C-O 117.218 -1.373 . . . . 0.0 112.216 -161.428 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 12' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_exo -40.61 141.11 0.9 Allowed 'Trans proline' 0 C--N 1.372 1.8 0 C-N-CA 122.962 2.442 . . . . 0.0 116.192 160.991 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 13' ' ' MET . . . . . . . . . . . . . 27.2 tpp -58.98 -26.13 64.21 Favored 'General case' 0 N--CA 1.495 1.822 0 N-CA-C 118.378 2.733 . . . . 0.0 118.378 -157.754 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 14' ' ' GLU . . . . . . . . . . . . 0.252 6.4 pt-20 -64.4 -49.14 72.74 Favored 'General case' 0 CA--C 1.572 1.803 0 N-CA-C 116.213 1.931 . . . . 0.0 116.213 161.477 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -58.22 -47.0 88.56 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.301 0 CA-C-N 122.568 2.44 . . . . 0.0 113.309 173.646 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 2.7 ttt180 -75.06 -32.57 61.54 Favored 'General case' 0 CA--C 1.543 0.684 0 CA-C-O 116.305 -1.807 . . . . 0.0 115.763 175.652 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 17' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -61.39 -44.83 96.47 Favored 'General case' 0 N--CA 1.492 1.647 0 CA-C-N 123.23 2.741 . . . . 0.0 113.242 159.916 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . 0.262 53.2 mtmt -58.74 -52.68 64.65 Favored 'General case' 0 CA--C 1.562 1.421 0 CA-C-N 121.173 1.806 . . . . 0.0 115.345 171.215 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 19' ' ' LEU . . . . . 0.556 HD23 ' SD ' ' B' ' 11' ' ' MET 0.26 12.5 tp -71.12 -36.35 72.1 Favored 'General case' 0 CA--C 1.563 1.444 0 N-CA-C 115.442 1.645 . . . . 0.0 115.442 178.41 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 20' ' ' LYS . . . . . 0.469 ' HB2' ' SD ' ' B' ' 30' ' ' MET . 18.3 ttpt -83.66 -20.81 32.92 Favored 'General case' 0 CA--C 1.584 2.262 0 N-CA-C 114.132 1.16 . . . . 0.0 114.132 172.756 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 21' ' ' PHE . . . . . 0.493 ' O ' ' HB3' ' B' ' 25' ' ' ALA . 9.4 m-30 -73.34 -65.88 0.76 Allowed 'General case' 0 N--CA 1.497 1.875 0 CA-C-N 122.547 2.43 . . . . 0.0 110.847 162.866 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . 0.311 0.2 OUTLIER -17.23 -52.57 0.01 OUTLIER 'General case' 0 CA--C 1.597 2.76 0 CA-C-N 124.79 3.45 . . . . 0.0 114.757 153.614 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 23' ' ' ALA . . . . . 0.479 ' HB2' ' CB ' ' B' ' 33' ' ' GLU . . . -58.27 -77.06 0.03 OUTLIER 'General case' 0 CA--C 1.575 1.905 0 N-CA-C 118.272 2.693 . . . . 0.0 118.272 158.975 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 58.0 mm-40 -75.5 -33.65 60.79 Favored 'General case' 0 CA--C 1.576 1.98 0 N-CA-C 118.303 2.705 . . . . 0.0 118.303 -174.996 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 25' ' ' ALA . . . . . 0.493 ' HB3' ' O ' ' B' ' 21' ' ' PHE . . . -45.61 -51.66 11.79 Favored 'General case' 0 CA--C 1.585 2.293 0 N-CA-C 116.009 1.855 . . . . 0.0 116.009 154.162 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 26' ' ' ASN . . . . . . . . . . . . . 90.8 m-20 -78.68 -53.02 7.59 Favored 'General case' 0 N--CA 1.499 1.989 0 N-CA-C 115.145 1.535 . . . . 0.0 115.145 174.867 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 27' ' ' GLY . . . . . . . . . . . . . . . 120.36 24.69 2.6 Favored Glycine 0 CA--C 1.562 2.99 0 N-CA-C 118.403 2.121 . . . . 0.0 118.403 -154.277 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 28' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -104.88 178.96 4.41 Favored 'General case' 0 CA--C 1.574 1.87 0 CA-C-N 120.211 2.005 . . . . 0.0 107.798 157.546 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 29' ' ' SER . . . . . 0.472 ' H ' ' HB2' ' B' ' 32' ' ' SER . 6.8 t -135.24 115.95 13.88 Favored 'General case' 0 N--CA 1.5 2.052 0 O-C-N 118.73 -2.481 . . . . 0.0 106.92 171.385 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 30' ' ' MET . . . . . 0.469 ' SD ' ' HB2' ' B' ' 20' ' ' LYS 0.355 2.7 ptm -48.84 -17.2 0.16 Allowed 'General case' 0 N--CA 1.506 2.341 1 N-CA-C 123.761 4.726 . . . . 0.0 123.761 -146.323 . . . . . . . . 4 3 . 1 . 010 nuclear build core ' B' B ' 31' ' ' ASN . . . . . . . . . . . . . 15.6 t-20 -56.29 -52.85 62.98 Favored 'General case' 0 CA--C 1.587 2.37 0 O-C-N 117.513 -3.242 . . . . 0.0 113.452 151.498 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 32' ' ' SER . . . . . 0.472 ' HB2' ' H ' ' B' ' 29' ' ' SER 0.299 71.0 m -49.37 -64.74 0.72 Allowed 'General case' 0 N--CA 1.496 1.849 0 N-CA-C 118.09 2.626 . . . . 0.0 118.09 150.329 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 33' ' ' GLU . . . . . 0.479 ' CB ' ' HB2' ' B' ' 23' ' ' ALA 0.27 4.9 tp10 -62.67 -60.15 3.91 Favored 'General case' 0 N--CA 1.513 2.676 0 CA-C-N 124.064 3.12 . . . . 0.0 114.449 -178.195 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 34' ' ' LEU . . . . . 0.541 HD22 HD21 ' B' ' 19' ' ' LEU 0.63 0.1 OUTLIER -53.57 -36.11 61.54 Favored 'General case' 0 CA--C 1.562 1.409 0 CA-C-O 114.607 -2.616 . . . . 0.0 106.548 -177.855 . . . . . . . . 4 4 . 1 . 010 nuclear build core ' B' B ' 35' ' ' LEU . . . . . 0.457 ' HG ' ' CE1' ' A' ' 9' ' ' PHE . 19.6 mt -66.16 -48.95 69.05 Favored 'General case' 0 C--N 1.37 1.484 0 CA-C-N 125.365 3.711 . . . . 0.0 115.926 167.361 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 36' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.14 -45.72 86.87 Favored 'General case' 0 N--CA 1.487 1.382 0 N-CA-C 114.671 1.36 . . . . 0.0 114.671 177.097 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 37' ' ' ILE . . . . . 0.42 ' HA ' ' HB3' ' B' ' 40' ' ' ASP . 3.0 tp -71.09 -28.46 33.06 Favored 'Isoleucine or valine' 0 CA--C 1.579 2.068 0 N-CA-C 116.851 2.167 . . . . 0.0 116.851 164.914 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 38' ' ' VAL . . . . . 0.433 HG21 HD12 ' B' ' 34' ' ' LEU . 2.8 t -83.75 -47.04 18.16 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.312 0 CA-C-N 124.265 3.211 . . . . 0.0 110.708 -177.923 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 26.1 mt-30 -54.53 -40.87 69.07 Favored 'General case' 0 CA--C 1.566 1.572 0 CA-C-O 118.093 -0.956 . . . . 0.0 112.268 158.038 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 40' ' ' ASP . . . . . 0.42 ' HB3' ' HA ' ' B' ' 37' ' ' ILE 0.315 24.9 t0 -46.75 -57.32 4.97 Favored 'General case' 0 N--CA 1.493 1.692 0 N-CA-C 115.881 1.808 . . . . 0.0 115.881 153.06 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 41' ' ' ALA . . . . . . . . . . . . 0.31 . . -78.83 -31.96 45.98 Favored 'General case' 0 N--CA 1.474 0.737 0 N-CA-C 119.12 3.007 . . . . 0.0 119.12 -155.18 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 42' ' ' LEU . . . . . 0.405 HD13 ' HB3' ' A' ' 18' ' ' LYS . 2.1 pp . . . . . 0 CA--C 1.563 1.474 0 N-CA-C 117.261 2.319 . . . . 0.0 117.261 159.216 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . 0.3 2.5 p30 . . . . . 0 CA--C 1.567 1.614 0 N-CA-C 113.361 0.874 . . . . 0.0 113.361 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 47.8 Cg_endo -81.9 168.26 15.75 Favored 'Trans proline' 0 CA--C 1.567 2.159 0 C-N-CA 123.557 2.838 . . . . 0.0 115.983 176.492 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 65.0 m80 -108.75 144.93 35.91 Favored 'General case' 0 CA--C 1.567 1.607 0 CA-C-N 113.068 -1.878 . . . . 0.0 112.35 -165.438 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 7' ' ' PHE . . . . . 0.809 ' CZ ' HD12 ' B' ' 34' ' ' LEU . 20.2 p90 -138.46 150.08 46.1 Favored 'General case' 0 CA--C 1.564 1.51 0 O-C-N 120.062 -1.649 . . . . 0.0 111.397 142.63 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 11.7 m120 -71.98 83.48 0.96 Allowed 'General case' 0 N--CA 1.491 1.612 0 O-C-N 120.089 -1.632 . . . . 0.0 111.689 170.083 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 9' ' ' PHE . . . . . 0.683 ' CD2' HD13 ' B' ' 34' ' ' LEU . 6.1 t80 -64.09 147.19 52.76 Favored 'General case' 0 CA--C 1.55 0.943 0 CA-C-O 125.313 2.482 . . . . 0.0 112.026 167.717 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 2.7 tmm_? -144.27 110.06 5.31 Favored 'General case' 0 C--N 1.304 -1.379 0 CA-C-N 111.166 -2.743 . . . . 0.0 104.974 -152.369 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 1.2 mpp? -116.12 116.2 40.11 Favored Pre-proline 0 CA--C 1.562 1.437 0 CA-C-O 117.64 -1.172 . . . . 0.0 111.764 -170.536 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_exo -41.55 140.35 1.74 Allowed 'Trans proline' 0 CA--C 1.559 1.768 0 C-N-CA 122.958 2.439 . . . . 0.0 115.575 156.411 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' MET . . . . . 0.497 ' SD ' ' HG2' ' A' ' 17' ' ' GLU . 25.0 tpp -57.85 -29.04 64.66 Favored 'General case' 0 N--CA 1.496 1.858 0 N-CA-C 118.173 2.657 . . . . 0.0 118.173 -158.87 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -57.43 -52.21 66.29 Favored 'General case' 0 CA--C 1.566 1.594 0 N-CA-C 117.696 2.48 . . . . 0.0 117.696 160.343 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -58.79 -49.45 82.82 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.249 0 CA-C-N 122.087 2.221 . . . . 0.0 112.507 172.207 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . 0.262 1.1 ttt180 -72.39 -37.54 68.7 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-O 115.405 -2.236 . . . . 0.0 115.191 176.959 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 17' ' ' GLU . . . . . 0.497 ' HG2' ' SD ' ' A' ' 13' ' ' MET . 41.8 mm-40 -62.42 -38.56 90.16 Favored 'General case' 0 CA--C 1.559 1.313 0 CA-C-N 124.485 3.311 . . . . 0.0 113.659 164.899 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . 0.576 26.5 pttt -74.72 -36.56 62.67 Favored 'General case' 0 CA--C 1.565 1.543 0 N-CA-C 117.777 2.51 . . . . 0.0 117.777 174.53 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.537 HD21 HD22 ' A' ' 34' ' ' LEU 0.253 11.2 tp -74.41 -34.91 63.38 Favored 'General case' 0 CA--C 1.574 1.891 0 N-CA-C 114.868 1.433 . . . . 0.0 114.868 167.978 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.408 ' HB2' ' SD ' ' A' ' 30' ' ' MET . 2.2 ttpt -91.09 -31.27 16.32 Favored 'General case' 0 CA--C 1.57 1.715 0 O-C-N 120.124 -1.61 . . . . 0.0 113.631 179.908 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 22.7 m-85 -57.41 -68.58 0.22 Allowed 'General case' 0 N--CA 1.496 1.828 0 CA-C-O 113.649 -3.072 . . . . 0.0 110.416 153.977 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . 0.287 30.7 ttt85 -29.4 -43.38 0.03 OUTLIER 'General case' 0 CA--C 1.598 2.81 1 CA-C-N 126.017 4.008 . . . . 0.0 117.676 166.169 . . . . . . . . 3 2 . 1 . 011 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.477 ' HB2' ' CB ' ' A' ' 33' ' ' GLU 0.289 . . -60.05 -71.36 0.13 Allowed 'General case' 0 CA--C 1.589 2.476 0 O-C-N 118.484 -2.635 . . . . 0.0 116.93 159.508 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 . . . . . 0 N--CA 1.502 2.147 0 N-CA-C 118.477 2.769 . . . . 0.0 118.477 177.371 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.439 ' HE ' ' HG2' ' A' ' 33' ' ' GLU . 1.4 mpp_? . . . . . 0 CA--C 1.575 1.91 0 CA-C-O 122.597 1.189 . . . . 0.0 108.0 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 29' ' ' SER . . . . . 0.401 ' H ' ' HB3' ' A' ' 32' ' ' SER . 35.0 t -132.86 112.08 11.62 Favored 'General case' 0 N--CA 1.501 2.104 0 O-C-N 118.602 -2.561 . . . . 0.0 106.921 179.88 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 30' ' ' MET . . . . . 0.408 ' SD ' ' HB2' ' A' ' 20' ' ' LYS . 26.5 mtp -46.12 -31.78 2.56 Favored 'General case' 0 N--CA 1.501 2.105 0 N-CA-C 121.552 3.908 . . . . 0.0 121.552 -138.947 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . 0.275 5.6 t-20 -51.12 -50.91 57.92 Favored 'General case' 0 CA--C 1.59 2.486 0 O-C-N 118.506 -2.622 . . . . 0.0 114.11 160.51 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 32' ' ' SER . . . . . 0.401 ' HB3' ' H ' ' A' ' 29' ' ' SER 0.308 22.8 t -44.44 -68.08 0.23 Allowed 'General case' 0 N--CA 1.503 2.211 0 N-CA-C 117.055 2.243 . . . . 0.0 117.055 143.987 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 33' ' ' GLU . . . . . 0.477 ' CB ' ' HB2' ' A' ' 23' ' ' ALA . 4.9 tm-20 -70.28 -54.79 11.19 Favored 'General case' 0 N--CA 1.505 2.293 0 N-CA-C 118.606 2.817 . . . . 0.0 118.606 -168.157 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.537 HD22 HD21 ' A' ' 19' ' ' LEU 0.589 0.0 OUTLIER -52.2 -34.03 43.55 Favored 'General case' 0 CA--C 1.574 1.87 0 CA-C-O 114.192 -2.813 . . . . 0.0 107.618 168.549 . . . . . . . . 4 4 . 1 . 011 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 21.7 mt -65.7 -46.1 80.27 Favored 'General case' 0 N--CA 1.495 1.787 1 CA-C-N 126.835 4.379 . . . . 0.0 116.257 164.853 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -60.92 -45.1 96.03 Favored 'General case' 0 N--CA 1.488 1.455 0 N-CA-C 114.779 1.4 . . . . 0.0 114.779 178.606 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . 0.27 2.8 tt -60.56 -46.36 95.68 Favored 'Isoleucine or valine' 0 CA--C 1.566 1.573 0 CA-C-O 114.866 -2.492 . . . . 0.0 116.453 156.553 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.433 HG12 ' CG1' ' B' ' 15' ' ' VAL . 3.3 t -71.26 -44.75 72.89 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.215 0 CA-C-N 123.93 3.059 . . . . 0.0 111.676 -169.747 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 23.8 mt-30 -55.7 -45.61 77.83 Favored 'General case' 0 CA--C 1.565 1.551 0 C-N-CA 124.423 1.089 . . . . 0.0 112.776 158.503 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . 0.475 0.9 OUTLIER -49.52 -34.84 18.29 Favored 'General case' 0 N--CA 1.5 2.055 0 N-CA-C 118.648 2.832 . . . . 0.0 118.648 156.74 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.545 0.771 0 C-N-CA 123.914 0.886 . . . . 0.0 111.113 -166.509 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo . . . . . 0 CA--C 1.549 1.23 0 N-CA-C 113.991 0.727 . . . . 0.0 113.991 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' B' B ' 6' ' ' HIS . . . . . . . . . . . . . 75.0 m80 -82.04 115.24 21.09 Favored 'General case' 0 CA--C 1.567 1.601 0 CA-C-N 114.137 -1.392 . . . . 0.0 111.109 170.833 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 7' ' ' PHE . . . . . 0.489 ' CZ ' HD23 ' A' ' 34' ' ' LEU . 1.1 p90 -118.51 150.23 39.97 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 120.856 -1.153 . . . . 0.0 109.855 159.959 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 8' ' ' ASN . . . . . . . . . . . . . 18.2 m120 -68.94 91.02 0.45 Allowed 'General case' 0 N--CA 1.489 1.492 0 O-C-N 120.472 -1.392 . . . . 0.0 112.512 171.077 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 9' ' ' PHE . . . . . 0.544 ' HD2' HD11 ' B' ' 34' ' ' LEU . 4.4 t80 -77.8 146.42 35.8 Favored 'General case' 0 CA--C 1.564 1.486 0 CA-C-O 125.836 2.732 . . . . 0.0 109.592 153.725 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 177.78 102.75 0.02 OUTLIER 'General case' 0 N--CA 1.487 1.381 0 CA-C-N 112.59 -2.095 . . . . 0.0 106.699 -130.363 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 11' ' ' MET . . . . . 0.499 ' SD ' ' HG3' ' B' ' 16' ' ' ARG . 0.9 OUTLIER -132.73 136.53 27.96 Favored Pre-proline 0 N--CA 1.491 1.623 0 CA-C-O 117.549 -1.215 . . . . 0.0 113.677 -154.486 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 12' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -59.19 154.25 47.34 Favored 'Trans proline' 0 CA--C 1.565 2.041 0 CA-C-N 122.692 1.997 . . . . 0.0 114.087 168.517 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 13' ' ' MET . . . . . 0.431 ' SD ' ' HG3' ' B' ' 17' ' ' GLU . 4.7 tpp -61.77 -37.45 84.35 Favored 'General case' 0 N--CA 1.487 1.422 0 N-CA-C 118.365 2.728 . . . . 0.0 118.365 -146.66 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 -61.81 -40.92 96.93 Favored 'General case' 0 CA--C 1.566 1.566 0 N-CA-C 116.428 2.01 . . . . 0.0 116.428 167.139 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 15' ' ' VAL . . . . . 0.433 ' CG1' HG12 ' A' ' 38' ' ' VAL . 0.2 OUTLIER -63.09 -49.43 83.4 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.08 0 CA-C-N 123.293 2.769 . . . . 0.0 111.921 171.788 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 16' ' ' ARG . . . . . 0.499 ' HG3' ' SD ' ' B' ' 11' ' ' MET 0.296 6.0 ttt180 -70.45 -37.05 74.28 Favored 'General case' 0 N--CA 1.477 0.908 0 CA-C-N 121.729 2.059 . . . . 0.0 115.997 175.341 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 17' ' ' GLU . . . . . 0.431 ' HG3' ' SD ' ' B' ' 13' ' ' MET . 37.6 mt-10 -63.03 -39.44 94.74 Favored 'General case' 0 N--CA 1.491 1.609 0 CA-C-N 123.548 2.886 . . . . 0.0 114.234 163.473 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . 0.257 53.6 mtmt -65.0 -49.09 71.61 Favored 'General case' 0 CA--C 1.563 1.452 0 CA-C-N 121.921 2.146 . . . . 0.0 115.344 170.352 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 19' ' ' LEU . . . . . 0.505 HD21 ' CD2' ' B' ' 34' ' ' LEU 0.263 11.9 tp -65.75 -39.69 91.33 Favored 'General case' 0 CA--C 1.568 1.668 0 CA-C-N 120.759 1.618 . . . . 0.0 114.336 173.791 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 20' ' ' LYS . . . . . . . . . . . . . 12.1 ttpt -84.84 -31.31 23.88 Favored 'General case' 0 CA--C 1.557 1.238 0 C-N-CA 125.244 1.418 . . . . 0.0 114.36 179.621 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 20.0 m-85 -60.91 -74.1 0.08 Allowed 'General case' 0 N--CA 1.49 1.531 0 CA-C-O 112.282 -3.723 . . . . 0.0 110.583 154.711 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . 0.292 8.7 ttt180 -16.84 -57.96 0.01 OUTLIER 'General case' 0 CA--C 1.586 2.347 1 CA-C-N 126.487 4.221 . . . . 0.0 116.699 168.866 . . . . . . . . 3 2 . 1 . 011 nuclear build core ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -53.41 -72.31 0.06 Allowed 'General case' 0 CA--C 1.583 2.242 1 N-CA-C 122.153 4.131 . . . . 0.0 122.153 156.896 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 49.3 mt-10 -66.92 -38.71 86.72 Favored 'General case' 0 N--CA 1.505 2.305 0 N-CA-C 118.138 2.644 . . . . 0.0 118.138 177.144 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 25' ' ' ALA . . . . . . . . . . . . . . . -38.5 -48.47 1.4 Allowed 'General case' 0 CA--C 1.585 2.325 0 N-CA-C 116.493 2.034 . . . . 0.0 116.493 155.883 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 26' ' ' ASN . . . . . 0.415 HD21 ' HB2' ' B' ' 28' ' ' ARG . 0.0 OUTLIER -101.27 -48.01 4.52 Favored 'General case' 0 CA--C 1.578 2.031 0 N-CA-C 116.626 2.084 . . . . 0.0 116.626 -173.748 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 27' ' ' GLY . . . . . . . . . . . . . . . 117.95 39.41 0.76 Allowed Glycine 0 CA--C 1.558 2.754 0 N-CA-C 117.774 1.87 . . . . 0.0 117.774 -157.75 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 28' ' ' ARG . . . . . 0.415 ' HB2' HD21 ' B' ' 26' ' ' ASN . 3.1 mtt85 -138.14 97.97 3.52 Favored 'General case' 0 N--CA 1.492 1.663 0 CA-C-N 119.936 1.868 . . . . 0.0 106.078 174.852 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 29' ' ' SER . . . . . . . . . . . . . 32.2 t -75.82 127.88 33.96 Favored 'General case' 0 N--CA 1.504 2.26 0 O-C-N 117.758 -3.089 . . . . 0.0 107.92 -162.301 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 30' ' ' MET . . . . . . . . . . . . . 25.4 mtp -44.93 -42.7 8.35 Favored 'General case' 0 N--CA 1.503 2.198 0 N-CA-C 118.663 2.838 . . . . 0.0 118.663 -144.973 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 31' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -46.26 -40.7 11.93 Favored 'General case' 0 CA--C 1.595 2.688 0 CA-C-N 125.245 3.657 . . . . 0.0 115.788 165.899 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 32' ' ' SER . . . . . . . . . . . . 0.28 40.4 t -56.4 -66.36 0.45 Allowed 'General case' 0 N--CA 1.498 1.963 0 N-CA-C 119.361 3.097 . . . . 0.0 119.361 148.133 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 8.1 tp10 -66.22 -56.27 12.12 Favored 'General case' 0 N--CA 1.515 2.807 0 CA-C-N 124.007 3.094 . . . . 0.0 114.739 -177.857 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 34' ' ' LEU . . . . . 0.809 HD12 ' CZ ' ' A' ' 7' ' ' PHE . 0.0 OUTLIER -37.64 -52.61 1.23 Allowed 'General case' 0 CA--C 1.546 0.81 0 CA-C-O 115.614 -2.136 . . . . 0.0 109.379 165.935 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 35' ' ' LEU . . . . . 0.417 HD23 ' HA ' ' B' ' 35' ' ' LEU . 9.5 mt -62.37 -53.13 59.42 Favored 'General case' 0 N--CA 1.485 1.321 0 CA-C-N 123.984 3.084 . . . . 0.0 115.306 175.148 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 36' ' ' GLN . . . . . . . . . . . . 0.271 8.3 tm0? -63.89 -33.12 74.99 Favored 'General case' 0 CA--C 1.58 2.109 0 N-CA-C 115.963 1.838 . . . . 0.0 115.963 179.644 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 37' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -71.71 -31.05 40.41 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.703 0 CA-C-N 121.058 1.754 . . . . 0.0 115.183 160.905 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 38' ' ' VAL . . . . . 0.429 ' CG1' HD22 ' A' ' 19' ' ' LEU . 2.4 t -80.15 -49.02 19.58 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.262 0 CA-C-N 122.682 2.492 . . . . 0.0 112.328 -179.033 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 32.4 mt-30 -47.01 -41.41 16.39 Favored 'General case' 0 CA--C 1.563 1.448 0 CA-C-O 116.72 -1.61 . . . . 0.0 113.856 149.447 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 40' ' ' ASP . . . . . . . . . . . . 0.447 8.1 t70 -51.32 -55.07 20.33 Favored 'General case' 0 N--CA 1.497 1.899 0 CA-C-N 121.766 2.075 . . . . 0.0 115.936 155.212 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -73.63 -33.31 64.49 Favored 'General case' 0 CA--C 1.552 1.023 0 N-CA-C 116.431 2.012 . . . . 0.0 116.431 -153.467 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.488 1.444 0 N-CA-C 118.691 2.849 . . . . 0.0 118.691 156.273 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 12.1 p-10 . . . . . 0 CA--C 1.57 1.714 0 CA-C-O 118.761 -0.638 . . . . 0.0 110.485 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_exo -98.21 145.95 0.64 Allowed 'Trans proline' 0 C--N 1.364 1.39 0 CA-C-N 123.059 2.128 . . . . 0.0 114.537 -153.793 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 81.0 m80 -75.46 132.85 41.1 Favored 'General case' 0 CA--C 1.563 1.475 0 CA-C-N 113.999 -1.455 . . . . 0.0 112.603 174.569 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 7' ' ' PHE . . . . . 0.645 ' CZ ' HD23 ' B' ' 34' ' ' LEU . 5.1 p90 -133.28 154.21 50.89 Favored 'General case' 0 CA--C 1.563 1.444 0 O-C-N 120.815 -1.178 . . . . 0.0 110.412 146.843 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 4.2 p-10 -59.77 86.44 0.01 OUTLIER 'General case' 0 CA--C 1.566 1.568 0 N-CA-C 115.744 1.757 . . . . 0.0 115.744 168.193 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 9' ' ' PHE . . . . . 0.424 ' HD2' HD21 ' A' ' 34' ' ' LEU 0.26 2.6 t80 -82.26 141.51 32.88 Favored 'General case' 0 CA--C 1.564 1.511 0 CA-C-O 126.375 2.988 . . . . 0.0 110.273 162.019 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 23.2 ttt85 -166.56 121.43 1.13 Allowed 'General case' 0 C--N 1.309 -1.174 0 CA-C-N 111.466 -2.607 . . . . 0.0 107.911 -146.482 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 2.3 mpt? -133.63 119.49 15.09 Favored Pre-proline 0 CA--C 1.56 1.336 0 CA-C-O 117.73 -1.129 . . . . 0.0 111.314 -148.498 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_exo -46.59 146.27 5.47 Favored 'Trans proline' 0 CA--C 1.561 1.841 0 C-N-CA 122.68 2.253 . . . . 0.0 114.931 161.61 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.4 tpp -64.83 -27.99 69.25 Favored 'General case' 0 CA--C 1.568 1.672 0 N-CA-C 118.386 2.736 . . . . 0.0 118.386 -151.188 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . 0.25 8.2 pt-20 -64.63 -43.71 92.83 Favored 'General case' 0 CA--C 1.566 1.593 0 N-CA-C 116.654 2.094 . . . . 0.0 116.654 160.609 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -59.7 -48.2 88.38 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.275 0 CA-C-N 123.269 2.759 . . . . 0.0 112.603 173.231 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 2.0 ttt180 -71.36 -40.28 70.76 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-O 116.265 -1.826 . . . . 0.0 115.611 174.486 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -60.85 -38.71 86.45 Favored 'General case' 0 CA--C 1.567 1.62 0 CA-C-N 123.349 2.795 . . . . 0.0 114.007 166.036 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 52.2 mtmt -66.9 -51.1 59.46 Favored 'General case' 0 CA--C 1.562 1.42 0 CA-C-N 121.362 1.892 . . . . 0.0 115.363 170.791 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.626 HD21 HD22 ' A' ' 34' ' ' LEU 0.281 14.1 tp -65.44 -39.76 92.46 Favored 'General case' 0 CA--C 1.566 1.564 0 N-CA-C 115.542 1.682 . . . . 0.0 115.542 173.863 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 18.9 ttpt -88.2 -25.97 22.63 Favored 'General case' 0 CA--C 1.567 1.629 0 C-N-CA 124.923 1.289 . . . . 0.0 113.922 -179.754 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 19.5 m-30 -67.47 -66.72 0.53 Allowed 'General case' 0 N--CA 1.493 1.693 0 CA-C-O 113.929 -2.938 . . . . 0.0 110.812 158.545 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . 0.336 1.6 tmt_? -27.04 -45.99 0.03 OUTLIER 'General case' 0 CA--C 1.602 2.944 0 CA-C-N 125.699 3.863 . . . . 0.0 114.614 164.528 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.498 ' HB2' ' HB3' ' A' ' 33' ' ' GLU . . . -59.73 -74.87 0.06 Allowed 'General case' 0 CA--C 1.585 2.29 0 N-CA-C 117.298 2.333 . . . . 0.0 117.298 159.314 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 . . . . . 0 N--CA 1.502 2.141 0 N-CA-C 118.72 2.859 . . . . 0.0 118.72 -179.023 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 24.5 mtm-85 . . . . . 0 N--CA 1.491 1.594 0 N-CA-C 107.161 -1.422 . . . . 0.0 107.161 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 43.1 t -114.6 113.73 24.77 Favored 'General case' 0 N--CA 1.496 1.845 0 N-CA-C 104.35 -2.463 . . . . 0.0 104.35 -178.082 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 6.2 mtp -38.03 -40.32 0.47 Allowed 'General case' 0 N--CA 1.501 2.084 0 N-CA-C 121.01 3.708 . . . . 0.0 121.01 -152.111 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . 0.253 0.1 OUTLIER -47.87 -46.79 31.71 Favored 'General case' 0 CA--C 1.592 2.56 0 O-C-N 118.575 -2.578 . . . . 0.0 115.446 163.93 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . 0.354 38.4 t -47.4 -76.14 0.02 OUTLIER 'General case' 0 N--CA 1.5 2.064 0 N-CA-C 118.151 2.649 . . . . 0.0 118.151 142.444 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 33' ' ' GLU . . . . . 0.498 ' HB3' ' HB2' ' A' ' 23' ' ' ALA . 8.5 tp10 -62.87 -56.76 14.42 Favored 'General case' 0 N--CA 1.507 2.39 0 CA-C-N 123.185 2.72 . . . . 0.0 117.261 -170.057 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.734 HD23 ' CZ ' ' B' ' 7' ' ' PHE 0.458 0.4 OUTLIER -47.04 -42.01 17.74 Favored 'General case' 0 CA--C 1.563 1.445 0 CA-C-O 113.274 -3.251 . . . . 0.0 107.313 168.863 . . . . . . . . 4 4 . 1 . 012 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 12.8 mt -61.09 -48.09 83.32 Favored 'General case' 0 N--CA 1.499 1.996 1 CA-C-N 127.11 4.504 . . . . 0.0 116.529 166.201 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.28 -43.32 99.07 Favored 'General case' 0 N--CA 1.487 1.41 0 N-CA-C 115.544 1.683 . . . . 0.0 115.544 -179.145 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 5.4 tt -67.57 -35.44 73.09 Favored 'Isoleucine or valine' 0 C--O 1.199 -1.597 0 CA-C-O 114.29 -2.767 . . . . 0.0 115.781 160.508 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.417 HG21 HD12 ' A' ' 34' ' ' LEU . 2.1 t -75.04 -47.67 35.51 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.143 0 CA-C-N 124.398 3.272 . . . . 0.0 112.619 -174.527 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 32.9 mt-30 -50.52 -46.71 57.41 Favored 'General case' 0 N--CA 1.486 1.341 0 N-CA-C 113.116 0.784 . . . . 0.0 113.116 156.026 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . 0.807 0.0 OUTLIER -55.83 -34.24 65.2 Favored 'General case' 0 CA--C 1.576 1.972 0 N-CA-C 119.555 3.169 . . . . 0.0 119.555 159.971 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.105 0 N-CA-C 115.142 1.534 . . . . 0.0 115.142 -166.307 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 62.7 Cg_endo . . . . . 0 CA--C 1.566 2.107 0 N-CA-C 116.127 1.549 . . . . 0.0 116.127 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' B' B ' 6' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -153.68 159.95 42.2 Favored 'General case' 0 CA--C 1.552 1.028 0 CA-C-N 113.797 -1.547 . . . . 0.0 114.88 -149.802 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 7' ' ' PHE . . . . . 0.734 ' CZ ' HD23 ' A' ' 34' ' ' LEU . 36.9 p90 -142.29 156.58 45.28 Favored 'General case' 0 CA--C 1.56 1.328 0 CA-C-O 122.499 1.142 . . . . 0.0 109.145 161.01 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 8' ' ' ASN . . . . . . . . . . . . . 91.6 m-20 -76.0 87.27 2.93 Favored 'General case' 0 CA--C 1.566 1.581 0 O-C-N 119.922 -1.736 . . . . 0.0 110.716 172.128 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 9' ' ' PHE . . . . . . . . . . . . . 4.8 t80 -62.7 142.3 58.18 Favored 'General case' 0 CA--C 1.56 1.35 0 CA-C-O 125.323 2.487 . . . . 0.0 111.245 171.001 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -148.05 96.78 2.69 Favored 'General case' 0 N--CA 1.486 1.358 0 CA-C-N 111.657 -2.52 . . . . 0.0 107.986 -147.015 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 11' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -114.23 118.26 42.26 Favored Pre-proline 0 CA--C 1.567 1.607 0 CA-C-O 117.135 -1.412 . . . . 0.0 112.012 -156.053 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 12' ' ' PRO . . . . . . . . . . . . . 80.3 Cg_exo -42.57 140.57 2.67 Favored 'Trans proline' 0 C--N 1.373 1.848 0 C-N-CA 123.389 2.726 . . . . 0.0 116.252 164.544 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 13' ' ' MET . . . . . . . . . . . . . 25.9 tpp -58.71 -26.53 64.0 Favored 'General case' 0 N--CA 1.498 1.931 0 N-CA-C 119.003 2.964 . . . . 0.0 119.003 -157.818 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 14' ' ' GLU . . . . . . . . . . . . 0.297 7.0 pt-20 -61.28 -50.96 70.92 Favored 'General case' 0 CA--C 1.566 1.588 0 N-CA-C 115.905 1.817 . . . . 0.0 115.905 160.161 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -58.8 -52.88 54.87 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.794 0 CA-C-N 122.092 2.224 . . . . 0.0 112.109 174.013 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 16' ' ' ARG . . . . . . . . . . . . 0.261 1.8 ttt180 -69.01 -33.21 73.27 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-N 122.255 2.298 . . . . 0.0 115.857 177.889 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 17' ' ' GLU . . . . . . . . . . . . . 5.4 pt-20 -65.3 -44.73 86.98 Favored 'General case' 0 N--CA 1.487 1.385 0 CA-C-N 123.326 2.784 . . . . 0.0 113.948 164.988 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . 0.296 52.5 mtmt -53.12 -55.86 20.8 Favored 'General case' 0 N--CA 1.487 1.412 0 N-CA-C 115.765 1.765 . . . . 0.0 115.765 166.006 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 19' ' ' LEU . . . . . 0.702 HD13 HD22 ' B' ' 34' ' ' LEU . 0.3 OUTLIER -71.87 -32.91 67.94 Favored 'General case' 0 CA--C 1.566 1.558 0 N-CA-C 116.321 1.971 . . . . 0.0 116.321 -179.984 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 20' ' ' LYS . . . . . 0.409 ' HA ' ' HB3' ' B' ' 23' ' ' ALA . 7.6 ttpt -87.29 -21.62 25.65 Favored 'General case' 0 CA--C 1.57 1.72 0 C-N-CA 124.78 1.232 . . . . 0.0 113.78 173.413 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 21' ' ' PHE . . . . . 0.444 ' O ' ' HB3' ' B' ' 25' ' ' ALA . 10.5 m-85 -66.25 -66.7 0.52 Allowed 'General case' 0 N--CA 1.49 1.53 0 CA-C-N 122.132 2.242 . . . . 0.0 110.635 155.195 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 22' ' ' ARG . . . . . 0.571 ' HE ' HG13 ' B' ' 37' ' ' ILE 0.274 1.8 tpt180 -21.48 -53.27 0.02 OUTLIER 'General case' 0 CA--C 1.596 2.742 0 CA-C-N 124.459 3.299 . . . . 0.0 115.259 160.052 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 23' ' ' ALA . . . . . 0.41 ' HB2' ' HB3' ' B' ' 33' ' ' GLU 0.318 . . -54.18 -77.0 0.03 OUTLIER 'General case' 0 CA--C 1.577 2.0 0 N-CA-C 120.546 3.536 . . . . 0.0 120.546 154.066 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 50.6 mm-40 -74.19 -34.38 63.73 Favored 'General case' 0 CA--C 1.576 1.968 0 N-CA-C 118.766 2.876 . . . . 0.0 118.766 -175.836 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 25' ' ' ALA . . . . . 0.444 ' HB3' ' O ' ' B' ' 21' ' ' PHE . . . -46.2 -52.41 12.45 Favored 'General case' 0 CA--C 1.579 2.083 0 N-CA-C 116.015 1.857 . . . . 0.0 116.015 154.562 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 26' ' ' ASN . . . . . . . . . . . . . 9.6 m120 -82.5 -56.8 3.66 Favored 'General case' 0 CA--C 1.575 1.935 0 N-CA-C 114.536 1.31 . . . . 0.0 114.536 179.236 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 27' ' ' GLY . . . . . . . . . . . . . . . 128.17 28.28 0.86 Allowed Glycine 0 CA--C 1.561 2.952 0 N-CA-C 119.037 2.375 . . . . 0.0 119.037 -166.703 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 28' ' ' ARG . . . . . . . . . . . . 0.254 8.3 mtm-85 -118.13 166.13 12.94 Favored 'General case' 0 N--CA 1.497 1.92 0 N-CA-C 105.682 -1.97 . . . . 0.0 105.682 159.929 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 29' ' ' SER . . . . . 0.465 ' H ' ' HB3' ' B' ' 32' ' ' SER . 87.4 p -115.85 113.24 23.09 Favored 'General case' 0 N--CA 1.498 1.935 0 O-C-N 118.836 -2.415 . . . . 0.0 105.244 -173.098 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 30' ' ' MET . . . . . 0.475 ' CE ' ' HB3' ' B' ' 19' ' ' LEU . 13.3 mtp -36.76 -39.5 0.22 Allowed 'General case' 0 N--CA 1.502 2.174 0 N-CA-C 121.397 3.851 . . . . 0.0 121.397 -147.87 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 31' ' ' ASN . . . . . . . . . . . . 0.3 0.5 OUTLIER -48.56 -50.47 32.06 Favored 'General case' 0 CA--C 1.587 2.368 0 O-C-N 118.857 -2.402 . . . . 0.0 114.662 162.945 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 32' ' ' SER . . . . . 0.465 ' HB3' ' H ' ' B' ' 29' ' ' SER 0.361 35.4 t -47.6 -69.95 0.11 Allowed 'General case' 0 N--CA 1.497 1.923 0 N-CA-C 118.392 2.738 . . . . 0.0 118.392 144.449 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 33' ' ' GLU . . . . . 0.41 ' HB3' ' HB2' ' B' ' 23' ' ' ALA . 6.6 tm-20 -76.15 -50.06 15.61 Favored 'General case' 0 N--CA 1.51 2.569 0 CA-C-N 123.978 3.081 . . . . 0.0 119.022 -169.496 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 34' ' ' LEU . . . . . 0.702 HD22 HD13 ' B' ' 19' ' ' LEU 0.47 0.3 OUTLIER -47.06 -39.12 12.34 Favored 'General case' 0 CA--C 1.579 2.09 0 CA-C-O 113.679 -3.057 . . . . 0.0 107.226 161.82 . . . . . . . . 4 4 . 1 . 012 nuclear build core ' B' B ' 35' ' ' LEU . . . . . 0.414 ' HG ' ' CE1' ' A' ' 9' ' ' PHE . 16.1 mt -65.19 -53.15 49.19 Favored 'General case' 0 N--CA 1.499 1.975 1 CA-C-N 127.692 4.769 . . . . 0.0 114.795 166.341 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 36' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -60.96 -33.79 73.76 Favored 'General case' 0 N--CA 1.493 1.688 0 N-CA-C 115.911 1.819 . . . . 0.0 115.911 -178.034 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 37' ' ' ILE . . . . . 0.571 HG13 ' HE ' ' B' ' 22' ' ' ARG . 0.4 OUTLIER -72.35 -42.2 65.25 Favored 'Isoleucine or valine' 0 C--O 1.2 -1.516 0 CA-C-O 115.115 -2.374 . . . . 0.0 115.383 159.409 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 38' ' ' VAL . . . . . 0.406 ' CG1' HD22 ' A' ' 19' ' ' LEU . 3.0 t -71.79 -48.71 49.9 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.408 0 CA-C-N 124.532 3.333 . . . . 0.0 113.111 -177.18 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 24.3 mt-30 -47.72 -51.1 23.27 Favored 'General case' 0 N--CA 1.476 0.856 0 CA-C-O 115.518 -2.182 . . . . 0.0 111.336 155.216 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 40' ' ' ASP . . . . . . . . . . . . 0.69 0.0 OUTLIER -44.1 -51.99 7.55 Favored 'General case' 0 N--CA 1.493 1.71 0 N-CA-C 117.274 2.324 . . . . 0.0 117.274 161.873 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 41' ' ' ALA . . . . . . . . . . . . 0.305 . . -80.18 -27.68 38.87 Favored 'General case' 0 CA--C 1.562 1.426 0 N-CA-C 116.507 2.04 . . . . 0.0 116.507 -159.812 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 1.1 pp . . . . . 0 N--CA 1.489 1.523 0 N-CA-C 118.217 2.673 . . . . 0.0 118.217 158.112 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 47.8 t0 . . . . . 0 CA--C 1.571 1.757 0 N-CA-C 108.549 -0.908 . . . . 0.0 108.549 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 2.8 Cg_endo -106.07 149.68 0.12 Allowed 'Trans proline' 0 C--N 1.371 1.722 0 C-N-CA 122.461 2.107 . . . . 0.0 114.643 -164.723 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 74.5 m80 -89.89 138.52 31.42 Favored 'General case' 0 N--CA 1.489 1.485 0 N-CA-C 113.605 0.965 . . . . 0.0 113.605 -178.744 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 7' ' ' PHE . . . . . 0.781 ' CZ ' HD12 ' B' ' 34' ' ' LEU . 15.8 p90 -128.26 157.35 41.15 Favored 'General case' 0 CA--C 1.566 1.583 0 O-C-N 120.193 -1.567 . . . . 0.0 110.726 144.654 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 85.5 m-20 -71.4 88.02 0.88 Allowed 'General case' 0 N--CA 1.491 1.598 0 O-C-N 119.938 -1.726 . . . . 0.0 111.666 169.956 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 9' ' ' PHE . . . . . 0.604 ' CD2' HD13 ' B' ' 34' ' ' LEU . 2.2 t80 -66.45 151.33 47.42 Favored 'General case' 0 CA--C 1.556 1.185 0 CA-C-O 125.319 2.485 . . . . 0.0 111.014 157.728 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -166.97 99.87 0.54 Allowed 'General case' 0 N--CA 1.488 1.428 0 CA-C-N 111.666 -2.516 . . . . 0.0 108.074 -142.545 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 1.3 mpt? -125.43 117.4 25.0 Favored Pre-proline 0 CA--C 1.561 1.392 0 CA-C-O 116.727 -1.606 . . . . 0.0 112.831 -151.213 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 82.7 Cg_exo -42.66 145.98 0.9 Allowed 'Trans proline' 0 CA--C 1.561 1.869 0 C-N-CA 123.062 2.508 . . . . 0.0 116.679 166.13 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -52.61 -38.45 60.2 Favored 'General case' 0 N--CA 1.498 1.932 0 N-CA-C 117.43 2.382 . . . . 0.0 117.43 -160.713 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . 0.26 9.9 pt-20 -64.59 -42.54 95.52 Favored 'General case' 0 CA--C 1.563 1.476 0 N-CA-C 116.719 2.118 . . . . 0.0 116.719 167.239 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -60.55 -50.31 80.89 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.191 0 CA-C-N 123.977 3.08 . . . . 0.0 113.005 173.795 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 1.2 ttt180 -68.65 -40.95 80.01 Favored 'General case' 0 C--O 1.215 -0.722 0 CA-C-O 115.983 -1.961 . . . . 0.0 115.467 173.191 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -58.5 -41.41 85.3 Favored 'General case' 0 CA--C 1.565 1.521 0 CA-C-N 123.858 3.026 . . . . 0.0 114.427 164.033 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . 0.277 48.8 mtmt -63.07 -54.67 34.4 Favored 'General case' 0 CA--C 1.562 1.418 0 CA-C-N 121.337 1.88 . . . . 0.0 115.046 169.94 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.728 HD13 HD22 ' A' ' 34' ' ' LEU . 9.0 mt -62.53 -38.16 88.88 Favored 'General case' 0 CA--C 1.57 1.747 0 N-CA-C 116.532 2.049 . . . . 0.0 116.532 172.832 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 14.3 ttpt -89.32 -24.94 21.88 Favored 'General case' 0 CA--C 1.57 1.718 0 C-N-CA 125.202 1.401 . . . . 0.0 113.19 -177.733 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 13.3 m-30 -65.23 -65.29 0.69 Allowed 'General case' 0 N--CA 1.49 1.571 0 CA-C-O 115.374 -2.25 . . . . 0.0 111.051 154.363 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . 0.273 7.3 ttm180 -20.71 -54.59 0.02 OUTLIER 'General case' 0 CA--C 1.587 2.401 0 CA-C-N 124.416 3.28 . . . . 0.0 115.922 158.146 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.437 ' HB2' ' HB3' ' A' ' 33' ' ' GLU 0.287 . . -57.87 -74.33 0.06 Allowed 'General case' 0 CA--C 1.585 2.319 0 N-CA-C 118.512 2.782 . . . . 0.0 118.512 158.919 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 15.6 mm-40 . . . . . 0 N--CA 1.499 1.976 0 N-CA-C 118.814 2.894 . . . . 0.0 118.814 -175.621 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 28' ' ' ARG . . . . . 0.502 HH11 ' HG3' ' A' ' 28' ' ' ARG 0.305 2.7 mtm-85 . . . . . 0 CA--C 1.576 1.958 0 N-CA-C 105.541 -2.022 . . . . 0.0 105.541 . . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 29' ' ' SER . . . . . 0.4 ' H ' ' HB3' ' A' ' 32' ' ' SER . 28.4 t -126.69 112.7 15.75 Favored 'General case' 0 N--CA 1.506 2.346 0 O-C-N 117.359 -3.338 . . . . 0.0 106.59 -173.793 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 30' ' ' MET . . . . . 0.498 ' CE ' ' HB3' ' A' ' 19' ' ' LEU . 14.2 mtp -38.2 -39.03 0.38 Allowed 'General case' 0 N--CA 1.501 2.096 1 N-CA-C 121.854 4.02 . . . . 0.0 121.854 -144.676 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 31' ' ' ASN . . . . . 0.425 ' O ' ' HB2' ' A' ' 35' ' ' LEU . 11.6 t-20 -47.15 -53.38 13.14 Favored 'General case' 0 CA--C 1.588 2.413 0 O-C-N 118.713 -2.492 . . . . 0.0 114.186 159.985 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 32' ' ' SER . . . . . 0.4 ' HB3' ' H ' ' A' ' 29' ' ' SER 0.308 30.2 t -49.17 -61.43 2.08 Favored 'General case' 0 N--CA 1.501 2.076 0 N-CA-C 120.219 3.415 . . . . 0.0 120.219 148.41 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 33' ' ' GLU . . . . . 0.437 ' HB3' ' HB2' ' A' ' 23' ' ' ALA . 0.0 OUTLIER -84.14 -47.83 10.48 Favored 'General case' 0 N--CA 1.517 2.918 0 CA-C-N 124.0 3.091 . . . . 0.0 117.829 -174.036 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.728 HD22 HD13 ' A' ' 19' ' ' LEU 0.489 0.3 OUTLIER -50.12 -39.27 42.49 Favored 'General case' 0 CA--C 1.584 2.288 0 CA-C-O 113.744 -3.027 . . . . 0.0 106.326 163.0 . . . . . . . . 4 4 . 1 . 013 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.425 ' HB2' ' O ' ' A' ' 31' ' ' ASN . 13.8 mt -66.26 -57.15 8.16 Favored 'General case' 0 N--CA 1.499 2.014 1 CA-C-N 127.437 4.653 . . . . 0.0 115.014 169.272 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -56.36 -40.52 74.65 Favored 'General case' 0 CA--C 1.557 1.25 0 CA-C-O 115.54 -2.172 . . . . 0.0 113.719 -179.813 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -70.49 -31.04 45.2 Favored 'Isoleucine or valine' 0 C--O 1.201 -1.481 0 CA-C-N 123.156 2.707 . . . . 0.0 116.254 165.144 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.473 HG11 HD11 ' B' ' 19' ' ' LEU . 2.4 t -75.94 -49.83 24.78 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.136 0 CA-C-N 124.084 3.129 . . . . 0.0 112.077 177.076 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 27.1 mt-30 -46.25 -47.21 18.11 Favored 'General case' 0 N--CA 1.486 1.33 0 CA-C-O 116.662 -1.637 . . . . 0.0 113.214 154.09 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . 0.417 24.7 m-20 -47.33 -67.18 0.3 Allowed 'General case' 0 N--CA 1.491 1.593 0 CA-C-N 120.82 1.646 . . . . 0.0 110.509 158.307 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . 0.348 . . . . . . . 0 CA--C 1.558 1.252 0 N-CA-C 116.975 2.213 . . . . 0.0 116.975 -152.693 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 7.7 Cg_exo . . . . . 0 CA--C 1.55 1.324 0 N-CA-C 114.75 1.019 . . . . 0.0 114.75 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' B' B ' 6' ' ' HIS . . . . . . . . . . . . . 74.2 m80 -79.44 126.74 31.23 Favored 'General case' 0 CA--C 1.565 1.522 0 CA-C-N 113.931 -1.486 . . . . 0.0 111.612 177.107 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 7' ' ' PHE . . . . . 0.52 ' CZ ' HD23 ' A' ' 34' ' ' LEU 0.255 2.3 p90 -131.8 153.44 50.13 Favored 'General case' 0 CA--C 1.561 1.372 0 O-C-N 120.239 -1.538 . . . . 0.0 110.419 146.81 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 8' ' ' ASN . . . . . . . . . . . . . 43.4 p-10 -70.48 77.12 0.57 Allowed 'General case' 0 CA--C 1.569 1.683 0 O-C-N 120.989 -1.069 . . . . 0.0 113.842 172.238 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 9' ' ' PHE . . . . . 0.474 ' HD2' HD11 ' B' ' 34' ' ' LEU . 12.2 t80 -73.52 145.7 45.4 Favored 'General case' 0 CA--C 1.558 1.268 0 CA-C-O 126.666 3.126 . . . . 0.0 110.207 168.262 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 10' ' ' ARG . . . . . . . . . . . . . 1.6 ttp180 -173.74 127.77 0.4 Allowed 'General case' 0 C--N 1.298 -1.652 0 CA-C-N 111.235 -2.711 . . . . 0.0 104.818 -135.847 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 11' ' ' MET . . . . . 0.428 ' HB3' ' HB ' ' B' ' 15' ' ' VAL . 1.3 mpt? -143.04 129.71 10.61 Favored Pre-proline 0 CA--C 1.559 1.307 0 CA-C-O 117.271 -1.347 . . . . 0.0 113.836 -159.896 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 12' ' ' PRO . . . . . . . . . . . . . 85.0 Cg_exo -43.06 146.27 0.98 Allowed 'Trans proline' 0 C--N 1.376 1.987 0 C-N-CA 123.201 2.601 . . . . 0.0 116.005 164.167 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 13' ' ' MET . . . . . . . . . . . . . 1.7 tpt -51.34 -36.41 42.83 Favored 'General case' 0 CA--C 1.57 1.749 0 N-CA-C 117.177 2.288 . . . . 0.0 117.177 -159.868 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 14' ' ' GLU . . . . . . . . . . . . 0.252 7.5 pt-20 -64.04 -51.02 66.13 Favored 'General case' 0 CA--C 1.572 1.799 0 N-CA-C 116.36 1.985 . . . . 0.0 116.36 170.407 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 15' ' ' VAL . . . . . 0.428 ' HB ' ' HB3' ' B' ' 11' ' ' MET . 0.0 OUTLIER -56.03 -49.9 72.87 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.393 0 CA-C-N 123.364 2.802 . . . . 0.0 111.972 171.797 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.4 -24.89 63.02 Favored 'General case' 0 N--CA 1.474 0.758 0 N-CA-C 117.304 2.335 . . . . 0.0 117.304 174.484 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 17' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -68.96 -40.41 78.9 Favored 'General case' 0 N--CA 1.492 1.655 0 CA-C-N 123.273 2.76 . . . . 0.0 113.986 154.632 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . 0.263 53.8 mtmt -71.85 -47.79 50.57 Favored 'General case' 0 CA--C 1.563 1.46 0 CA-C-N 121.534 1.97 . . . . 0.0 115.732 179.157 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 19' ' ' LEU . . . . . 0.547 ' HB3' ' CE ' ' B' ' 30' ' ' MET . 12.6 mt -56.02 -54.55 43.49 Favored 'General case' 0 CA--C 1.566 1.593 0 CA-C-N 120.225 1.375 . . . . 0.0 114.238 158.989 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 20' ' ' LYS . . . . . . . . . . . . . 15.1 ttpt -78.67 -20.84 49.31 Favored 'General case' 0 CA--C 1.572 1.809 0 O-C-N 119.453 -2.029 . . . . 0.0 114.371 -173.191 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 21' ' ' PHE . . . . . 0.465 ' O ' ' HB3' ' B' ' 25' ' ' ALA . 14.2 m-85 -68.62 -68.74 0.37 Allowed 'General case' 0 N--CA 1.489 1.516 0 CA-C-O 113.696 -3.05 . . . . 0.0 111.194 156.218 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . 0.276 13.5 tpp180 -22.97 -49.71 0.02 OUTLIER 'General case' 0 CA--C 1.599 2.86 1 CA-C-N 126.231 4.105 . . . . 0.0 115.554 162.7 . . . . . . . . 3 2 . 1 . 013 nuclear build core ' B' B ' 23' ' ' ALA . . . . . 0.433 ' HB2' ' CB ' ' B' ' 33' ' ' GLU 0.265 . . -60.09 -76.08 0.05 Allowed 'General case' 0 CA--C 1.582 2.176 0 N-CA-C 116.815 2.154 . . . . 0.0 116.815 160.884 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 57.7 mm-40 -71.43 -35.03 70.82 Favored 'General case' 0 N--CA 1.5 2.057 0 N-CA-C 118.921 2.934 . . . . 0.0 118.921 -177.516 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 25' ' ' ALA . . . . . 0.465 ' HB3' ' O ' ' B' ' 21' ' ' PHE . . . -44.69 -50.27 10.02 Favored 'General case' 0 CA--C 1.585 2.32 0 N-CA-C 115.89 1.811 . . . . 0.0 115.89 155.705 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 26' ' ' ASN . . . . . . . . . . . . . 12.2 m120 -82.74 -43.37 16.88 Favored 'General case' 0 N--CA 1.501 2.124 0 N-CA-C 116.823 2.157 . . . . 0.0 116.823 176.3 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 27' ' ' GLY . . . . . . . . . . . . . . . 106.51 30.29 4.42 Favored Glycine 0 CA--C 1.561 2.936 0 N-CA-C 118.001 1.96 . . . . 0.0 118.001 -152.875 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 28' ' ' ARG . . . . . 0.566 HH22 HD13 ' B' ' 37' ' ' ILE . 48.4 mtm180 -114.62 145.39 42.06 Favored 'General case' 0 CA--C 1.57 1.742 0 N-CA-C 104.179 -2.526 . . . . 0.0 104.179 171.852 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 29' ' ' SER . . . . . . . . . . . . . 81.0 p -113.05 115.15 27.91 Favored 'General case' 0 N--CA 1.507 2.419 0 O-C-N 117.964 -2.96 . . . . 0.0 105.896 -170.271 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 30' ' ' MET . . . . . 0.547 ' CE ' ' HB3' ' B' ' 19' ' ' LEU . 32.6 mtp -46.62 -42.18 15.8 Favored 'General case' 0 N--CA 1.498 1.943 0 N-CA-C 118.833 2.901 . . . . 0.0 118.833 -141.566 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 31' ' ' ASN . . . . . . . . . . . . . 6.0 t-20 -45.1 -45.52 11.2 Favored 'General case' 0 CA--C 1.594 2.652 0 CA-C-N 125.974 3.988 . . . . 0.0 115.835 163.225 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 32' ' ' SER . . . . . . . . . . . . 0.274 51.7 m -55.34 -62.73 1.48 Allowed 'General case' 0 N--CA 1.502 2.156 0 N-CA-C 120.47 3.507 . . . . 0.0 120.47 151.963 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 33' ' ' GLU . . . . . 0.433 ' CB ' ' HB2' ' B' ' 23' ' ' ALA . 6.2 tm-20 -58.54 -62.58 1.75 Allowed 'General case' 0 N--CA 1.507 2.42 0 CA-C-N 123.076 2.671 . . . . 0.0 115.675 175.343 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 34' ' ' LEU . . . . . 0.781 HD12 ' CZ ' ' A' ' 7' ' ' PHE . 0.0 OUTLIER -44.23 -52.07 7.74 Favored 'General case' 0 C--O 1.212 -0.894 0 CA-C-O 115.653 -2.118 . . . . 0.0 105.948 178.254 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 35' ' ' LEU . . . . . 0.41 ' HG ' ' CE1' ' A' ' 9' ' ' PHE . 8.3 mt -63.17 -56.12 19.39 Favored 'General case' 0 C--N 1.364 1.237 0 CA-C-N 123.319 2.782 . . . . 0.0 116.839 179.98 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 36' ' ' GLN . . . . . . . . . . . . 0.287 0.9 OUTLIER -59.11 -35.85 74.14 Favored 'General case' 0 CA--C 1.568 1.663 0 CA-C-O 117.599 -1.191 . . . . 0.0 113.875 176.122 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 37' ' ' ILE . . . . . 0.566 HD13 HH22 ' B' ' 28' ' ' ARG . 1.3 tp -73.54 -26.08 21.65 Favored 'Isoleucine or valine' 0 CA--C 1.568 1.672 0 N-CA-C 117.831 2.53 . . . . 0.0 117.831 164.015 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 38' ' ' VAL . . . . . 0.496 ' HA ' ' HB3' ' B' ' 41' ' ' ALA . 2.4 t -80.97 -46.26 20.82 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.091 0 C-N-CA 127.887 2.475 . . . . 0.0 112.285 179.807 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 33.5 mt-30 -46.26 -46.92 18.12 Favored 'General case' 0 CA--C 1.576 1.968 0 C-N-CA 124.094 0.958 . . . . 0.0 113.53 150.023 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 40' ' ' ASP . . . . . . . . . . . . 0.289 1.2 t70 -58.56 -32.36 68.84 Favored 'General case' 0 CA--C 1.575 1.918 0 N-CA-C 118.151 2.648 . . . . 0.0 118.151 159.534 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 41' ' ' ALA . . . . . 0.496 ' HB3' ' HA ' ' B' ' 38' ' ' VAL . . . -78.34 -50.92 10.9 Favored 'General case' 0 N--CA 1.48 1.072 0 N-CA-C 115.811 1.782 . . . . 0.0 115.811 -167.715 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 2.6 pp . . . . . 0 CA--C 1.566 1.564 0 N-CA-C 117.281 2.326 . . . . 0.0 117.281 164.812 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 8.8 p-10 . . . . . 0 CA--C 1.567 1.617 0 N-CA-C 112.049 0.388 . . . . 0.0 112.049 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 64.1 Cg_endo -64.37 148.39 90.86 Favored 'Trans proline' 0 CA--C 1.559 1.752 0 C-N-CA 123.698 2.932 . . . . 0.0 116.486 175.847 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 73.2 m80 -92.44 133.01 36.31 Favored 'General case' 0 CA--C 1.566 1.57 0 CA-C-N 113.301 -1.772 . . . . 0.0 110.956 178.977 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 7' ' ' PHE . . . . . 0.564 ' CZ ' HD23 ' B' ' 34' ' ' LEU . 2.8 p90 -125.82 151.23 47.07 Favored 'General case' 0 CA--C 1.563 1.479 0 O-C-N 120.423 -1.423 . . . . 0.0 110.28 154.285 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 14.3 m120 -69.25 90.67 0.5 Allowed 'General case' 0 N--CA 1.488 1.445 0 O-C-N 120.434 -1.416 . . . . 0.0 111.465 167.517 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 9' ' ' PHE . . . . . 0.53 ' HD2' HD11 ' A' ' 34' ' ' LEU . 4.5 t80 -72.57 159.7 33.48 Favored 'General case' 0 CA--C 1.565 1.54 0 CA-C-O 125.207 2.432 . . . . 0.0 109.824 153.723 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 3.1 tmm_? -176.5 114.93 0.11 Allowed 'General case' 0 C--N 1.308 -1.232 0 N-CA-C 104.499 -2.408 . . . . 0.0 104.499 -141.493 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' MET . . . . . 0.489 ' SD ' ' CD2' ' A' ' 9' ' ' PHE . 0.1 OUTLIER -127.18 116.28 21.74 Favored Pre-proline 0 CA--C 1.559 1.311 0 CA-C-O 116.957 -1.497 . . . . 0.0 110.934 -162.488 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 81.5 Cg_exo -40.04 138.13 1.18 Allowed 'Trans proline' 0 CA--C 1.562 1.914 0 CA-C-N 123.798 2.392 . . . . 0.0 116.074 160.488 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' MET . . . . . 0.442 ' SD ' ' HG3' ' A' ' 17' ' ' GLU . 15.5 tpp -54.84 -25.83 31.18 Favored 'General case' 0 N--CA 1.496 1.836 0 N-CA-C 119.496 3.147 . . . . 0.0 119.496 -160.323 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -58.31 -57.55 12.41 Favored 'General case' 0 CA--C 1.568 1.655 0 N-CA-C 117.353 2.353 . . . . 0.0 117.353 156.976 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -55.42 -45.88 78.38 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.433 0 CA-C-N 121.887 2.13 . . . . 0.0 113.454 173.731 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -77.42 -27.89 52.42 Favored 'General case' 0 N--CA 1.474 0.75 0 CA-C-O 115.792 -2.052 . . . . 0.0 116.137 175.176 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 17' ' ' GLU . . . . . 0.442 ' HG3' ' SD ' ' A' ' 13' ' ' MET . 38.4 mt-10 -65.0 -41.27 95.53 Favored 'General case' 0 N--CA 1.485 1.29 0 CA-C-N 124.252 3.205 . . . . 0.0 113.345 158.684 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . 0.542 32.5 pttt -77.44 -39.41 46.88 Favored 'General case' 0 CA--C 1.563 1.449 0 N-CA-C 116.989 2.218 . . . . 0.0 116.989 179.768 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.566 HD21 ' HG ' ' A' ' 34' ' ' LEU . 12.9 tp -66.27 -36.99 84.41 Favored 'General case' 0 CA--C 1.569 1.674 0 CA-C-N 120.595 1.543 . . . . 0.0 114.885 163.632 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.412 ' HA ' ' HB3' ' A' ' 23' ' ' ALA . 13.3 ttpt -90.26 -25.22 20.67 Favored 'General case' 0 CA--C 1.574 1.873 0 N-CA-C 114.821 1.415 . . . . 0.0 114.821 -179.825 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 24.1 m-85 -64.98 -69.58 0.28 Allowed 'General case' 0 N--CA 1.494 1.751 0 CA-C-O 113.581 -3.104 . . . . 0.0 110.501 155.974 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . 0.35 2.5 tmt_? -28.84 -44.0 0.03 OUTLIER 'General case' 0 CA--C 1.605 3.074 0 CA-C-N 125.747 3.885 . . . . 0.0 115.272 166.58 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.507 ' HB2' ' CB ' ' A' ' 33' ' ' GLU . . . -57.85 -76.28 0.04 OUTLIER 'General case' 0 CA--C 1.582 2.203 0 N-CA-C 117.445 2.387 . . . . 0.0 117.445 157.727 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 37.6 mt-10 . . . . . 0 N--CA 1.505 2.276 0 N-CA-C 118.092 2.627 . . . . 0.0 118.092 178.026 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 44.4 mtt85 . . . . . 0 CA--C 1.568 1.654 0 N-CA-C 106.762 -1.57 . . . . 0.0 106.762 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 39.2 t -114.14 118.96 35.5 Favored 'General case' 0 N--CA 1.5 2.064 0 N-CA-C 105.194 -2.15 . . . . 0.0 105.194 -178.893 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 15.1 mtp -47.61 -36.95 11.62 Favored 'General case' 0 N--CA 1.5 2.061 0 N-CA-C 119.25 3.056 . . . . 0.0 119.25 -146.599 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 50.3 t30 -45.53 -45.65 13.49 Favored 'General case' 0 CA--C 1.598 2.827 0 CA-C-N 125.622 3.828 . . . . 0.0 115.715 161.881 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . 0.35 12.8 t -49.12 -73.73 0.04 OUTLIER 'General case' 0 N--CA 1.499 1.982 0 N-CA-C 117.877 2.547 . . . . 0.0 117.877 145.574 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 33' ' ' GLU . . . . . 0.507 ' CB ' ' HB2' ' A' ' 23' ' ' ALA . 10.1 tp10 -57.92 -57.35 13.18 Favored 'General case' 0 N--CA 1.516 2.834 0 CA-C-N 124.017 3.099 . . . . 0.0 116.523 -174.656 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.834 HD12 ' CZ ' ' B' ' 7' ' ' PHE . 0.1 OUTLIER -42.56 -53.2 4.49 Favored 'General case' 0 CA--C 1.555 1.145 0 CA-C-O 115.476 -2.202 . . . . 0.0 107.183 171.164 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.414 ' HG ' ' CE1' ' B' ' 9' ' ' PHE . 16.0 mt -62.24 -43.85 97.9 Favored 'General case' 0 C--N 1.368 1.388 0 CA-C-N 124.077 3.126 . . . . 0.0 115.954 174.036 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.76 -44.23 93.95 Favored 'General case' 0 N--CA 1.49 1.553 0 N-CA-C 115.37 1.619 . . . . 0.0 115.37 175.106 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 37' ' ' ILE . . . . . 0.414 ' O ' ' HB2' ' A' ' 41' ' ' ALA . 3.4 tt -75.07 -20.79 16.46 Favored 'Isoleucine or valine' 0 CA--C 1.564 1.493 0 CA-C-O 114.667 -2.587 . . . . 0.0 116.056 165.537 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.518 HG21 HD22 ' A' ' 34' ' ' LEU . 4.1 t -89.91 -48.53 14.33 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.001 0 CA-C-N 123.222 2.737 . . . . 0.0 109.927 -174.915 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 26.6 mt-30 -55.32 -43.67 75.13 Favored 'General case' 0 CA--C 1.565 1.527 0 O-C-N 121.276 -0.89 . . . . 0.0 112.31 156.953 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . 0.672 0.4 OUTLIER -61.02 -28.02 68.75 Favored 'General case' 0 CA--C 1.571 1.78 0 N-CA-C 118.531 2.789 . . . . 0.0 118.531 157.572 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 41' ' ' ALA . . . . . 0.417 ' HB3' ' HA ' ' A' ' 38' ' ' VAL . . . . . . . . 0 N--CA 1.494 1.728 0 O-C-N 119.431 -2.043 . . . . 0.0 114.238 -179.766 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 3.3 Cg_exo . . . . . 0 CA--C 1.552 1.408 0 CA-C-O 122.025 0.76 . . . . 0.0 113.683 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' B' B ' 6' ' ' HIS . . . . . . . . . . . . . 78.5 m80 -83.22 128.95 34.94 Favored 'General case' 0 CA--C 1.562 1.44 0 CA-C-N 114.155 -1.384 . . . . 0.0 111.974 -178.171 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 7' ' ' PHE . . . . . 0.834 ' CZ ' HD12 ' A' ' 34' ' ' LEU . 4.2 p90 -129.45 146.53 51.28 Favored 'General case' 0 CA--C 1.562 1.406 0 O-C-N 120.599 -1.313 . . . . 0.0 110.754 154.577 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 8' ' ' ASN . . . . . . . . . . . . . 12.6 m120 -70.26 86.42 0.58 Allowed 'General case' 0 N--CA 1.489 1.509 0 O-C-N 120.552 -1.343 . . . . 0.0 111.261 170.369 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 9' ' ' PHE . . . . . 0.678 ' CD2' HD13 ' A' ' 34' ' ' LEU . 5.9 t80 -70.48 153.12 43.27 Favored 'General case' 0 CA--C 1.551 1.006 0 CA-C-O 124.91 2.29 . . . . 0.0 110.745 161.907 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -162.65 126.15 2.93 Favored 'General case' 0 N--CA 1.481 1.114 0 CA-C-N 112.433 -2.167 . . . . 0.0 108.504 -160.752 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 11' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -127.02 115.44 21.96 Favored Pre-proline 0 CA--C 1.562 1.435 0 CA-C-O 117.253 -1.356 . . . . 0.0 110.605 -156.689 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 12' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_exo -41.96 142.99 1.31 Allowed 'Trans proline' 0 C--N 1.374 1.883 0 C-N-CA 122.99 2.46 . . . . 0.0 115.69 160.371 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 13' ' ' MET . . . . . . . . . . . . . 20.2 tpp -61.74 -35.56 78.46 Favored 'General case' 0 N--CA 1.493 1.69 0 N-CA-C 117.403 2.371 . . . . 0.0 117.403 -149.14 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 8.0 pt-20 -59.07 -41.44 88.0 Favored 'General case' 0 CA--C 1.568 1.645 0 N-CA-C 116.649 2.092 . . . . 0.0 116.649 163.564 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 15' ' ' VAL . . . . . 0.414 ' CG1' HG12 ' A' ' 38' ' ' VAL . 0.4 OUTLIER -59.65 -48.85 85.93 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.146 0 CA-C-N 122.885 2.584 . . . . 0.0 112.594 171.101 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 16' ' ' ARG . . . . . . . . . . . . 0.259 2.8 ttt180 -72.15 -41.23 67.33 Favored 'General case' 0 C--O 1.216 -0.704 0 CA-C-N 120.69 1.586 . . . . 0.0 114.855 176.986 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 17' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -61.52 -34.82 76.18 Favored 'General case' 0 CA--C 1.571 1.781 0 CA-C-N 122.779 2.536 . . . . 0.0 115.043 166.41 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 55.7 mtmt -66.55 -55.61 14.63 Favored 'General case' 0 CA--C 1.563 1.452 0 CA-C-N 121.34 1.882 . . . . 0.0 114.666 165.31 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 19' ' ' LEU . . . . . 0.599 HD21 HD22 ' B' ' 34' ' ' LEU . 11.3 tp -64.71 -37.06 86.31 Favored 'General case' 0 CA--C 1.566 1.572 0 N-CA-C 116.353 1.982 . . . . 0.0 116.353 176.965 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 20' ' ' LYS . . . . . . . . . . . . . 3.8 ttpt -87.22 -25.02 24.21 Favored 'General case' 0 CA--C 1.568 1.655 0 CA-C-O 116.917 -1.516 . . . . 0.0 113.598 176.331 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 13.6 m-30 -65.27 -71.06 0.2 Allowed 'General case' 0 N--CA 1.496 1.85 0 CA-C-O 113.551 -3.118 . . . . 0.0 110.667 158.218 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . 0.273 1.5 tpp180 -13.69 -56.68 0.0 OUTLIER 'General case' 0 CA--C 1.595 2.707 0 CA-C-N 125.263 3.665 . . . . 0.0 115.988 158.273 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 23' ' ' ALA . . . . . 0.551 ' HB2' ' HB3' ' B' ' 33' ' ' GLU 0.261 . . -57.91 -77.65 0.03 OUTLIER 'General case' 0 CA--C 1.589 2.47 0 N-CA-C 117.653 2.464 . . . . 0.0 117.653 160.664 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 54.5 mt-10 -61.13 -42.83 99.26 Favored 'General case' 0 N--CA 1.503 2.216 0 N-CA-C 118.874 2.916 . . . . 0.0 118.874 179.251 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 25' ' ' ALA . . . . . . . . . . . . . . . -39.63 -50.26 2.25 Favored 'General case' 0 CA--C 1.585 2.322 0 N-CA-C 115.882 1.808 . . . . 0.0 115.882 158.45 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 26' ' ' ASN . . . . . . . . . . . . . 71.2 m-20 -82.11 -49.15 10.5 Favored 'General case' 0 N--CA 1.498 1.952 0 N-CA-C 116.293 1.96 . . . . 0.0 116.293 174.79 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 27' ' ' GLY . . . . . . . . . . . . . . . 109.49 15.06 12.86 Favored Glycine 0 CA--C 1.561 2.964 0 N-CA-C 118.756 2.262 . . . . 0.0 118.756 -148.25 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 28' ' ' ARG . . . . . . . . . . . . . 1.7 mtt85 -98.66 156.04 17.02 Favored 'General case' 0 CA--C 1.573 1.829 0 CA-C-N 120.358 2.079 . . . . 0.0 105.59 162.737 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 29' ' ' SER . . . . . 0.536 ' H ' ' HB3' ' B' ' 32' ' ' SER . 38.9 t -122.14 112.22 17.94 Favored 'General case' 0 N--CA 1.503 2.21 0 O-C-N 117.928 -2.983 . . . . 0.0 105.774 -172.228 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 30' ' ' MET . . . . . . . . . . . . . 20.4 mtp -42.88 -32.12 0.58 Allowed 'General case' 0 N--CA 1.505 2.305 0 N-CA-C 121.46 3.874 . . . . 0.0 121.46 -146.133 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 31' ' ' ASN . . . . . . . . . . . . 0.269 12.5 t-20 -50.46 -52.12 40.86 Favored 'General case' 0 CA--C 1.594 2.659 0 O-C-N 118.34 -2.725 . . . . 0.0 114.414 159.002 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 32' ' ' SER . . . . . 0.536 ' HB3' ' H ' ' B' ' 29' ' ' SER 0.321 30.5 t -45.2 -77.54 0.02 OUTLIER 'General case' 0 N--CA 1.501 2.088 0 N-CA-C 116.793 2.145 . . . . 0.0 116.793 145.223 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 33' ' ' GLU . . . . . 0.551 ' HB3' ' HB2' ' B' ' 23' ' ' ALA . 3.3 tp10 -67.83 -52.52 35.91 Favored 'General case' 0 N--CA 1.505 2.282 0 CA-C-N 123.728 2.967 . . . . 0.0 116.198 -168.095 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 34' ' ' LEU . . . . . 0.599 HD22 HD21 ' B' ' 19' ' ' LEU 0.595 0.1 OUTLIER -49.56 -36.76 24.83 Favored 'General case' 0 CA--C 1.569 1.683 0 CA-C-O 114.061 -2.876 . . . . 0.0 107.882 170.833 . . . . . . . . 4 4 . 1 . 014 nuclear build core ' B' B ' 35' ' ' LEU . . . . . 0.413 ' HG ' ' CE1' ' A' ' 9' ' ' PHE . 19.2 mt -65.56 -51.23 61.36 Favored 'General case' 0 N--CA 1.494 1.757 1 CA-C-N 126.493 4.224 . . . . 0.0 115.317 165.829 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 36' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -62.7 -39.12 93.0 Favored 'General case' 0 N--CA 1.477 0.905 0 CA-C-O 116.569 -1.682 . . . . 0.0 114.892 -177.325 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 37' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -69.36 -33.16 56.3 Favored 'Isoleucine or valine' 0 CA--C 1.572 1.802 0 CA-C-O 114.064 -2.874 . . . . 0.0 116.935 158.231 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 38' ' ' VAL . . . . . 0.407 ' CG1' HD22 ' A' ' 19' ' ' LEU . 2.2 t -77.24 -50.68 20.08 Favored 'Isoleucine or valine' 0 N--CA 1.513 2.706 0 CA-C-N 125.453 3.751 . . . . 0.0 112.259 -178.09 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 23.6 mt-30 -47.38 -44.76 24.53 Favored 'General case' 0 CA--C 1.557 1.226 0 CA-C-O 116.935 -1.507 . . . . 0.0 112.072 153.534 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 40' ' ' ASP . . . . . . . . . . . . 0.671 0.0 OUTLIER -48.0 -57.31 5.93 Favored 'General case' 0 N--CA 1.494 1.73 0 N-CA-C 117.051 2.241 . . . . 0.0 117.051 156.03 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -71.01 -44.64 65.48 Favored 'General case' 0 CA--C 1.543 0.684 0 N-CA-C 115.076 1.51 . . . . 0.0 115.076 -151.153 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . 0.312 0.7 OUTLIER . . . . . 0 N--CA 1.49 1.56 0 N-CA-C 118.394 2.738 . . . . 0.0 118.394 157.372 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 52.8 p-10 . . . . . 0 CA--C 1.57 1.714 0 CA-C-O 118.545 -0.74 . . . . 0.0 110.685 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 5.9 Cg_exo -101.12 144.98 0.29 Allowed 'Trans proline' 0 CA--C 1.559 1.733 0 CA-C-N 122.293 1.855 . . . . 0.0 114.619 -156.717 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 75.2 m80 -85.78 129.73 34.75 Favored 'General case' 0 CA--C 1.577 1.985 0 CA-C-N 115.011 -0.995 . . . . 0.0 112.144 179.754 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 7' ' ' PHE . . . . . 0.791 ' CZ ' HD12 ' B' ' 34' ' ' LEU . 8.3 p90 -129.42 152.95 48.41 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 119.329 -2.107 . . . . 0.0 111.115 147.871 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 14.2 m120 -71.17 87.05 0.78 Allowed 'General case' 0 N--CA 1.491 1.602 0 O-C-N 120.059 -1.651 . . . . 0.0 112.614 172.49 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 9' ' ' PHE . . . . . 0.625 ' CD2' HD13 ' B' ' 34' ' ' LEU . 2.8 t80 -74.19 138.0 43.48 Favored 'General case' 0 CA--C 1.556 1.18 0 CA-C-O 125.573 2.606 . . . . 0.0 110.271 163.075 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -163.29 120.37 1.85 Allowed 'General case' 0 N--CA 1.487 1.422 0 CA-C-N 112.003 -2.362 . . . . 0.0 107.955 -153.002 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 2.5 mpt? -131.27 119.32 17.57 Favored Pre-proline 0 N--CA 1.485 1.278 0 CA-C-O 116.845 -1.55 . . . . 0.0 113.199 -142.162 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 75.5 Cg_exo -42.73 142.78 1.91 Allowed 'Trans proline' 0 C--N 1.372 1.807 0 C-N-CA 123.082 2.521 . . . . 0.0 115.529 165.003 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -57.19 -36.41 70.78 Favored 'General case' 0 N--CA 1.493 1.691 0 N-CA-C 117.227 2.306 . . . . 0.0 117.227 -152.405 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -62.28 -43.58 98.5 Favored 'General case' 0 CA--C 1.565 1.521 0 N-CA-C 116.969 2.211 . . . . 0.0 116.969 165.03 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.407 ' CG1' HG12 ' B' ' 38' ' ' VAL . 0.4 OUTLIER -58.76 -50.64 78.58 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.355 0 CA-C-N 124.087 3.131 . . . . 0.0 113.158 174.584 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -67.37 -41.99 84.14 Favored 'General case' 0 C--O 1.214 -0.767 0 CA-C-O 116.041 -1.933 . . . . 0.0 115.789 171.284 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 51.0 mt-10 -59.04 -36.06 74.36 Favored 'General case' 0 CA--C 1.573 1.831 0 CA-C-N 123.935 3.061 . . . . 0.0 114.132 165.889 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . 0.276 42.3 mtmt -69.86 -54.71 12.25 Favored 'General case' 0 CA--C 1.564 1.492 0 CA-C-N 121.705 2.048 . . . . 0.0 115.138 171.909 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.636 HD13 HD22 ' A' ' 34' ' ' LEU . 10.8 mt -57.99 -45.63 86.51 Favored 'General case' 0 CA--C 1.57 1.723 0 N-CA-C 117.248 2.314 . . . . 0.0 117.248 167.565 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.43 ' HA ' ' HB3' ' A' ' 23' ' ' ALA . 17.1 ttpt -85.91 -24.46 26.61 Favored 'General case' 0 CA--C 1.569 1.681 0 C-N-CA 124.941 1.296 . . . . 0.0 113.486 -176.281 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 16.9 m-30 -67.44 -64.35 0.87 Allowed 'General case' 0 N--CA 1.492 1.662 0 CA-C-O 114.54 -2.647 . . . . 0.0 110.739 159.138 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . 0.305 12.1 tpp180 -25.22 -45.41 0.02 OUTLIER 'General case' 0 CA--C 1.614 3.406 0 CA-C-N 125.294 3.679 . . . . 0.0 116.089 159.086 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.496 ' HB2' ' CB ' ' A' ' 33' ' ' GLU 0.281 . . -64.45 -69.03 0.31 Allowed 'General case' 0 CA--C 1.59 2.492 0 O-C-N 117.618 -3.177 . . . . 0.0 116.265 163.442 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 39.8 mt-10 . . . . . 0 N--CA 1.501 2.075 0 N-CA-C 118.458 2.762 . . . . 0.0 118.458 -179.427 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.573 1.837 0 CA-C-O 122.622 1.201 . . . . 0.0 108.608 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 29' ' ' SER . . . . . 0.408 ' H ' ' HB3' ' A' ' 32' ' ' SER . 37.5 t -125.61 116.88 22.42 Favored 'General case' 0 N--CA 1.499 2.018 0 O-C-N 119.413 -2.054 . . . . 0.0 105.91 173.174 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 30' ' ' MET . . . . . 0.484 ' CE ' ' HB3' ' A' ' 19' ' ' LEU . 15.2 mtp -46.3 -30.7 2.16 Favored 'General case' 0 N--CA 1.501 2.109 0 N-CA-C 121.705 3.965 . . . . 0.0 121.705 -146.1 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . 0.251 4.0 t-20 -51.3 -49.68 60.83 Favored 'General case' 0 CA--C 1.584 2.281 0 O-C-N 118.512 -2.618 . . . . 0.0 114.164 160.538 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 32' ' ' SER . . . . . 0.408 ' HB3' ' H ' ' A' ' 29' ' ' SER 0.328 29.6 t -45.63 -71.42 0.08 Allowed 'General case' 0 N--CA 1.499 1.985 0 N-CA-C 117.335 2.346 . . . . 0.0 117.335 145.405 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 33' ' ' GLU . . . . . 0.496 ' CB ' ' HB2' ' A' ' 23' ' ' ALA . 0.0 OUTLIER -66.3 -60.24 2.96 Favored 'General case' 0 N--CA 1.503 2.217 0 CA-C-N 122.977 2.626 . . . . 0.0 114.547 -168.541 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.636 HD22 HD13 ' A' ' 19' ' ' LEU 0.573 0.1 OUTLIER -50.46 -34.25 24.17 Favored 'General case' 0 CA--C 1.575 1.907 0 CA-C-O 113.67 -3.062 . . . . 0.0 106.33 175.059 . . . . . . . . 4 4 . 1 . 015 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 17.7 mt -66.4 -49.93 65.16 Favored 'General case' 0 C--N 1.378 1.812 1 CA-C-N 127.288 4.585 . . . . 0.0 116.8 164.227 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -58.43 -41.36 84.85 Favored 'General case' 0 N--CA 1.492 1.627 0 N-CA-C 114.983 1.475 . . . . 0.0 114.983 178.393 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 37' ' ' ILE . . . . . 0.445 ' HA ' ' HB2' ' A' ' 40' ' ' ASP . 2.6 tt -71.8 -31.07 40.03 Favored 'Isoleucine or valine' 0 CA--C 1.567 1.622 0 CA-C-O 114.066 -2.873 . . . . 0.0 116.972 161.398 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.458 ' HA ' ' HB3' ' A' ' 41' ' ' ALA . 3.3 t -77.9 -45.72 27.48 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.291 0 CA-C-N 124.717 3.417 . . . . 0.0 112.156 -179.979 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 23.8 mt-30 -52.74 -43.25 65.6 Favored 'General case' 0 CA--C 1.565 1.54 0 C-N-CA 124.362 1.065 . . . . 0.0 113.14 155.272 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 40' ' ' ASP . . . . . 0.445 ' HB2' ' HA ' ' A' ' 37' ' ' ILE 0.494 2.8 m-20 -57.65 -32.65 67.5 Favored 'General case' 0 N--CA 1.5 2.055 0 N-CA-C 118.938 2.94 . . . . 0.0 118.938 155.089 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 41' ' ' ALA . . . . . 0.458 ' HB3' ' HA ' ' A' ' 38' ' ' VAL . . . . . . . . 0 CA--C 1.551 1.001 0 O-C-N 119.635 -1.916 . . . . 0.0 112.803 -167.372 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo . . . . . 0 CA--C 1.569 2.23 0 N-CA-C 117.207 1.964 . . . . 0.0 117.207 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' B' B ' 6' ' ' HIS . . . . . . . . . . . . . 70.5 m80 -106.6 143.52 34.59 Favored 'General case' 0 CA--C 1.56 1.341 0 CA-C-N 113.555 -1.657 . . . . 0.0 112.402 -167.004 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 7' ' ' PHE . . . . . 0.497 ' CZ ' HD23 ' A' ' 34' ' ' LEU . 8.9 p90 -140.63 155.71 46.46 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 120.411 -1.43 . . . . 0.0 111.1 149.166 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 8' ' ' ASN . . . . . . . . . . . . . 14.7 m120 -71.04 90.04 0.83 Allowed 'General case' 0 N--CA 1.489 1.494 0 O-C-N 120.218 -1.551 . . . . 0.0 111.659 168.537 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 9' ' ' PHE . . . . . . . . . . . . . 6.8 t80 -73.31 149.24 42.81 Favored 'General case' 0 CA--C 1.561 1.397 0 CA-C-O 125.121 2.391 . . . . 0.0 110.428 156.822 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 10' ' ' ARG . . . . . . . . . . . . . 34.0 tpt85 -179.78 93.3 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.651 0 O-C-N 119.718 -1.863 . . . . 0.0 107.869 -123.991 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 11' ' ' MET . . . . . 0.444 ' SD ' ' HG3' ' B' ' 16' ' ' ARG . 1.2 mpt? -130.09 129.88 23.01 Favored Pre-proline 0 CA--C 1.567 1.625 0 CA-C-O 117.302 -1.332 . . . . 0.0 112.805 -153.68 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 12' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_exo -44.89 146.14 2.57 Favored 'Trans proline' 0 CA--C 1.564 2.012 0 C-N-CA 123.082 2.521 . . . . 0.0 116.976 166.867 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 13' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -48.87 -37.53 19.87 Favored 'General case' 0 N--CA 1.496 1.827 0 N-CA-C 118.348 2.721 . . . . 0.0 118.348 -165.554 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 14' ' ' GLU . . . . . . . . . . . . 0.262 8.6 pt-20 -64.29 -48.08 77.05 Favored 'General case' 0 CA--C 1.566 1.572 0 N-CA-C 115.64 1.719 . . . . 0.0 115.64 170.028 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -59.6 -46.97 92.65 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.067 0 CA-C-N 123.408 2.822 . . . . 0.0 112.385 172.052 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 16' ' ' ARG . . . . . 0.444 ' HG3' ' SD ' ' B' ' 11' ' ' MET . 0.0 OUTLIER -74.25 -33.86 63.45 Favored 'General case' 0 N--CA 1.475 0.781 0 N-CA-C 116.455 2.02 . . . . 0.0 116.455 177.184 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 17' ' ' GLU . . . . . . . . . . . . . 74.5 mm-40 -65.32 -41.89 93.54 Favored 'General case' 0 N--CA 1.491 1.623 0 CA-C-N 123.611 2.914 . . . . 0.0 113.896 159.742 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . 0.289 50.9 mtmt -62.56 -45.79 91.3 Favored 'General case' 0 CA--C 1.566 1.561 0 CA-C-N 121.912 2.142 . . . . 0.0 115.361 172.241 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 19' ' ' LEU . . . . . 0.511 HD21 ' CD2' ' B' ' 34' ' ' LEU . 13.9 tp -72.65 -34.94 67.61 Favored 'General case' 0 CA--C 1.569 1.696 0 CA-C-N 120.739 1.608 . . . . 0.0 114.399 176.585 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 20' ' ' LYS . . . . . 0.447 ' HB2' ' SD ' ' B' ' 30' ' ' MET . 8.5 ttpt -88.21 -30.3 19.83 Favored 'General case' 0 CA--C 1.564 1.488 0 C-N-CA 125.635 1.574 . . . . 0.0 114.388 178.468 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 15.1 m-85 -56.82 -73.59 0.06 Allowed 'General case' 0 N--CA 1.491 1.599 0 CA-C-O 113.581 -3.104 . . . . 0.0 110.46 148.915 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . 0.406 4.9 tmm_? -31.34 -41.68 0.04 OUTLIER 'General case' 0 CA--C 1.594 2.655 0 CA-C-N 125.829 3.922 . . . . 0.0 116.869 173.66 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -57.46 -74.48 0.06 Allowed 'General case' 0 CA--C 1.585 2.316 0 N-CA-C 118.856 2.91 . . . . 0.0 118.856 154.357 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -59.92 -45.82 91.37 Favored 'General case' 0 N--CA 1.504 2.274 0 N-CA-C 118.826 2.899 . . . . 0.0 118.826 175.363 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 25' ' ' ALA . . . . . . . . . . . . . . . -38.98 -51.92 1.79 Allowed 'General case' 0 CA--C 1.587 2.378 0 N-CA-C 116.824 2.157 . . . . 0.0 116.824 159.42 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 26' ' ' ASN . . . . . . . . . . . . . 34.8 m-20 -87.53 -51.75 5.74 Favored 'General case' 0 CA--C 1.575 1.936 0 N-CA-C 115.236 1.569 . . . . 0.0 115.236 179.67 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 27' ' ' GLY . . . . . . . . . . . . . . . 128.61 19.76 1.62 Allowed Glycine 0 CA--C 1.56 2.875 0 N-CA-C 119.275 2.47 . . . . 0.0 119.275 -161.054 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 28' ' ' ARG . . . . . . . . . . . . . 80.0 mtt-85 -116.22 166.49 11.97 Favored 'General case' 0 N--CA 1.495 1.778 0 CA-C-N 121.049 2.425 . . . . 0.0 106.957 167.535 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 29' ' ' SER . . . . . . . . . . . . . 91.1 p -121.14 112.55 18.82 Favored 'General case' 0 N--CA 1.5 2.049 0 O-C-N 118.742 -2.474 . . . . 0.0 105.491 -173.115 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 30' ' ' MET . . . . . 0.447 ' SD ' ' HB2' ' B' ' 20' ' ' LYS . 38.3 mtp -41.88 -46.14 3.91 Favored 'General case' 0 N--CA 1.499 2.002 0 N-CA-C 119.438 3.125 . . . . 0.0 119.438 -141.436 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 31' ' ' ASN . . . . . . . . . . . . . 25.2 t-20 -43.43 -44.52 5.83 Favored 'General case' 0 CA--C 1.598 2.796 0 CA-C-N 125.245 3.657 . . . . 0.0 115.712 164.179 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 32' ' ' SER . . . . . . . . . . . . 0.282 62.9 m -58.01 -58.23 9.33 Favored 'General case' 0 N--CA 1.498 1.96 0 N-CA-C 120.914 3.672 . . . . 0.0 120.914 149.688 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -64.9 -61.99 1.83 Allowed 'General case' 0 N--CA 1.515 2.795 0 CA-C-N 123.76 2.982 . . . . 0.0 114.835 177.637 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 34' ' ' LEU . . . . . 0.791 HD12 ' CZ ' ' A' ' 7' ' ' PHE . 0.0 OUTLIER -38.8 -53.96 1.64 Allowed 'General case' 0 CA--C 1.549 0.915 0 CA-C-O 115.004 -2.426 . . . . 0.0 107.934 170.726 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 35' ' ' LEU . . . . . 0.506 ' HG ' ' CE1' ' A' ' 9' ' ' PHE . 11.1 mt -65.09 -60.31 3.16 Favored 'General case' 0 N--CA 1.485 1.293 0 CA-C-N 124.448 3.295 . . . . 0.0 115.665 -178.156 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 36' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -53.0 -41.46 64.66 Favored 'General case' 0 CA--C 1.558 1.253 0 CA-C-O 117.213 -1.375 . . . . 0.0 113.932 175.073 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 37' ' ' ILE . . . . . 0.441 ' HA ' ' HB3' ' B' ' 40' ' ' ASP . 1.6 tp -75.08 -24.91 18.0 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.405 0 N-CA-C 116.37 1.989 . . . . 0.0 116.37 173.165 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 38' ' ' VAL . . . . . 0.521 HG11 HD11 ' A' ' 19' ' ' LEU . 2.2 t -81.15 -49.76 17.65 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.809 0 C-N-CA 127.487 2.315 . . . . 0.0 111.03 175.643 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 9.7 tt0 -44.27 -47.88 9.45 Favored 'General case' 0 CA--C 1.559 1.3 0 C-N-CA 124.771 1.229 . . . . 0.0 113.649 153.814 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 40' ' ' ASP . . . . . 0.441 ' HB3' ' HA ' ' B' ' 37' ' ' ILE 0.582 0.7 OUTLIER -53.09 -59.01 5.09 Favored 'General case' 0 CA--C 1.553 1.081 0 N-CA-C 116.092 1.886 . . . . 0.0 116.092 157.317 . . . . . . . . 4 4 . 1 . 015 nuclear build core ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -67.4 -37.34 82.96 Favored 'General case' 0 CA--C 1.555 1.147 0 N-CA-C 116.591 2.071 . . . . 0.0 116.591 -159.465 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . 0.331 1.2 pp . . . . . 0 N--CA 1.49 1.553 0 N-CA-C 119.321 3.082 . . . . 0.0 119.321 157.418 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.559 1.314 0 N-CA-C 113.757 1.021 . . . . 0.0 113.757 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 22.3 mmt180 -84.6 77.98 9.93 Favored 'General case' 0 N--CA 1.491 1.591 0 N-CA-C 114.502 1.297 . . . . 0.0 114.502 -176.639 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -106.04 23.11 14.54 Favored 'General case' 0 CA--C 1.572 1.792 0 N-CA-C 114.321 1.23 . . . . 0.0 114.321 154.673 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 2.5 p30 -151.86 86.72 4.51 Favored Pre-proline 0 CA--C 1.567 1.606 0 O-C-N 120.367 -1.458 . . . . 0.0 112.074 155.507 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 5.7 Cg_exo -87.89 148.55 7.04 Favored 'Trans proline' 0 CA--C 1.549 1.247 0 C-N-CA 122.486 2.124 . . . . 0.0 114.676 -170.704 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 37.8 m80 -73.57 141.3 46.66 Favored 'General case' 0 CA--C 1.561 1.394 0 CA-C-N 113.384 -1.734 . . . . 0.0 113.355 173.555 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' PHE . . . . . 0.758 ' CZ ' HD12 ' B' ' 34' ' ' LEU . 24.3 p90 -125.93 163.81 22.15 Favored 'General case' 0 CA--C 1.559 1.317 0 O-C-N 120.035 -1.666 . . . . 0.0 111.2 115.807 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 1.1 p-10 -73.98 91.08 2.0 Favored 'General case' 0 CA--C 1.567 1.604 0 O-C-N 120.106 -1.621 . . . . 0.0 110.398 159.525 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' PHE . . . . . 0.631 ' CD2' HD13 ' B' ' 34' ' ' LEU . 4.1 t80 -66.99 168.07 10.62 Favored 'General case' 0 CA--C 1.559 1.325 0 CA-C-O 124.049 1.88 . . . . 0.0 110.489 154.274 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 9.6 tpt180 163.28 109.03 0.0 OUTLIER 'General case' 0 N--CA 1.488 1.443 0 O-C-N 119.724 -1.86 . . . . 0.0 106.211 -120.173 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' MET . . . . . 0.641 ' SD ' HD23 ' A' ' 19' ' ' LEU . 13.6 mtm -144.73 123.21 6.75 Favored Pre-proline 0 CA--C 1.562 1.438 0 CA-C-N 114.08 -1.418 . . . . 0.0 108.881 -157.228 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_exo -43.66 147.92 0.99 Allowed 'Trans proline' 0 CA--C 1.562 1.9 0 C-N-CA 122.613 2.209 . . . . 0.0 115.952 159.657 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 1.3 tpt -48.99 -40.79 32.02 Favored 'General case' 0 N--CA 1.494 1.749 0 N-CA-C 117.195 2.294 . . . . 0.0 117.195 -166.942 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 1.1 pm0 -56.77 -49.42 75.34 Favored 'General case' 0 CA--C 1.562 1.406 0 N-CA-C 117.774 2.509 . . . . 0.0 117.774 167.092 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -62.33 -45.54 98.53 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.27 0 CA-C-N 122.721 2.51 . . . . 0.0 113.116 173.891 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -78.15 -23.91 47.55 Favored 'General case' 0 CA--C 1.552 1.055 0 N-CA-C 116.51 2.041 . . . . 0.0 116.51 176.532 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 51.0 mt-10 -68.67 -38.52 80.44 Favored 'General case' 0 CA--C 1.559 1.296 0 CA-C-N 121.579 1.99 . . . . 0.0 114.33 154.089 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . 0.608 11.5 pttt -81.39 -35.09 31.19 Favored 'General case' 0 N--CA 1.497 1.907 0 CA-C-N 124.487 3.312 . . . . 0.0 117.142 177.68 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.641 HD23 ' SD ' ' A' ' 11' ' ' MET 0.293 12.6 tp -63.92 -39.13 93.46 Favored 'General case' 0 CA--C 1.567 1.606 0 O-C-N 120.193 -1.567 . . . . 0.0 114.83 159.735 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.576 ' HB2' ' SD ' ' A' ' 30' ' ' MET . 20.0 ttpt -89.08 -20.78 23.91 Favored 'General case' 0 CA--C 1.568 1.656 0 CA-C-O 115.167 -2.349 . . . . 0.0 117.027 175.887 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 21' ' ' PHE . . . . . 0.96 ' HA ' ' HB2' ' A' ' 25' ' ' ALA . 0.1 OUTLIER -102.83 6.5 39.25 Favored 'General case' 0 N--CA 1.529 3.493 0 N-CA-C 119.987 3.329 . . . . 0.0 119.987 164.358 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.509 ' O ' ' N ' ' A' ' 24' ' ' GLU . 2.2 tpp180 -72.71 -140.46 0.01 OUTLIER 'General case' 0 C--N 1.308 -1.205 0 CA-C-O 115.218 -2.325 . . . . 0.0 111.798 106.984 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.759 ' HB1' ' ND2' ' A' ' 26' ' ' ASN 0.66 . . 39.12 -48.32 0.0 OUTLIER 'General case' 0 CA--C 1.593 2.605 1 CA-C-N 127.101 4.5 . . . . 0.0 120.085 -163.865 . . . . . . . . 4 3 . 1 . 001 nuclear build full ' A' A ' 24' ' ' GLU . . . . . 0.647 ' H ' ' HA ' ' A' ' 25' ' ' ALA . 2.5 tt0 -135.74 -64.11 0.64 Allowed 'General case' 0 N--CA 1.496 1.857 1 O-C-N 115.878 -4.264 . . . . 0.0 119.987 121.481 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.96 ' HB2' ' HA ' ' A' ' 21' ' ' PHE 0.613 . . -66.26 114.65 5.5 Favored 'General case' 0 N--CA 1.499 1.994 1 N-CA-C 134.186 8.587 . . . . 0.0 134.186 24.543 . . . . . . . . 4 3 . 1 . 001 nuclear build full ' A' A ' 26' ' ' ASN . . . . . 0.759 ' ND2' ' HB1' ' A' ' 23' ' ' ALA 1.171 0.7 OUTLIER 26.72 77.21 0.02 OUTLIER 'General case' 0 CA--C 1.577 2.002 2 N-CA-C 130.262 7.134 . . . . 0.0 130.262 -159.525 . . . . . . . . 5 4 . 1 . 001 nuclear build full ' A' A ' 27' ' ' GLY . . . . . 0.567 ' H ' ' HB2' ' A' ' 24' ' ' GLU . . . -108.69 -36.52 2.21 Favored Glycine 0 CA--C 1.558 2.744 0 N-CA-C 117.468 1.747 . . . . 0.0 117.468 148.908 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.424 ' O ' ' HB2' ' A' ' 33' ' ' GLU 0.398 0.0 OUTLIER -118.35 109.67 16.56 Favored 'General case' 0 N--CA 1.487 1.401 0 N-CA-C 105.864 -1.902 . . . . 0.0 105.864 -173.371 . . . . . . . . 4 4 . 1 . 001 nuclear build full ' A' A ' 29' ' ' SER . . . . . 0.528 ' H ' ' HB3' ' A' ' 32' ' ' SER . 32.6 t -102.0 112.55 25.23 Favored 'General case' 0 N--CA 1.488 1.458 0 CA-C-O 115.107 -2.378 . . . . 0.0 106.307 -118.733 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 30' ' ' MET . . . . . 0.576 ' SD ' ' HB2' ' A' ' 20' ' ' LYS . 21.1 mtp -37.45 -41.2 0.42 Allowed 'General case' 0 N--CA 1.506 2.366 0 N-CA-C 120.165 3.394 . . . . 0.0 120.165 -145.811 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 14.5 t-20 -42.1 -51.75 4.49 Favored 'General case' 0 CA--C 1.597 2.771 0 O-C-N 116.867 -3.646 . . . . 0.0 116.142 159.224 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' SER . . . . . 0.528 ' HB3' ' H ' ' A' ' 29' ' ' SER 0.37 24.4 t -46.12 -65.63 0.52 Allowed 'General case' 0 N--CA 1.5 2.042 0 N-CA-C 119.738 3.236 . . . . 0.0 119.738 144.598 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 33' ' ' GLU . . . . . 0.585 ' HB3' ' HB2' ' A' ' 23' ' ' ALA . 0.1 OUTLIER -71.14 -54.54 10.71 Favored 'General case' 0 N--CA 1.512 2.664 0 N-CA-C 119.269 3.063 . . . . 0.0 119.269 -176.789 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.762 HD12 ' CZ ' ' B' ' 7' ' ' PHE . 0.1 OUTLIER -37.46 -52.84 1.16 Allowed 'General case' 0 CA--C 1.55 0.96 0 CA-C-O 115.586 -2.149 . . . . 0.0 108.814 162.855 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.494 ' HG ' ' CE1' ' B' ' 9' ' ' PHE . 12.9 mt -61.96 -51.32 68.57 Favored 'General case' 0 C--N 1.369 1.444 0 CA-C-N 123.036 2.653 . . . . 0.0 115.098 177.091 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . 0.326 0.0 OUTLIER -67.04 -36.67 82.58 Favored 'General case' 0 CA--C 1.575 1.922 0 CA-C-O 116.081 -1.914 . . . . 0.0 115.022 -178.979 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 8.7 tt -61.97 -44.67 99.24 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.254 0 CA-C-N 124.133 3.151 . . . . 0.0 115.533 154.049 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.497 HG23 ' O ' ' A' ' 34' ' ' LEU . 2.7 t -65.25 -48.23 84.27 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.117 0 CA-C-N 123.351 2.796 . . . . 0.0 112.782 -172.66 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 30.4 mt-30 -48.71 -47.76 40.9 Favored 'General case' 0 CA--C 1.567 1.631 0 C-N-CA 125.571 1.549 . . . . 0.0 114.226 155.685 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . 0.458 2.1 m-20 -52.83 -34.96 56.46 Favored 'General case' 0 CA--C 1.578 2.035 0 N-CA-C 118.68 2.844 . . . . 0.0 118.68 157.475 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 41' ' ' ALA . . . . . 0.425 ' HB3' ' HA ' ' A' ' 38' ' ' VAL . . . -85.26 -57.37 3.11 Favored 'General case' 0 CA--C 1.55 0.965 0 N-CA-C 113.606 0.965 . . . . 0.0 113.606 -161.909 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 2.7 pp -85.23 -2.06 57.62 Favored 'General case' 0 CA--C 1.569 1.674 0 N-CA-C 117.812 2.523 . . . . 0.0 117.812 163.648 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 73.3 m -140.1 42.55 1.94 Allowed 'General case' 0 N--CA 1.496 1.83 0 CA-C-N 122.874 2.579 . . . . 0.0 116.637 173.182 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 8.1 mtpm? -115.28 150.92 45.25 Favored Pre-proline 0 N--CA 1.507 2.394 0 O-C-N 119.927 -1.733 . . . . 0.0 111.667 140.067 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_exo -93.77 165.44 2.21 Favored 'Trans proline' 0 N--CA 1.502 1.974 0 N-CA-C 120.965 3.409 . . . . 0.0 120.965 61.988 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 67.0 m -108.81 120.4 46.22 Favored Pre-proline 0 CA--C 1.576 1.945 0 CA-C-O 117.157 -1.402 . . . . 0.0 108.481 142.881 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 83.4 Cg_exo -50.57 101.86 0.05 OUTLIER 'Trans proline' 0 CA--C 1.575 2.542 0 CA-C-N 124.267 2.56 . . . . 0.0 118.412 179.786 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 4.6 t -25.93 116.5 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.518 2.936 0 N-CA-C 118.51 2.782 . . . . 0.0 118.51 -172.063 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . 0.542 0.5 OUTLIER 66.52 -152.52 0.22 Allowed 'General case' 0 N--CA 1.503 2.206 2 O-C-N 113.072 -6.018 . . . . 0.0 116.603 -12.951 . . . . . . . . 4 3 . 1 . 001 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -124.64 131.59 7.89 Favored Glycine 0 CA--C 1.563 3.05 0 O-C-N 120.557 -1.339 . . . . 0.0 113.507 135.504 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -154.42 172.9 16.99 Favored 'General case' 0 CA--C 1.587 2.381 2 O-C-N 113.969 -5.43 . . . . 0.0 112.36 -6.02 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 34.3 ttm-85 -94.84 -163.36 1.04 Allowed 'General case' 0 N--CA 1.508 2.472 0 O-C-N 120.104 -1.623 . . . . 0.0 112.818 163.07 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' ASN . . . . . 0.722 ' HA ' ' HB2' ' A' ' 55' ' ' ALA 0.415 4.7 m120 80.78 -137.34 0.01 OUTLIER 'General case' 0 N--CA 1.512 2.638 0 O-C-N 118.642 -2.536 . . . . 0.0 111.055 -177.554 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . 0.3 21.1 p30 12.44 68.01 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.87 0 N-CA-C 116.243 1.942 . . . . 0.0 116.243 -101.55 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 55' ' ' ALA . . . . . 0.722 ' HB2' ' HA ' ' A' ' 53' ' ' ASN . . . -84.39 -90.45 0.09 Allowed 'General case' 0 CA--C 1.545 0.77 0 N-CA-C 115.246 1.573 . . . . 0.0 115.246 -153.12 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.459 ' HB2' ' HB3' ' A' ' 55' ' ' ALA . 29.0 mt-10 31.84 -63.58 0.0 OUTLIER 'General case' 0 CA--C 1.563 1.462 1 N-CA-C 122.439 4.237 . . . . 0.0 122.439 82.146 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.577 ' H ' ' N ' ' A' ' 55' ' ' ALA 0.501 1.1 mpt_? -89.71 -44.53 9.95 Favored 'General case' 0 N--CA 1.479 1.016 0 O-C-N 120.153 -1.592 . . . . 0.0 115.057 -178.679 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.558 HD22 ' CD1' ' B' ' 37' ' ' ILE 0.604 33.0 mt -83.44 -1.37 53.38 Favored 'General case' 0 CA--C 1.606 3.111 0 O-C-N 118.567 -2.583 . . . . 0.0 114.063 160.963 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -65.07 -30.97 71.97 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 116.635 -3.791 . . . . 0.0 116.87 141.597 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' ASP . . . . . 0.432 ' HA ' ' HB2' ' A' ' 63' ' ' SER . 0.5 OUTLIER -64.44 -19.28 65.44 Favored 'General case' 0 CA--C 1.571 1.787 0 N-CA-C 117.018 2.229 . . . . 0.0 117.018 154.897 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.413 ' H ' ' HA ' ' A' ' 58' ' ' LEU 0.406 0.1 OUTLIER -55.83 -51.18 68.41 Favored 'General case' 0 N--CA 1.491 1.587 0 CA-C-O 116.492 -1.718 . . . . 0.0 112.174 151.947 . . . . . . . . 4 4 . 1 . 001 nuclear build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -52.46 -63.36 1.17 Allowed 'General case' 0 CA--C 1.56 1.341 0 CA-C-N 121.74 2.064 . . . . 0.0 112.537 170.674 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 63' ' ' SER . . . . . 0.432 ' HB2' ' HA ' ' A' ' 60' ' ' ASP . 28.1 m -21.03 -54.81 0.02 OUTLIER 'General case' 0 N--CA 1.508 2.466 0 N-CA-C 121.634 3.938 . . . . 0.0 121.634 163.039 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . 0.365 51.1 mt-10 -81.26 -9.66 59.73 Favored 'General case' 0 CA--C 1.586 2.352 0 N-CA-C 113.846 1.054 . . . . 0.0 113.846 -179.769 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -103.56 25.19 10.0 Favored 'General case' 0 CA--C 1.607 3.151 0 C-N-CA 126.597 1.959 . . . . 0.0 114.261 151.7 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.416 ' CG1' ' HA ' ' A' ' 63' ' ' SER . 1.3 t . . . . . 0 N--CA 1.524 3.251 0 O-C-N 119.965 -1.709 . . . . 0.0 113.14 -166.309 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.566 1.562 0 N-CA-C 117.967 2.58 . . . . 0.0 117.967 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 2' ' ' ARG . . . . . . . . . . . . 0.286 3.5 mmp_? 63.46 37.87 10.32 Favored 'General case' 0 N--CA 1.506 2.334 0 N-CA-C 118.231 2.678 . . . . 0.0 118.231 173.156 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -160.02 -41.98 0.05 Allowed 'General case' 0 N--CA 1.491 1.609 0 C-N-CA 124.898 1.279 . . . . 0.0 112.046 164.47 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 4' ' ' ASP . . . . . . . . . . . . . 2.1 p30 -139.06 78.82 28.25 Favored Pre-proline 0 CA--C 1.569 1.695 0 O-C-N 120.859 -1.151 . . . . 0.0 111.209 156.01 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -69.75 136.73 33.77 Favored 'Trans proline' 0 CA--C 1.555 1.543 0 C-N-CA 123.478 2.785 . . . . 0.0 116.891 -179.974 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 6' ' ' HIS . . . . . . . . . . . . . 71.9 m80 -77.14 136.67 38.61 Favored 'General case' 0 CA--C 1.577 2.0 0 CA-C-N 113.615 -1.63 . . . . 0.0 111.859 164.222 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 7' ' ' PHE . . . . . 0.762 ' CZ ' HD12 ' A' ' 34' ' ' LEU . 1.2 p90 -136.28 158.1 45.22 Favored 'General case' 0 CA--C 1.57 1.746 0 O-C-N 119.869 -1.769 . . . . 0.0 111.87 150.036 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 8' ' ' ASN . . . . . . . . . . . . . 80.8 m-20 -69.35 103.87 2.11 Favored 'General case' 0 CA--C 1.571 1.773 0 O-C-N 120.374 -1.454 . . . . 0.0 113.033 174.622 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 9' ' ' PHE . . . . . 0.636 ' CG ' HD13 ' A' ' 34' ' ' LEU . 6.8 t80 -120.65 104.81 10.22 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 124.31 1.044 . . . . 0.0 108.318 160.334 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 10' ' ' ARG . . . . . . . . . . . . 0.438 0.1 OUTLIER 91.75 86.9 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.737 1 O-C-N 113.503 -5.748 . . . . 0.0 111.2 -9.779 . . . . . . . . 4 3 . 1 . 001 nuclear build full ' B' B ' 11' ' ' MET . . . . . 0.461 ' HE2' ' CD2' ' B' ' 9' ' ' PHE . 16.4 mtm -155.93 126.7 3.5 Favored Pre-proline 0 CA--C 1.572 1.808 0 CA-C-O 116.894 -1.527 . . . . 0.0 110.241 -154.777 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 12' ' ' PRO . . . . . . . . . . . . . 87.0 Cg_exo -42.55 147.55 0.56 Allowed 'Trans proline' 0 C--N 1.373 1.828 0 C-N-CA 123.788 2.992 . . . . 0.0 117.751 168.941 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 13' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -44.33 -53.17 6.99 Favored 'General case' 0 N--CA 1.493 1.723 0 N-CA-C 118.105 2.632 . . . . 0.0 118.105 -162.851 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -62.1 -39.26 91.89 Favored 'General case' 0 CA--C 1.561 1.375 0 N-CA-C 116.793 2.145 . . . . 0.0 116.793 173.034 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -59.98 -52.25 63.34 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.181 0 CA-C-N 123.509 2.868 . . . . 0.0 111.604 170.423 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -72.14 -30.04 64.64 Favored 'General case' 0 CA--C 1.553 1.07 0 N-CA-C 116.364 1.987 . . . . 0.0 116.364 179.152 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 17' ' ' GLU . . . . . . . . . . . . . 38.3 mt-10 -61.54 -49.25 77.45 Favored 'General case' 0 N--CA 1.492 1.674 0 CA-C-N 122.4 2.364 . . . . 0.0 114.086 155.333 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . 0.255 51.0 mtmt -58.48 -49.54 76.98 Favored 'General case' 0 N--CA 1.489 1.492 0 CA-C-N 122.055 2.207 . . . . 0.0 115.748 174.026 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 19' ' ' LEU . . . . . 0.519 ' HB3' ' CE ' ' B' ' 30' ' ' MET 0.266 0.5 OUTLIER -66.21 -35.82 81.44 Favored 'General case' 0 CA--C 1.571 1.761 0 C-N-CA 125.574 1.55 . . . . 0.0 114.766 174.218 . . . . . . . . 4 4 . 1 . 001 nuclear build full ' B' B ' 20' ' ' LYS . . . . . . . . . . . . . 15.9 ttpt -87.33 -31.2 20.3 Favored 'General case' 0 CA--C 1.564 1.492 0 N-CA-C 114.502 1.297 . . . . 0.0 114.502 178.201 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 13.8 m-85 -59.05 -72.29 0.1 Allowed 'General case' 0 N--CA 1.487 1.409 0 CA-C-O 114.855 -2.498 . . . . 0.0 110.956 155.014 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 22' ' ' ARG . . . . . 0.445 HH21 HD13 ' A' ' 58' ' ' LEU 0.299 13.2 ttt85 -23.83 -50.28 0.02 OUTLIER 'General case' 0 CA--C 1.59 2.496 0 CA-C-N 125.098 3.59 . . . . 0.0 117.043 166.514 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 23' ' ' ALA . . . . . 0.448 ' HB2' ' CB ' ' B' ' 33' ' ' GLU 0.272 . . -53.78 -76.23 0.03 OUTLIER 'General case' 0 CA--C 1.587 2.383 0 N-CA-C 119.332 3.086 . . . . 0.0 119.332 154.849 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 51.1 mm-40 -71.11 -39.29 72.16 Favored 'General case' 0 CA--C 1.578 2.027 0 N-CA-C 119.229 3.048 . . . . 0.0 119.229 -178.351 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 25' ' ' ALA . . . . . . . . . . . . . . . -40.72 -49.87 3.08 Favored 'General case' 0 CA--C 1.578 2.053 0 N-CA-C 117.304 2.335 . . . . 0.0 117.304 154.938 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 26' ' ' ASN . . . . . 0.411 ' HB3' ' O ' ' B' ' 22' ' ' ARG 0.303 0.0 OUTLIER -117.3 -36.71 3.68 Favored 'General case' 0 CA--C 1.578 2.028 0 N-CA-C 115.454 1.65 . . . . 0.0 115.454 -156.386 . . . . . . . . 4 4 . 1 . 001 nuclear build full ' B' B ' 27' ' ' GLY . . . . . . . . . . . . . . . 131.64 31.75 0.5 Allowed Glycine 0 N--CA 1.496 2.674 0 N-CA-C 119.041 2.377 . . . . 0.0 119.041 172.825 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 28' ' ' ARG . . . . . 0.646 ' HE ' ' HB3' ' B' ' 36' ' ' GLN 0.343 3.2 mtm-85 -131.09 164.19 25.99 Favored 'General case' 0 CA--C 1.585 2.299 0 N-CA-C 103.647 -2.723 . . . . 0.0 103.647 168.177 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 29' ' ' SER . . . . . . . . . . . . . 89.9 p -127.41 107.59 10.09 Favored 'General case' 0 N--CA 1.511 2.623 1 O-C-N 116.064 -4.148 . . . . 0.0 108.2 -168.053 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 30' ' ' MET . . . . . 0.519 ' CE ' ' HB3' ' B' ' 19' ' ' LEU . 24.2 mtp -42.88 -42.81 3.81 Favored 'General case' 0 N--CA 1.498 1.972 0 N-CA-C 119.476 3.139 . . . . 0.0 119.476 -133.339 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 31' ' ' ASN . . . . . . . . . . . . 0.274 0.1 OUTLIER -49.28 -43.1 42.83 Favored 'General case' 0 CA--C 1.593 2.608 0 O-C-N 116.712 -3.742 . . . . 0.0 114.966 165.383 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 32' ' ' SER . . . . . . . . . . . . 0.29 27.2 t -50.47 -73.38 0.04 OUTLIER 'General case' 0 N--CA 1.501 2.124 0 N-CA-C 117.54 2.422 . . . . 0.0 117.54 141.927 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 33' ' ' GLU . . . . . 0.448 ' CB ' ' HB2' ' B' ' 23' ' ' ALA . 5.2 tm-20 -65.05 -49.0 71.8 Favored 'General case' 0 N--CA 1.506 2.346 0 N-CA-C 119.598 3.184 . . . . 0.0 119.598 -171.274 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 34' ' ' LEU . . . . . 0.758 HD12 ' CZ ' ' A' ' 7' ' ' PHE . 0.1 OUTLIER -41.51 -57.01 2.36 Favored 'General case' 0 CA--C 1.556 1.198 0 CA-C-O 115.495 -2.193 . . . . 0.0 108.628 158.926 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 35' ' ' LEU . . . . . . . . . . . . . 11.9 mt -60.93 -48.34 82.29 Favored 'General case' 0 N--CA 1.491 1.596 0 CA-C-N 124.44 3.291 . . . . 0.0 116.392 179.058 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 36' ' ' GLN . . . . . 0.646 ' HB3' ' HE ' ' B' ' 28' ' ' ARG . 0.0 OUTLIER -68.46 -34.56 76.16 Favored 'General case' 0 N--CA 1.478 0.964 0 CA-C-O 116.748 -1.596 . . . . 0.0 114.023 178.726 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 37' ' ' ILE . . . . . 0.558 ' CD1' HD22 ' A' ' 58' ' ' LEU . 2.0 tp -70.84 -27.94 32.12 Favored 'Isoleucine or valine' 0 CA--C 1.567 1.602 0 CA-C-O 115.836 -2.031 . . . . 0.0 115.363 163.191 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 38' ' ' VAL . . . . . 0.474 HG21 HD22 ' B' ' 34' ' ' LEU . 2.6 t -86.38 -52.96 11.26 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.194 0 C-N-CA 127.812 2.445 . . . . 0.0 110.917 -174.55 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 33.9 mt-30 -52.96 -37.67 61.36 Favored 'General case' 0 CA--C 1.562 1.427 0 CA-C-O 117.922 -1.037 . . . . 0.0 112.901 156.401 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 40' ' ' ASP . . . . . . . . . . . . 0.322 54.0 t0 -55.78 -54.63 42.13 Favored 'General case' 0 N--CA 1.49 1.548 0 N-CA-C 117.567 2.432 . . . . 0.0 117.567 154.516 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 41' ' ' ALA . . . . . . . . . . . . 0.315 . . -64.17 -40.43 96.11 Favored 'General case' 0 CA--C 1.558 1.253 0 N-CA-C 116.215 1.932 . . . . 0.0 116.215 -167.747 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 42' ' ' LEU . . . . . 0.495 ' HB3' HH21 ' A' ' 22' ' ' ARG . 2.6 pp -118.28 -1.99 11.22 Favored 'General case' 0 N--CA 1.49 1.549 0 N-CA-C 118.176 2.658 . . . . 0.0 118.176 171.65 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 43' ' ' SER . . . . . . . . . . . . . 64.1 p -123.78 6.38 8.76 Favored 'General case' 0 N--CA 1.496 1.865 0 N-CA-C 117.076 2.25 . . . . 0.0 117.076 163.421 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 44' ' ' LYS . . . . . . . . . . . . 0.51 96.4 mttt 71.23 -102.69 0.0 OUTLIER Pre-proline 0 CA--C 1.591 2.531 0 N-CA-C 117.412 2.375 . . . . 0.0 117.412 149.197 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 70.7 Cg_endo -79.81 116.14 3.43 Favored 'Trans proline' 0 CA--C 1.568 2.218 0 CA-C-N 126.948 3.517 . . . . 0.0 118.51 -163.694 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 46' ' ' SER . . . . . . . . . . . . . 36.5 m -74.54 125.95 89.2 Favored Pre-proline 0 CA--C 1.582 2.178 0 CA-C-O 117.874 -1.06 . . . . 0.0 110.141 135.438 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -74.47 95.64 0.95 Allowed 'Trans proline' 0 CA--C 1.569 2.254 0 CA-C-N 123.028 2.117 . . . . 0.0 116.98 -160.764 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 48' ' ' VAL . . . . . . . . . . . . 0.285 97.0 t -85.58 -59.47 2.75 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.098 0 N-CA-C 113.194 0.813 . . . . 0.0 113.194 170.821 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 49' ' ' THR . . . . . . . . . . . . . 11.5 m -131.93 85.43 2.25 Favored 'General case' 0 CA--C 1.572 1.807 2 O-C-N 112.199 -6.563 . . . . 0.0 110.057 -2.922 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 50' ' ' GLY . . . . . . . . . . . . . . . -94.87 61.97 1.61 Allowed Glycine 0 N--CA 1.503 3.116 0 O-C-N 120.15 -1.594 . . . . 0.0 113.858 159.067 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 51' ' ' TYR . . . . . . . . . . . . . 22.3 m-30 -135.34 85.86 2.2 Favored 'General case' 0 CA--C 1.569 1.71 0 CA-C-O 121.46 0.647 . . . . 0.0 109.676 -166.268 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 52' ' ' ARG . . . . . 0.554 ' HE ' ' H ' ' B' ' 53' ' ' ASN . 8.0 tpm_? -141.72 127.03 18.66 Favored 'General case' 0 N--CA 1.503 2.214 0 O-C-N 120.61 -1.306 . . . . 0.0 112.201 160.347 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 53' ' ' ASN . . . . . 0.554 ' H ' ' HE ' ' B' ' 52' ' ' ARG . 0.1 OUTLIER -178.09 176.21 1.16 Allowed 'General case' 0 N--CA 1.501 2.078 0 N-CA-C 118.034 2.605 . . . . 0.0 118.034 -147.227 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 54' ' ' ASP . . . . . 0.608 ' O ' ' HB3' ' B' ' 57' ' ' ARG 0.484 0.0 OUTLIER -89.81 42.7 1.11 Allowed 'General case' 0 CA--C 1.563 1.475 0 CA-C-O 127.799 3.666 . . . . 0.0 116.868 172.519 . . . . . . . . 4 4 . 1 . 001 nuclear build full ' B' B ' 55' ' ' ALA . . . . . . . . . . . . 0.302 . . -67.32 -23.42 65.63 Favored 'General case' 0 CA--C 1.587 2.382 0 O-C-N 116.713 -3.742 . . . . 0.0 118.58 117.319 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 56' ' ' GLU . . . . . 0.442 ' C ' ' HB3' ' B' ' 59' ' ' ALA . 10.8 tp10 -50.22 5.93 0.0 OUTLIER 'General case' 0 CA--C 1.598 2.808 0 N-CA-C 120.371 3.471 . . . . 0.0 120.371 137.144 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 57' ' ' ARG . . . . . 0.608 ' HB3' ' O ' ' B' ' 54' ' ' ASP . 35.7 ttp180 -104.81 -49.79 3.43 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 119.311 -2.118 . . . . 0.0 114.433 163.894 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 58' ' ' LEU . . . . . . . . . . . . 0.558 0.0 OUTLIER -56.9 -26.18 58.6 Favored 'General case' 0 CA--C 1.586 2.339 0 CA-C-N 121.726 2.057 . . . . 0.0 114.043 169.577 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 59' ' ' ALA . . . . . 0.442 ' HB3' ' C ' ' B' ' 56' ' ' GLU . . . -36.51 -96.19 0.0 OUTLIER 'General case' 0 CA--C 1.569 1.707 0 N-CA-C 121.701 3.963 . . . . 0.0 121.701 131.304 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -77.8 -4.88 48.72 Favored 'General case' 0 N--CA 1.483 1.221 0 N-CA-C 117.189 2.292 . . . . 0.0 117.189 -163.008 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 61' ' ' GLU . . . . . . . . . . . . 0.322 0.6 OUTLIER -99.64 -15.98 18.38 Favored 'General case' 0 CA--C 1.557 1.232 0 CA-C-O 114.202 -2.808 . . . . 0.0 114.834 161.392 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 62' ' ' GLN . . . . . . . . . . . . 0.327 0.0 OUTLIER -80.61 -18.94 46.65 Favored 'General case' 0 CA--C 1.583 2.214 1 CA-C-N 127.502 4.683 . . . . 0.0 113.349 161.792 . . . . . . . . 4 3 . 1 . 001 nuclear build full ' B' B ' 63' ' ' SER . . . . . 0.702 ' CA ' HG22 ' B' ' 66' ' ' VAL 1.287 7.9 t -139.87 -8.67 1.21 Allowed 'General case' 0 CA--C 1.58 2.122 0 C-N-CA 129.794 3.238 . . . . 0.0 117.77 -159.849 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 64' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -114.53 51.07 0.91 Allowed 'General case' 0 CA--C 1.576 1.951 0 O-C-N 119.408 -2.058 . . . . 0.0 112.127 119.953 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 65' ' ' LEU . . . . . . . . . . . . 0.352 20.4 mt -113.48 -60.63 1.86 Allowed 'General case' 0 N--CA 1.514 2.763 0 O-C-N 118.663 -2.523 . . . . 0.0 112.692 127.246 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 66' ' ' VAL . . . . . 0.702 HG22 ' CA ' ' B' ' 63' ' ' SER 0.379 0.1 OUTLIER . . . . . 0 N--CA 1.513 2.711 0 N-CA-C 121.459 3.874 . . . . 0.0 121.459 161.642 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.566 1.57 0 N-CA-C 117.64 2.459 . . . . 0.0 117.64 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . 0.275 15.2 mmp_? 57.69 44.31 20.8 Favored 'General case' 0 N--CA 1.504 2.244 0 N-CA-C 117.738 2.496 . . . . 0.0 117.738 170.406 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 6.8 p-10 -139.59 65.84 1.42 Allowed 'General case' 0 CA--C 1.564 1.501 0 N-CA-C 107.296 -1.372 . . . . 0.0 107.296 173.344 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 1.8 p30 -167.29 84.81 0.82 Allowed Pre-proline 0 CA--C 1.567 1.601 0 O-C-N 120.771 -1.205 . . . . 0.0 112.178 -161.092 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_exo -97.31 136.84 0.43 Allowed 'Trans proline' 0 CA--C 1.552 1.411 0 CA-C-N 122.296 1.856 . . . . 0.0 113.256 -161.995 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 75.2 m80 -81.1 122.01 26.81 Favored 'General case' 0 CA--C 1.573 1.841 0 CA-C-N 114.263 -1.335 . . . . 0.0 110.571 174.539 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' PHE . . . . . 0.781 ' CZ ' HD12 ' B' ' 34' ' ' LEU . 1.5 p90 -125.56 157.82 36.14 Favored 'General case' 0 CA--C 1.567 1.631 0 O-C-N 119.984 -1.698 . . . . 0.0 112.184 159.408 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 83.9 m-20 -68.96 103.45 1.83 Allowed 'General case' 0 CA--C 1.57 1.723 0 O-C-N 120.893 -1.129 . . . . 0.0 112.613 176.034 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' PHE . . . . . 0.622 ' CG ' HD13 ' B' ' 34' ' ' LEU . 5.6 t80 -124.47 104.95 9.03 Favored 'General case' 0 CA--C 1.537 0.48 0 N-CA-C 107.328 -1.36 . . . . 0.0 107.328 162.337 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . 0.478 0.1 OUTLIER 93.93 85.55 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.781 1 O-C-N 113.686 -5.634 . . . . 0.0 110.843 -12.54 . . . . . . . . 4 3 . 1 . 002 nuclear build full ' A' A ' 11' ' ' MET . . . . . 0.482 ' HG2' HD21 ' B' ' 35' ' ' LEU . 15.7 mtt -157.14 134.33 6.74 Favored Pre-proline 0 CA--C 1.57 1.738 0 CA-C-O 117.777 -1.106 . . . . 0.0 111.813 -154.715 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 67.8 Cg_exo -49.4 156.35 2.76 Favored 'Trans proline' 0 CA--C 1.564 2.022 0 C-N-CA 123.106 2.537 . . . . 0.0 118.277 167.191 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 9.0 tpp -62.7 -41.65 99.24 Favored 'General case' 0 N--CA 1.488 1.443 0 N-CA-C 116.793 2.146 . . . . 0.0 116.793 -161.579 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 -61.23 -38.72 87.64 Favored 'General case' 0 CA--C 1.565 1.54 0 N-CA-C 115.991 1.848 . . . . 0.0 115.991 165.635 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.457 ' CG1' HG12 ' B' ' 38' ' ' VAL . 1.5 t -58.46 -43.85 87.64 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.077 0 CA-C-N 122.267 2.303 . . . . 0.0 114.983 175.943 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . 0.535 0.1 OUTLIER -117.73 22.25 12.44 Favored 'General case' 0 N--CA 1.483 1.205 0 N-CA-C 119.35 3.093 . . . . 0.0 119.35 171.922 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -66.75 -45.62 77.99 Favored 'General case' 0 CA--C 1.565 1.537 0 O-C-N 118.54 -2.6 . . . . 0.0 113.278 121.201 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . 0.256 46.2 mtmt -63.8 -52.6 59.54 Favored 'General case' 0 N--CA 1.489 1.494 0 CA-C-N 122.535 2.425 . . . . 0.0 116.079 177.454 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.538 HD21 ' CD2' ' A' ' 34' ' ' LEU . 11.7 tp -68.36 -35.55 77.9 Favored 'General case' 0 CA--C 1.564 1.494 0 C-N-CA 124.945 1.298 . . . . 0.0 113.556 173.078 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 2.3 ttpt -87.02 -24.02 24.79 Favored 'General case' 0 CA--C 1.572 1.813 0 CA-C-N 121.309 1.868 . . . . 0.0 114.31 178.667 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' PHE . . . . . 0.404 ' O ' ' HB3' ' A' ' 25' ' ' ALA . 13.9 m-85 -65.34 -68.87 0.33 Allowed 'General case' 0 N--CA 1.488 1.456 0 CA-C-O 114.365 -2.731 . . . . 0.0 111.15 154.887 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . 0.291 24.4 ttt180 -25.46 -48.53 0.02 OUTLIER 'General case' 0 CA--C 1.591 2.528 0 CA-C-N 125.363 3.71 . . . . 0.0 115.94 165.521 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -57.58 -76.56 0.04 OUTLIER 'General case' 0 CA--C 1.589 2.476 0 N-CA-C 117.523 2.416 . . . . 0.0 117.523 157.446 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 36.7 mt-10 -60.45 -49.48 77.38 Favored 'General case' 0 N--CA 1.507 2.378 0 N-CA-C 118.512 2.782 . . . . 0.0 118.512 178.201 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.404 ' HB3' ' O ' ' A' ' 21' ' ' PHE . . . -40.74 -51.14 3.11 Favored 'General case' 0 CA--C 1.588 2.439 0 N-CA-C 116.777 2.14 . . . . 0.0 116.777 162.103 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 86.1 m-20 -83.36 -46.69 12.28 Favored 'General case' 0 N--CA 1.501 2.087 0 N-CA-C 116.108 1.892 . . . . 0.0 116.108 177.201 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 116.61 31.03 1.88 Allowed Glycine 0 CA--C 1.561 2.957 0 N-CA-C 118.08 1.992 . . . . 0.0 118.08 -157.066 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 37.5 mtm-85 -120.13 162.77 18.76 Favored 'General case' 0 CA--C 1.572 1.797 0 N-CA-C 106.546 -1.649 . . . . 0.0 106.546 168.881 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' SER . . . . . 0.434 ' H ' ' HB2' ' A' ' 32' ' ' SER . 33.5 m -122.77 113.34 19.05 Favored 'General case' 0 N--CA 1.503 2.206 0 O-C-N 118.457 -2.652 . . . . 0.0 104.835 -176.478 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 30' ' ' MET . . . . . 0.402 ' HE3' ' HB3' ' A' ' 19' ' ' LEU . 24.4 mtp -44.54 -41.27 6.31 Favored 'General case' 0 N--CA 1.501 2.105 0 N-CA-C 119.486 3.143 . . . . 0.0 119.486 -143.408 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -48.0 -41.53 25.63 Favored 'General case' 0 CA--C 1.595 2.682 0 CA-C-N 124.794 3.452 . . . . 0.0 115.071 165.226 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 32' ' ' SER . . . . . 0.434 ' HB2' ' H ' ' A' ' 29' ' ' SER 0.291 67.3 m -55.31 -61.34 2.4 Favored 'General case' 0 N--CA 1.503 2.201 0 N-CA-C 120.686 3.587 . . . . 0.0 120.686 145.98 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 11.5 tp10 -62.78 -60.56 3.33 Favored 'General case' 0 N--CA 1.523 3.217 0 CA-C-N 125.096 3.589 . . . . 0.0 115.731 178.709 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.733 HD12 ' CZ ' ' B' ' 7' ' ' PHE . 0.1 OUTLIER -41.16 -55.29 2.68 Favored 'General case' 0 CA--C 1.546 0.816 0 CA-C-O 115.587 -2.149 . . . . 0.0 108.214 170.473 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 15.9 mt -61.66 -51.19 69.46 Favored 'General case' 0 C--N 1.37 1.489 0 CA-C-N 123.074 2.67 . . . . 0.0 114.412 176.528 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 1.7 tm0? -54.49 -42.28 70.56 Favored 'General case' 0 CA--C 1.567 1.632 0 N-CA-C 115.675 1.732 . . . . 0.0 115.675 175.68 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 5.3 tp -72.92 -29.16 28.46 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.958 0 CA-C-N 122.301 2.319 . . . . 0.0 116.636 166.484 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.495 ' HA ' ' HB3' ' A' ' 41' ' ' ALA . 8.1 t -80.01 -50.11 18.15 Favored 'Isoleucine or valine' 0 CA--C 1.58 2.118 0 C-N-CA 126.683 1.993 . . . . 0.0 110.042 -178.238 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 26.0 mt-30 -48.09 -40.96 24.96 Favored 'General case' 0 N--CA 1.488 1.429 0 N-CA-C 114.476 1.287 . . . . 0.0 114.476 153.836 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . 0.335 79.2 m-20 -50.5 -62.73 1.42 Allowed 'General case' 0 N--CA 1.491 1.595 0 CA-C-N 120.415 1.461 . . . . 0.0 114.142 154.029 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 41' ' ' ALA . . . . . 0.495 ' HB3' ' HA ' ' A' ' 38' ' ' VAL 0.285 . . -52.82 -33.03 47.3 Favored 'General case' 0 CA--C 1.562 1.409 0 N-CA-C 119.184 3.031 . . . . 0.0 119.184 -171.326 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.59 HD11 ' HB2' ' B' ' 19' ' ' LEU . 10.7 mt -95.71 -36.92 11.01 Favored 'General case' 0 CA--C 1.571 1.77 0 C-N-CA 125.887 1.675 . . . . 0.0 114.587 174.626 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 6.0 t -92.16 4.78 52.48 Favored 'General case' 0 N--CA 1.497 1.908 0 N-CA-C 119.233 3.049 . . . . 0.0 119.233 -177.306 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . 0.716 0.7 OUTLIER 80.22 -106.59 0.0 OUTLIER Pre-proline 0 CA--C 1.599 2.853 0 N-CA-C 120.548 3.536 . . . . 0.0 120.548 147.465 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 24.3 Cg_endo -70.54 136.16 30.29 Favored 'Trans proline' 0 C--N 1.375 1.957 0 CA-C-N 127.648 3.767 . . . . 0.0 118.654 -160.845 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 8.7 t -70.68 149.74 95.33 Favored Pre-proline 0 CA--C 1.575 1.924 0 CA-C-N 114.255 -1.339 . . . . 0.0 113.004 145.269 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 85.0 Cg_endo -75.09 81.78 2.16 Favored 'Trans proline' 0 CA--C 1.571 2.33 0 CA-C-N 123.732 2.369 . . . . 0.0 112.818 167.379 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' VAL . . . . . 0.57 ' H ' HG23 ' A' ' 49' ' ' THR 0.394 59.2 t -127.48 -96.5 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.506 2.326 0 CA-C-O 117.908 -1.044 . . . . 0.0 110.866 -176.56 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 49' ' ' THR . . . . . 0.57 HG23 ' H ' ' A' ' 48' ' ' VAL . 1.4 p -142.07 86.15 1.96 Allowed 'General case' 0 N--CA 1.496 1.87 2 O-C-N 110.386 -7.696 . . . . 0.0 111.684 5.022 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -79.36 -23.32 63.22 Favored Glycine 0 N--CA 1.502 3.07 0 N-CA-C 117.724 1.85 . . . . 0.0 117.724 143.329 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 29.6 m-85 -58.61 116.99 4.05 Favored 'General case' 0 CA--C 1.582 2.202 0 CA-C-N 119.054 1.427 . . . . 0.0 111.586 148.48 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 76.6 mtp180 -132.43 94.78 3.49 Favored 'General case' 0 N--CA 1.509 2.486 0 CA-C-N 120.451 1.478 . . . . 0.0 113.385 170.258 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' ASN . . . . . 0.417 ' HB2' ' H ' ' A' ' 55' ' ' ALA 0.532 0.9 OUTLIER -47.77 119.46 2.82 Favored 'General case' 0 N--CA 1.494 1.751 0 N-CA-C 115.631 1.715 . . . . 0.0 115.631 -164.216 . . . . . . . . 4 4 . 1 . 002 nuclear build full ' A' A ' 54' ' ' ASP . . . . . 0.45 ' H ' ' HG2' ' A' ' 56' ' ' GLU 1.313 4.6 p30 68.59 3.49 3.87 Favored 'General case' 0 N--CA 1.495 1.815 2 N-CA-C 123.055 4.465 . . . . 0.0 123.055 12.766 . . . . . . . . 4 3 . 1 . 002 nuclear build full ' A' A ' 55' ' ' ALA . . . . . 0.594 ' HB1' ' HB2' ' A' ' 58' ' ' LEU 0.579 . . -116.16 12.19 15.43 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 117.367 -3.333 . . . . 0.0 119.982 124.347 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.45 ' HG2' ' H ' ' A' ' 54' ' ' ASP 0.297 9.2 tt0 -34.58 -13.12 0.0 OUTLIER 'General case' 0 CA--C 1.606 3.101 1 N-CA-C 124.01 4.819 . . . . 0.0 124.01 99.557 . . . . . . . . 4 3 . 1 . 002 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.569 ' H ' ' HA ' ' A' ' 55' ' ' ALA . 3.1 tmt_? -115.35 -35.95 4.47 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 118.616 -2.553 . . . . 0.0 113.777 170.148 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.594 ' HB2' ' HB1' ' A' ' 55' ' ' ALA . 0.8 OUTLIER -51.11 -35.09 33.58 Favored 'General case' 0 N--CA 1.514 2.758 0 CA-C-N 122.618 2.463 . . . . 0.0 115.131 148.363 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 59' ' ' ALA . . . . . 0.424 ' HB3' ' C ' ' A' ' 56' ' ' GLU . . . -46.01 -80.66 0.01 OUTLIER 'General case' 0 N--CA 1.481 1.12 0 CA-C-O 115.616 -2.135 . . . . 0.0 114.071 148.0 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -63.73 -11.71 28.59 Favored 'General case' 0 N--CA 1.493 1.719 0 CA-C-N 124.132 3.151 . . . . 0.0 117.752 -169.207 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . 0.298 23.8 tt0 -70.67 -55.04 9.62 Favored 'General case' 0 CA--C 1.553 1.095 0 CA-C-O 117.042 -1.456 . . . . 0.0 113.268 162.367 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 62' ' ' GLN . . . . . 0.682 ' O ' HG13 ' A' ' 66' ' ' VAL 0.378 2.4 mm-40 -82.44 -56.35 3.94 Favored 'General case' 0 N--CA 1.495 1.798 0 CA-C-N 123.011 2.641 . . . . 0.0 112.706 170.616 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . 0.457 0.3 OUTLIER -52.79 -10.32 0.16 Allowed 'General case' 0 CA--C 1.578 2.046 0 N-CA-C 121.613 3.931 . . . . 0.0 121.613 168.277 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 12.5 tt0 -95.49 -37.76 10.75 Favored 'General case' 0 N--CA 1.499 1.986 0 CA-C-N 124.145 3.157 . . . . 0.0 114.513 151.13 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 15.2 mt -90.84 12.97 17.69 Favored 'General case' 0 N--CA 1.504 2.246 0 CA-C-N 121.322 1.874 . . . . 0.0 115.923 -175.018 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.682 HG13 ' O ' ' A' ' 62' ' ' GLN . 6.8 m . . . . . 0 N--CA 1.503 2.186 0 C-N-CA 126.043 1.737 . . . . 0.0 111.941 177.602 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.564 1.517 0 N-CA-C 114.635 1.346 . . . . 0.0 114.635 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 2' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -97.83 66.38 1.9 Allowed 'General case' 0 N--CA 1.498 1.946 1 O-C-N 113.684 -5.635 . . . . 0.0 111.718 -9.404 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -126.8 79.56 1.88 Allowed 'General case' 0 N--CA 1.491 1.592 0 O-C-N 120.78 -1.2 . . . . 0.0 107.927 -179.732 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 4' ' ' ASP . . . . . . . . . . . . . 2.2 p30 -141.25 78.54 18.75 Favored Pre-proline 0 N--CA 1.487 1.422 0 O-C-N 121.223 -0.923 . . . . 0.0 112.169 171.294 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 4.8 Cg_exo -96.84 160.51 1.1 Allowed 'Trans proline' 0 CA--C 1.553 1.461 0 C-N-CA 121.955 1.77 . . . . 0.0 113.123 -160.01 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 6' ' ' HIS . . . . . . . . . . . . . 76.3 m80 -76.7 141.14 41.02 Favored 'General case' 0 CA--C 1.56 1.347 0 CA-C-N 113.517 -1.674 . . . . 0.0 113.184 -178.157 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 7' ' ' PHE . . . . . 0.733 ' CZ ' HD12 ' A' ' 34' ' ' LEU 0.266 27.7 p90 -121.29 167.54 12.62 Favored 'General case' 0 CA--C 1.564 1.497 0 O-C-N 119.838 -1.789 . . . . 0.0 110.285 116.972 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 8' ' ' ASN . . . . . . . . . . . . . 16.7 m120 -84.39 94.01 8.4 Favored 'General case' 0 N--CA 1.486 1.354 0 O-C-N 119.479 -2.013 . . . . 0.0 108.062 164.211 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 9' ' ' PHE . . . . . 0.642 ' CD2' HD13 ' A' ' 34' ' ' LEU . 5.7 t80 -68.41 162.73 24.79 Favored 'General case' 0 CA--C 1.557 1.229 0 CA-C-O 124.486 2.089 . . . . 0.0 110.824 158.957 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 10' ' ' ARG . . . . . . . . . . . . . 28.1 tpt85 177.08 97.93 0.01 OUTLIER 'General case' 0 N--CA 1.486 1.374 0 CA-C-N 113.385 -1.734 . . . . 0.0 106.713 -126.463 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 11' ' ' MET . . . . . 0.517 ' SD ' ' CD2' ' B' ' 9' ' ' PHE . 0.7 OUTLIER -122.64 120.51 27.81 Favored Pre-proline 0 CA--C 1.563 1.47 0 CA-C-O 117.049 -1.453 . . . . 0.0 110.864 -161.269 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 12' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_exo -44.91 149.78 1.08 Allowed 'Trans proline' 0 CA--C 1.566 2.123 0 CA-C-N 123.702 2.358 . . . . 0.0 116.051 159.942 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 13' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -54.14 -41.96 68.98 Favored 'General case' 0 N--CA 1.498 1.964 0 N-CA-C 117.374 2.361 . . . . 0.0 117.374 -157.501 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 9.1 pt-20 -63.46 -39.26 93.99 Favored 'General case' 0 CA--C 1.564 1.508 0 N-CA-C 116.54 2.052 . . . . 0.0 116.54 168.747 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 15' ' ' VAL . . . . . 0.437 ' CG1' HG12 ' A' ' 38' ' ' VAL . 0.8 OUTLIER -61.16 -46.38 96.75 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.091 0 CA-C-N 123.04 2.655 . . . . 0.0 113.421 172.259 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 2.1 ttt180 -74.7 -39.99 61.62 Favored 'General case' 0 C--O 1.218 -0.592 0 CA-C-O 116.353 -1.784 . . . . 0.0 115.027 174.419 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 17' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -58.91 -38.13 78.21 Favored 'General case' 0 CA--C 1.566 1.585 0 CA-C-N 123.386 2.812 . . . . 0.0 114.371 163.604 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 18' ' ' LYS . . . . . 0.433 ' HB2' HD13 ' A' ' 42' ' ' LEU 0.309 50.5 mtmt -67.93 -50.04 58.37 Favored 'General case' 0 CA--C 1.566 1.591 0 CA-C-N 121.6 2.0 . . . . 0.0 115.227 170.347 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 19' ' ' LEU . . . . . 0.639 ' HG ' ' SD ' ' B' ' 30' ' ' MET 0.322 13.3 tp -67.82 -37.77 82.39 Favored 'General case' 0 CA--C 1.574 1.872 0 CA-C-N 121.024 1.738 . . . . 0.0 114.336 174.458 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 20' ' ' LYS . . . . . . . . . . . . . 29.2 ttpt -88.5 -27.02 21.74 Favored 'General case' 0 CA--C 1.566 1.595 0 O-C-N 120.466 -1.396 . . . . 0.0 113.996 -179.988 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 19.9 m-30 -62.59 -70.5 0.2 Allowed 'General case' 0 N--CA 1.493 1.684 0 CA-C-O 113.607 -3.092 . . . . 0.0 110.27 155.326 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . 0.288 53.5 ttt180 -20.5 -53.07 0.01 OUTLIER 'General case' 0 CA--C 1.593 2.624 0 CA-C-N 125.751 3.887 . . . . 0.0 116.882 165.016 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 23' ' ' ALA . . . . . 0.491 ' HB2' ' CB ' ' B' ' 33' ' ' GLU . . . -54.22 -75.74 0.03 OUTLIER 'General case' 0 CA--C 1.589 2.475 0 N-CA-C 119.06 2.985 . . . . 0.0 119.06 157.091 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 -68.95 -39.13 79.69 Favored 'General case' 0 N--CA 1.502 2.137 0 N-CA-C 118.897 2.925 . . . . 0.0 118.897 -179.55 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 25' ' ' ALA . . . . . . . . . . . . . . . -38.97 -48.96 1.66 Allowed 'General case' 0 CA--C 1.581 2.137 0 N-CA-C 116.92 2.193 . . . . 0.0 116.92 156.08 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 26' ' ' ASN . . . . . . . . . . . . 0.299 0.0 OUTLIER -112.19 -47.8 3.08 Favored 'General case' 0 CA--C 1.578 2.047 0 N-CA-C 115.066 1.506 . . . . 0.0 115.066 -163.036 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 27' ' ' GLY . . . . . . . . . . . . . . . 148.66 44.65 0.03 OUTLIER Glycine 0 N--CA 1.5 2.926 0 N-CA-C 118.189 2.036 . . . . 0.0 118.189 176.472 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 28' ' ' ARG . . . . . 0.429 ' HE ' ' HG2' ' B' ' 33' ' ' GLU 0.334 1.1 ptt180 -156.92 153.44 28.12 Favored 'General case' 0 N--CA 1.495 1.797 0 N-CA-C 105.586 -2.005 . . . . 0.0 105.586 -173.115 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 29' ' ' SER . . . . . . . . . . . . . 75.1 p -119.77 110.5 16.86 Favored 'General case' 0 N--CA 1.502 2.126 0 O-C-N 118.312 -2.743 . . . . 0.0 105.638 -168.547 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 30' ' ' MET . . . . . 0.639 ' SD ' ' HG ' ' B' ' 19' ' ' LEU . 0.0 OUTLIER -39.85 -43.96 1.55 Allowed 'General case' 0 N--CA 1.493 1.703 0 N-CA-C 120.651 3.574 . . . . 0.0 120.651 -143.557 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 31' ' ' ASN . . . . . 0.405 ' O ' ' HB2' ' B' ' 35' ' ' LEU . 12.1 t-20 -44.4 -45.77 9.13 Favored 'General case' 0 CA--C 1.594 2.639 0 CA-C-N 124.029 3.104 . . . . 0.0 114.699 164.42 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 32' ' ' SER . . . . . . . . . . . . 0.326 30.9 t -50.61 -68.54 0.16 Allowed 'General case' 0 N--CA 1.5 2.044 0 N-CA-C 119.591 3.182 . . . . 0.0 119.591 144.561 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 33' ' ' GLU . . . . . 0.491 ' CB ' ' HB2' ' B' ' 23' ' ' ALA . 10.5 tm-20 -60.93 -58.44 8.41 Favored 'General case' 0 N--CA 1.515 2.793 0 N-CA-C 118.508 2.781 . . . . 0.0 118.508 -177.186 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 34' ' ' LEU . . . . . 0.781 HD12 ' CZ ' ' A' ' 7' ' ' PHE . 0.1 OUTLIER -39.91 -54.16 2.22 Favored 'General case' 0 CA--C 1.563 1.448 0 CA-C-O 116.46 -1.733 . . . . 0.0 107.305 166.2 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 35' ' ' LEU . . . . . 0.484 ' HG ' ' CE1' ' A' ' 9' ' ' PHE . 9.3 mt -63.26 -61.79 2.12 Favored 'General case' 0 C--N 1.371 1.53 0 CA-C-N 123.563 2.892 . . . . 0.0 115.977 -174.627 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 36' ' ' GLN . . . . . . . . . . . . 0.489 0.0 OUTLIER -60.76 -25.08 66.23 Favored 'General case' 0 CA--C 1.571 1.757 0 N-CA-C 115.352 1.612 . . . . 0.0 115.352 177.917 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 37' ' ' ILE . . . . . . . . . . . . . 1.9 tp -77.62 -32.57 18.34 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.788 0 CA-C-N 121.788 2.085 . . . . 0.0 116.24 163.833 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 38' ' ' VAL . . . . . 0.623 HG21 HD22 ' B' ' 34' ' ' LEU . 4.3 t -74.38 -50.38 27.45 Favored 'Isoleucine or valine' 0 CA--C 1.572 1.79 0 C-N-CA 127.942 2.497 . . . . 0.0 110.94 178.494 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 30.2 mt-30 -40.1 -49.23 2.57 Favored 'General case' 0 CA--C 1.567 1.601 0 N-CA-C 114.97 1.47 . . . . 0.0 114.97 149.798 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 40' ' ' ASP . . . . . . . . . . . . 0.339 1.5 t0 -57.45 -38.63 74.77 Favored 'General case' 0 CA--C 1.572 1.815 0 N-CA-C 118.241 2.682 . . . . 0.0 118.241 160.903 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 41' ' ' ALA . . . . . 0.555 ' HB3' ' HA ' ' B' ' 38' ' ' VAL . . . -72.99 -34.63 66.54 Favored 'General case' 0 CA--C 1.564 1.515 0 N-CA-C 116.914 2.19 . . . . 0.0 116.914 -176.83 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 42' ' ' LEU . . . . . 0.425 HD11 ' HB2' ' A' ' 19' ' ' LEU . 12.8 mt -89.94 -46.97 8.16 Favored 'General case' 0 CA--C 1.56 1.334 0 C-N-CA 126.086 1.754 . . . . 0.0 113.185 176.776 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 43' ' ' SER . . . . . . . . . . . . . 8.6 t -71.12 -35.85 71.91 Favored 'General case' 0 N--CA 1.494 1.733 0 N-CA-C 116.24 1.941 . . . . 0.0 116.24 175.151 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 44' ' ' LYS . . . . . . . . . . . . 0.504 37.8 mtmm 63.46 -128.72 0.0 OUTLIER Pre-proline 0 CA--C 1.594 2.643 0 CA-C-O 114.013 -2.898 . . . . 0.0 113.406 176.844 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 76.7 Cg_endo -86.31 111.59 1.06 Allowed 'Trans proline' 0 CA--C 1.568 2.221 1 CA-C-N 128.641 4.122 . . . . 0.0 118.405 -170.155 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 46' ' ' SER . . . . . . . . . . . . . 67.5 m -75.69 124.54 88.81 Favored Pre-proline 0 CA--C 1.584 2.265 0 CA-C-O 117.225 -1.369 . . . . 0.0 110.462 131.576 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 87.8 Cg_exo -55.07 95.4 0.05 OUTLIER 'Trans proline' 0 CA--C 1.573 2.448 0 N-CA-C 119.176 2.721 . . . . 0.0 119.176 -177.333 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 48' ' ' VAL . . . . . . . . . . . . . 4.3 p -107.01 -9.43 10.66 Favored 'Isoleucine or valine' 0 N--CA 1.518 2.946 0 N-CA-C 117.772 2.508 . . . . 0.0 117.772 -176.003 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 49' ' ' THR . . . . . . . . . . . . . 3.0 t -123.25 142.75 50.6 Favored 'General case' 0 N--CA 1.494 1.752 0 N-CA-C 116.55 2.055 . . . . 0.0 116.55 -113.055 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 50' ' ' GLY . . . . . . . . . . . . . . . -106.19 31.55 8.23 Favored Glycine 0 N--CA 1.501 3.028 0 N-CA-C 118.589 2.195 . . . . 0.0 118.589 159.503 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 51' ' ' TYR . . . . . . . . . . . . 0.379 0.0 OUTLIER -164.52 -34.09 0.03 OUTLIER 'General case' 0 N--CA 1.507 2.403 0 N-CA-C 116.496 2.035 . . . . 0.0 116.496 -172.858 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 52' ' ' ARG . . . . . . . . . . . . . 1.4 tmt_? 64.53 115.83 0.02 OUTLIER 'General case' 0 N--CA 1.507 2.376 0 C-N-CA 125.934 1.693 . . . . 0.0 114.659 177.419 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 53' ' ' ASN . . . . . 0.431 ' HA ' ' HA ' ' B' ' 54' ' ' ASP 0.391 0.1 OUTLIER -63.12 115.24 4.29 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 119.356 -2.09 . . . . 0.0 109.669 173.251 . . . . . . . . 4 4 . 1 . 002 nuclear build full ' B' B ' 54' ' ' ASP . . . . . 0.491 ' C ' ' H ' ' B' ' 57' ' ' ARG 1.631 0.6 OUTLIER 47.95 13.52 0.04 OUTLIER 'General case' 0 CA--C 1.597 2.769 2 O-C-N 114.553 -5.092 . . . . 0.0 123.969 14.226 . . . . . . . . 5 4 . 1 . 002 nuclear build full ' B' B ' 55' ' ' ALA . . . . . 0.463 ' CB ' ' HB2' ' A' ' 55' ' ' ALA 0.278 . . -126.06 -0.58 7.17 Favored 'General case' 0 CA--C 1.561 1.404 1 O-C-N 116.031 -4.168 . . . . 0.0 118.087 143.152 . . . . . . . . 4 3 . 1 . 002 nuclear build full ' B' B ' 56' ' ' GLU . . . . . 0.483 ' HA ' ' HB3' ' B' ' 59' ' ' ALA 0.29 9.5 tp10 -16.66 -30.12 0.0 OUTLIER 'General case' 0 CA--C 1.614 3.404 1 N-CA-C 125.705 5.446 . . . . 0.0 125.705 89.444 . . . . . . . . 4 3 . 1 . 002 nuclear build full ' B' B ' 57' ' ' ARG . . . . . 0.491 ' H ' ' C ' ' B' ' 54' ' ' ASP . 2.1 ttp180 -77.65 -57.87 3.58 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 118.255 -2.778 . . . . 0.0 112.81 158.241 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 58' ' ' LEU . . . . . 0.441 HD13 ' H ' ' B' ' 58' ' ' LEU 0.536 0.0 OUTLIER -63.37 -28.62 70.12 Favored 'General case' 0 N--CA 1.506 2.355 0 CA-C-N 121.372 1.896 . . . . 0.0 115.975 175.782 . . . . . . . . 4 4 . 1 . 002 nuclear build full ' B' B ' 59' ' ' ALA . . . . . 0.483 ' HB3' ' HA ' ' B' ' 56' ' ' GLU . . . -37.57 -60.09 0.73 Allowed 'General case' 0 N--CA 1.49 1.556 0 N-CA-C 117.762 2.504 . . . . 0.0 117.762 144.286 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -78.99 3.88 15.93 Favored 'General case' 0 CA--C 1.555 1.172 0 N-CA-C 116.849 2.166 . . . . 0.0 116.849 172.119 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 38.4 tt0 -65.01 -75.99 0.08 Allowed 'General case' 0 N--CA 1.477 0.905 0 CA-C-O 116.216 -1.849 . . . . 0.0 109.009 153.143 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 62' ' ' GLN . . . . . 0.6 ' O ' HG13 ' B' ' 66' ' ' VAL 0.368 4.2 mm-40 -69.08 -55.73 9.86 Favored 'General case' 0 N--CA 1.482 1.173 0 CA-C-N 122.6 2.455 . . . . 0.0 113.177 -176.848 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 63' ' ' SER . . . . . . . . . . . . 0.349 48.2 t -86.01 41.28 0.91 Allowed 'General case' 0 CA--C 1.571 1.754 0 N-CA-C 118.25 2.685 . . . . 0.0 118.25 171.474 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 64' ' ' GLU . . . . . . . . . . . . . 27.4 tt0 -97.44 -45.03 6.6 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 119.457 -2.027 . . . . 0.0 111.676 121.565 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 13.9 mt -64.05 -24.67 67.79 Favored 'General case' 0 CA--C 1.579 2.083 0 N-CA-C 117.008 2.225 . . . . 0.0 117.008 -178.498 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 66' ' ' VAL . . . . . 0.6 HG13 ' O ' ' B' ' 62' ' ' GLN . 1.5 m . . . . . 0 N--CA 1.505 2.317 0 N-CA-C 116.764 2.135 . . . . 0.0 116.764 174.766 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.566 1.564 0 N-CA-C 115.767 1.766 . . . . 0.0 115.767 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' ARG . . . . . 0.417 ' O ' ' SD ' ' B' ' 13' ' ' MET 0.352 55.4 ptt85 46.17 41.72 9.01 Favored 'General case' 0 N--CA 1.503 2.201 0 N-CA-C 120.324 3.453 . . . . 0.0 120.324 -177.897 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 3.8 p-10 -117.8 133.31 56.07 Favored 'General case' 0 CA--C 1.554 1.103 0 N-CA-C 104.622 -2.362 . . . . 0.0 104.622 169.371 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 21.7 p-10 -153.8 94.51 2.91 Favored Pre-proline 0 CA--C 1.572 1.823 1 O-C-N 113.459 -5.775 . . . . 0.0 111.241 39.967 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 23.6 Cg_exo -84.03 154.75 13.0 Favored 'Trans proline' 0 CA--C 1.557 1.633 0 CA-C-N 122.4 1.893 . . . . 0.0 116.374 -159.661 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 77.1 m80 -86.37 137.08 32.85 Favored 'General case' 0 CA--C 1.561 1.386 0 CA-C-N 114.04 -1.436 . . . . 0.0 113.568 -175.138 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' PHE . . . . . 0.711 ' CZ ' HD12 ' B' ' 34' ' ' LEU . 1.6 p90 -139.28 140.45 37.65 Favored 'General case' 0 N--CA 1.485 1.293 0 O-C-N 120.751 -1.218 . . . . 0.0 108.409 137.583 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 39.9 m-20 -73.92 100.86 3.63 Favored 'General case' 0 CA--C 1.563 1.458 0 O-C-N 120.434 -1.416 . . . . 0.0 111.469 -178.424 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' PHE . . . . . 0.69 ' HD2' HD11 ' A' ' 34' ' ' LEU . 5.3 t80 -79.65 77.0 6.28 Favored 'General case' 0 CA--C 1.576 1.953 0 CA-C-O 127.683 3.611 . . . . 0.0 111.216 169.593 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . 0.283 28.8 ptt180 -47.04 138.65 6.43 Favored 'General case' 0 N--CA 1.478 0.936 0 CA-C-N 109.577 -3.465 . . . . 0.0 118.011 130.238 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 11' ' ' MET . . . . . 0.439 ' HB2' ' HB2' ' A' ' 16' ' ' ARG . 9.1 mtt -147.75 138.07 12.7 Favored Pre-proline 0 CA--C 1.572 1.791 0 CA-C-N 112.928 -1.942 . . . . 0.0 110.204 -176.326 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 87.1 Cg_exo -41.46 142.61 1.08 Allowed 'Trans proline' 0 C--N 1.375 1.944 0 C-N-CA 123.627 2.885 . . . . 0.0 116.497 167.588 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 1.7 tpt -44.3 -38.03 3.64 Favored 'General case' 0 CA--C 1.569 1.711 0 N-CA-C 119.675 3.213 . . . . 0.0 119.675 -167.001 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -61.96 -47.13 86.25 Favored 'General case' 0 N--CA 1.486 1.342 0 N-CA-C 117.548 2.425 . . . . 0.0 117.548 167.734 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.459 HG21 HD22 ' B' ' 35' ' ' LEU . 0.1 OUTLIER -67.37 -42.44 87.43 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.911 0 CA-C-N 122.949 2.613 . . . . 0.0 112.509 173.262 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 16' ' ' ARG . . . . . 0.439 ' HB2' ' HB2' ' A' ' 11' ' ' MET 0.318 0.0 OUTLIER -79.15 -29.24 42.95 Favored 'General case' 0 N--CA 1.486 1.329 0 CA-C-N 123.078 2.672 . . . . 0.0 116.313 176.083 . . . . . . . . 4 4 . 1 . 003 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -67.42 -44.76 77.98 Favored 'General case' 0 N--CA 1.49 1.533 0 CA-C-N 123.38 2.809 . . . . 0.0 113.254 156.926 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . 0.552 8.8 pttt -74.02 -31.73 63.05 Favored 'General case' 0 N--CA 1.484 1.25 0 N-CA-C 116.643 2.09 . . . . 0.0 116.643 179.366 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.507 ' HB3' ' CE ' ' A' ' 30' ' ' MET 0.294 0.9 OUTLIER -69.07 -43.79 73.87 Favored 'General case' 0 N--CA 1.492 1.634 0 CA-C-N 122.764 2.529 . . . . 0.0 113.624 162.004 . . . . . . . . 4 4 . 1 . 003 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 1.5 ttpt -77.38 -38.92 49.01 Favored 'General case' 0 CA--C 1.562 1.428 0 N-CA-C 115.158 1.54 . . . . 0.0 115.158 -177.919 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 29.4 m-85 -55.86 -77.71 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.573 0 CA-C-O 113.408 -3.187 . . . . 0.0 110.832 154.557 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.441 HH21 HD13 ' B' ' 58' ' ' LEU 0.331 0.0 OUTLIER -28.72 -48.73 0.06 Allowed 'General case' 0 CA--C 1.589 2.463 1 CA-C-N 126.117 4.053 . . . . 0.0 117.113 176.053 . . . . . . . . 5 4 . 1 . 003 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.48 ' HB2' ' HB3' ' A' ' 33' ' ' GLU . . . -47.54 -77.65 0.02 OUTLIER 'General case' 0 CA--C 1.586 2.334 0 N-CA-C 120.54 3.533 . . . . 0.0 120.54 152.254 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 54.2 mm-40 -64.58 -40.26 95.23 Favored 'General case' 0 N--CA 1.499 2.005 0 N-CA-C 118.603 2.816 . . . . 0.0 118.603 179.188 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -38.22 -48.35 1.27 Allowed 'General case' 0 CA--C 1.575 1.942 0 N-CA-C 117.961 2.578 . . . . 0.0 117.961 154.628 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . 0.259 0.0 OUTLIER -105.6 -42.86 5.08 Favored 'General case' 0 CA--C 1.575 1.92 0 N-CA-C 116.38 1.993 . . . . 0.0 116.38 -167.177 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 130.95 16.56 1.58 Allowed Glycine 0 N--CA 1.497 2.705 0 N-CA-C 119.649 2.62 . . . . 0.0 119.649 -172.559 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.566 ' HE ' ' HB3' ' A' ' 36' ' ' GLN 0.288 18.3 mtm-85 -121.4 143.07 49.42 Favored 'General case' 0 N--CA 1.5 2.034 0 N-CA-C 102.688 -3.079 . . . . 0.0 102.688 166.526 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 23.2 t -115.92 112.71 22.27 Favored 'General case' 0 N--CA 1.509 2.492 0 O-C-N 116.617 -3.802 . . . . 0.0 108.818 -164.8 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' MET . . . . . 0.507 ' CE ' ' HB3' ' A' ' 19' ' ' LEU . 25.6 mtp -42.62 -45.29 4.56 Favored 'General case' 0 N--CA 1.501 2.077 0 N-CA-C 119.474 3.139 . . . . 0.0 119.474 -134.707 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 18.7 t-20 -47.15 -43.56 21.08 Favored 'General case' 0 CA--C 1.6 2.888 1 O-C-N 115.928 -4.233 . . . . 0.0 114.816 165.088 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . 0.291 13.6 t -53.18 -72.24 0.06 Allowed 'General case' 0 N--CA 1.502 2.161 0 N-CA-C 117.306 2.336 . . . . 0.0 117.306 143.384 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 33' ' ' GLU . . . . . 0.48 ' HB3' ' HB2' ' A' ' 23' ' ' ALA . 4.5 tm-20 -68.41 -45.62 72.13 Favored 'General case' 0 N--CA 1.504 2.256 0 CA-C-N 124.471 3.305 . . . . 0.0 119.338 -171.994 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.846 HD12 ' CZ ' ' B' ' 7' ' ' PHE . 0.1 OUTLIER -41.43 -55.99 2.64 Favored 'General case' 0 CA--C 1.557 1.245 0 CA-C-O 114.866 -2.492 . . . . 0.0 108.39 156.762 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 11.8 mt -62.21 -45.94 91.11 Favored 'General case' 0 N--CA 1.493 1.706 0 CA-C-N 125.7 3.864 . . . . 0.0 116.762 177.493 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' GLN . . . . . 0.566 ' HB3' ' HE ' ' A' ' 28' ' ' ARG . 0.1 OUTLIER -70.97 -40.88 71.69 Favored 'General case' 0 N--CA 1.483 1.184 0 CA-C-O 116.705 -1.617 . . . . 0.0 113.48 178.955 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 37' ' ' ILE . . . . . 0.458 ' O ' ' HB2' ' A' ' 41' ' ' ALA . 1.3 tt -61.67 -31.7 51.58 Favored 'Isoleucine or valine' 0 C--O 1.199 -1.593 0 CA-C-O 114.329 -2.748 . . . . 0.0 115.178 160.474 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.457 HG21 HD22 ' A' ' 34' ' ' LEU . 2.6 t -84.38 -51.84 13.4 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.096 0 CA-C-N 123.698 2.954 . . . . 0.0 110.884 -173.57 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 33.9 mt-30 -48.76 -41.57 32.76 Favored 'General case' 0 CA--C 1.568 1.643 0 C-N-CA 124.208 1.003 . . . . 0.0 113.656 155.014 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . 0.352 17.4 t0 -50.31 -57.91 6.83 Favored 'General case' 0 N--CA 1.49 1.526 0 N-CA-C 116.916 2.191 . . . . 0.0 116.916 153.981 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 41' ' ' ALA . . . . . 0.458 ' HB2' ' O ' ' A' ' 37' ' ' ILE . . . -74.96 -33.16 61.87 Favored 'General case' 0 CA--C 1.551 0.995 0 N-CA-C 116.733 2.124 . . . . 0.0 116.733 -157.496 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 2.3 pp -96.74 -19.31 19.04 Favored 'General case' 0 CA--C 1.562 1.436 0 N-CA-C 118.5 2.778 . . . . 0.0 118.5 159.245 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 94.8 p -138.26 38.91 2.29 Favored 'General case' 0 N--CA 1.493 1.706 0 CA-C-N 122.268 2.304 . . . . 0.0 116.576 -173.842 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 69.2 mmtt -120.42 129.04 25.52 Favored Pre-proline 0 N--CA 1.502 2.158 0 CA-C-N 120.249 1.386 . . . . 0.0 112.584 159.456 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 67.3 Cg_endo -96.96 173.79 0.73 Allowed 'Trans proline' 0 CA--C 1.564 2.014 0 N-CA-C 117.482 2.07 . . . . 0.0 117.482 47.987 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . 0.292 66.1 m -112.99 -124.92 0.0 OUTLIER Pre-proline 0 CA--C 1.583 2.235 0 CA-C-O 115.941 -1.98 . . . . 0.0 107.603 154.439 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 78.0 Cg_exo -67.69 67.72 0.81 Allowed 'Trans proline' 0 CA--C 1.573 2.437 0 CA-C-N 126.502 3.358 . . . . 0.0 118.111 164.441 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 14.9 p -153.37 106.95 0.23 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.889 0 C-N-CA 123.902 0.881 . . . . 0.0 110.314 172.17 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 73.1 p -123.01 53.26 1.3 Allowed 'General case' 0 N--CA 1.507 2.387 0 CA-C-O 122.807 1.289 . . . . 0.0 113.918 173.763 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -168.93 73.81 0.13 Allowed Glycine 0 CA--C 1.555 2.545 0 CA-C-N 114.748 -1.114 . . . . 0.0 112.101 158.355 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . 0.413 0.3 OUTLIER 61.85 -162.68 0.27 Allowed 'General case' 0 CA--C 1.584 2.269 2 O-C-N 114.96 -4.847 . . . . 0.0 115.052 3.209 . . . . . . . . 4 3 . 1 . 003 nuclear build full ' A' A ' 52' ' ' ARG . . . . . 0.633 ' HE ' ' H ' ' A' ' 53' ' ' ASN 0.317 6.7 tpm_? 75.66 136.51 0.06 Allowed 'General case' 0 N--CA 1.506 2.332 0 N-CA-C 115.113 1.523 . . . . 0.0 115.113 -172.755 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 53' ' ' ASN . . . . . 0.633 ' H ' ' HE ' ' A' ' 52' ' ' ARG . 7.4 t-20 121.36 141.62 0.0 OUTLIER 'General case' 0 N--CA 1.505 2.312 0 CA-C-O 125.03 2.347 . . . . 0.0 106.423 -148.137 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 54' ' ' ASP . . . . . 0.472 ' CB ' ' HD2' ' A' ' 57' ' ' ARG 1.351 0.0 OUTLIER 57.17 19.3 4.74 Favored 'General case' 0 N--CA 1.483 1.183 1 N-CA-C 123.018 4.451 . . . . 0.0 123.018 98.336 . . . . . . . . 5 4 . 1 . 003 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . 1.291 . . -90.73 19.24 5.61 Favored 'General case' 0 CA--C 1.577 1.986 1 O-C-N 115.663 -4.398 . . . . 0.0 121.784 111.451 . . . . . . . . 3 2 . 1 . 003 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.844 ' O ' ' HB3' ' A' ' 59' ' ' ALA . 34.7 mt-10 -47.88 -19.48 0.24 Allowed 'General case' 0 CA--C 1.602 2.945 0 N-CA-C 121.118 3.747 . . . . 0.0 121.118 112.076 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.472 ' HD2' ' CB ' ' A' ' 54' ' ' ASP . 0.0 OUTLIER -98.8 -23.14 15.51 Favored 'General case' 0 N--CA 1.49 1.529 1 O-C-N 115.728 -4.358 . . . . 0.0 114.428 169.657 . . . . . . . . 4 4 . 1 . 003 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.539 ' HA ' ' H ' ' A' ' 61' ' ' GLU 0.815 0.4 OUTLIER -73.57 -0.93 16.71 Favored 'General case' 0 CA--C 1.626 3.883 0 O-C-N 118.694 -2.504 . . . . 0.0 114.75 143.791 . . . . . . . . 4 4 . 1 . 003 nuclear build full ' A' A ' 59' ' ' ALA . . . . . 0.844 ' HB3' ' O ' ' A' ' 56' ' ' GLU 0.284 . . -55.39 -36.16 66.09 Favored 'General case' 0 N--CA 1.517 2.878 1 O-C-N 114.656 -5.028 . . . . 0.0 117.229 136.054 . . . . . . . . 4 3 . 1 . 003 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -66.14 -14.57 62.04 Favored 'General case' 0 CA--C 1.58 2.099 0 N-CA-C 118.164 2.653 . . . . 0.0 118.164 159.276 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.539 ' H ' ' HA ' ' A' ' 58' ' ' LEU 0.436 0.0 OUTLIER -52.6 -52.26 56.12 Favored 'General case' 0 N--CA 1.513 2.693 0 O-C-N 119.296 -2.127 . . . . 0.0 112.457 145.586 . . . . . . . . 4 4 . 1 . 003 nuclear build full ' A' A ' 62' ' ' GLN . . . . . 0.581 ' O ' HG13 ' A' ' 66' ' ' VAL 0.373 3.0 tp60 -55.19 -37.97 67.76 Favored 'General case' 0 CA--C 1.586 2.353 0 CA-C-O 114.586 -2.626 . . . . 0.0 116.968 162.925 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 26.3 m -36.56 -50.51 0.8 Allowed 'General case' 0 N--CA 1.53 3.535 1 CA-C-N 126.117 4.053 . . . . 0.0 115.91 159.278 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . 0.45 1.0 OUTLIER -91.86 12.64 20.87 Favored 'General case' 0 CA--C 1.573 1.841 0 N-CA-C 115.769 1.766 . . . . 0.0 115.769 179.94 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.432 HD13 ' O ' ' A' ' 61' ' ' GLU . 5.0 mp -91.98 -52.06 4.9 Favored 'General case' 0 CA--C 1.588 2.41 0 C-N-CA 126.285 1.834 . . . . 0.0 114.278 141.118 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.581 HG13 ' O ' ' A' ' 62' ' ' GLN 0.338 34.4 m . . . . . 0 N--CA 1.517 2.878 0 N-CA-C 120.615 3.561 . . . . 0.0 120.615 -149.412 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.559 1.307 0 CA-C-O 121.96 0.885 . . . . 0.0 113.301 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 2' ' ' ARG . . . . . . . . . . . . . 8.6 ptm180 -87.22 91.7 8.81 Favored 'General case' 0 CA--C 1.564 1.496 0 CA-C-O 121.745 0.783 . . . . 0.0 112.737 174.114 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 28.0 m-20 -131.18 -0.69 4.08 Favored 'General case' 0 CA--C 1.57 1.734 0 N-CA-C 115.523 1.675 . . . . 0.0 115.523 164.754 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 4' ' ' ASP . . . . . . . . . . . . 0.251 8.3 p-10 -136.73 71.21 57.98 Favored Pre-proline 0 CA--C 1.573 1.85 0 O-C-N 119.871 -1.768 . . . . 0.0 111.903 139.484 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 90.0 Cg_endo -66.54 152.51 80.62 Favored 'Trans proline' 0 CA--C 1.557 1.636 0 C-N-CA 123.424 2.749 . . . . 0.0 115.945 174.38 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 6' ' ' HIS . . . . . . . . . . . . . 54.9 m80 -75.19 154.21 37.75 Favored 'General case' 0 CA--C 1.557 1.231 0 CA-C-N 113.8 -1.546 . . . . 0.0 114.597 174.656 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 7' ' ' PHE . . . . . 0.846 ' CZ ' HD12 ' A' ' 34' ' ' LEU . 17.8 p90 -131.19 162.66 29.45 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 120.197 -1.564 . . . . 0.0 112.395 120.026 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 8' ' ' ASN . . . . . . . . . . . . . 6.1 p-10 -61.73 92.47 0.04 OUTLIER 'General case' 0 CA--C 1.567 1.628 0 N-CA-C 114.422 1.267 . . . . 0.0 114.422 165.403 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 9' ' ' PHE . . . . . 0.65 ' CD2' HD13 ' A' ' 34' ' ' LEU 0.263 0.8 OUTLIER -79.53 164.77 23.62 Favored 'General case' 0 CA--C 1.563 1.476 0 CA-C-O 125.543 2.592 . . . . 0.0 109.511 153.905 . . . . . . . . 4 4 . 1 . 003 nuclear build full ' B' B ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 162.63 103.33 0.0 OUTLIER 'General case' 0 C--N 1.308 -1.231 0 CA-C-N 111.819 -2.446 . . . . 0.0 104.658 -123.846 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 11' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -139.96 128.75 13.37 Favored Pre-proline 0 CA--C 1.567 1.631 0 CA-C-O 117.669 -1.158 . . . . 0.0 110.88 -158.883 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 12' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -59.46 153.42 54.52 Favored 'Trans proline' 0 CA--C 1.562 1.905 0 CA-C-N 123.779 2.385 . . . . 0.0 114.116 169.445 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 13' ' ' MET . . . . . 0.417 ' SD ' ' O ' ' A' ' 2' ' ' ARG . 0.0 OUTLIER -57.84 -36.55 72.44 Favored 'General case' 0 N--CA 1.495 1.821 0 N-CA-C 117.026 2.232 . . . . 0.0 117.026 -155.03 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -60.13 -44.23 95.07 Favored 'General case' 0 CA--C 1.563 1.458 0 N-CA-C 117.146 2.276 . . . . 0.0 117.146 165.705 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 15' ' ' VAL . . . . . 0.406 ' CG1' HG12 ' A' ' 38' ' ' VAL . 0.3 OUTLIER -63.06 -46.33 96.46 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.131 0 CA-C-N 123.57 2.896 . . . . 0.0 112.612 172.921 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 16' ' ' ARG . . . . . . . . . . . . 0.255 0.0 OUTLIER -76.63 -27.87 55.87 Favored 'General case' 0 N--CA 1.479 1.009 0 N-CA-C 116.261 1.949 . . . . 0.0 116.261 177.297 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 17' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -67.44 -44.46 78.65 Favored 'General case' 0 N--CA 1.49 1.573 0 CA-C-N 122.833 2.56 . . . . 0.0 113.699 156.925 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 55.4 mtmt -58.5 -54.89 41.9 Favored 'General case' 0 N--CA 1.49 1.561 0 CA-C-N 122.378 2.354 . . . . 0.0 114.93 171.316 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 19' ' ' LEU . . . . . 0.496 HD21 ' HG ' ' B' ' 34' ' ' LEU . 12.9 tp -63.57 -35.63 81.13 Favored 'General case' 0 CA--C 1.562 1.44 0 N-CA-C 115.124 1.527 . . . . 0.0 115.124 176.453 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 20' ' ' LYS . . . . . 0.444 ' HA ' ' HB3' ' B' ' 23' ' ' ALA . 11.8 ttpt -87.82 -23.0 24.17 Favored 'General case' 0 CA--C 1.572 1.803 0 N-CA-C 114.314 1.228 . . . . 0.0 114.314 176.185 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 21' ' ' PHE . . . . . 0.41 ' O ' ' HB3' ' B' ' 25' ' ' ALA . 11.2 m-85 -64.53 -71.71 0.17 Allowed 'General case' 0 N--CA 1.491 1.62 0 CA-C-O 115.167 -2.349 . . . . 0.0 110.635 154.678 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . 0.369 0.0 OUTLIER -18.58 -52.28 0.01 OUTLIER 'General case' 0 CA--C 1.597 2.754 0 CA-C-N 124.616 3.371 . . . . 0.0 115.106 159.794 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 23' ' ' ALA . . . . . 0.444 ' HB3' ' HA ' ' B' ' 20' ' ' LYS 0.331 . . -55.67 -77.96 0.02 OUTLIER 'General case' 0 CA--C 1.586 2.338 0 N-CA-C 120.202 3.408 . . . . 0.0 120.202 154.182 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 12.6 mm-40 -68.93 -36.59 78.16 Favored 'General case' 0 N--CA 1.502 2.16 0 N-CA-C 119.323 3.083 . . . . 0.0 119.323 -178.719 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 25' ' ' ALA . . . . . 0.41 ' HB3' ' O ' ' B' ' 21' ' ' PHE . . . -42.79 -49.82 5.69 Favored 'General case' 0 CA--C 1.58 2.127 0 N-CA-C 116.496 2.036 . . . . 0.0 116.496 154.413 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 26' ' ' ASN . . . . . . . . . . . . . 6.8 m-20 -82.23 -54.61 5.11 Favored 'General case' 0 CA--C 1.572 1.789 0 N-CA-C 114.275 1.213 . . . . 0.0 114.275 179.131 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 27' ' ' GLY . . . . . . . . . . . . . . . 116.67 23.94 3.86 Favored Glycine 0 N--CA 1.498 2.793 0 N-CA-C 117.835 1.894 . . . . 0.0 117.835 -152.661 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 28' ' ' ARG . . . . . . . . . . . . 0.291 81.7 mtm180 -119.09 155.61 31.22 Favored 'General case' 0 CA--C 1.58 2.106 0 N-CA-C 103.738 -2.69 . . . . 0.0 103.738 170.927 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 29' ' ' SER . . . . . . . . . . . . . 87.5 p -122.98 108.13 12.59 Favored 'General case' 0 N--CA 1.507 2.387 0 O-C-N 116.852 -3.655 . . . . 0.0 107.576 -166.47 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 30' ' ' MET . . . . . . . . . . . . . 23.4 mtp -40.6 -45.93 2.43 Favored 'General case' 0 N--CA 1.5 2.033 0 N-CA-C 119.15 3.019 . . . . 0.0 119.15 -137.592 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 31' ' ' ASN . . . . . . . . . . . . 0.286 0.1 OUTLIER -48.56 -43.65 35.85 Favored 'General case' 0 CA--C 1.601 2.926 0 CA-C-N 125.178 3.626 . . . . 0.0 114.707 167.08 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 32' ' ' SER . . . . . . . . . . . . 0.296 70.0 m -53.04 -63.19 1.23 Allowed 'General case' 0 N--CA 1.508 2.473 0 N-CA-C 119.902 3.297 . . . . 0.0 119.902 145.527 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 33' ' ' GLU . . . . . 0.441 ' HB3' ' HB2' ' B' ' 23' ' ' ALA . 8.5 tm-20 -70.28 -54.76 11.31 Favored 'General case' 0 N--CA 1.504 2.234 0 CA-C-N 123.668 2.94 . . . . 0.0 118.901 -178.707 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 34' ' ' LEU . . . . . 0.711 HD12 ' CZ ' ' A' ' 7' ' ' PHE . 0.1 OUTLIER -36.39 -52.23 0.83 Allowed 'General case' 0 CA--C 1.554 1.111 0 CA-C-O 115.829 -2.034 . . . . 0.0 108.74 161.119 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 35' ' ' LEU . . . . . 0.459 HD22 HG21 ' A' ' 15' ' ' VAL . 19.7 mt -62.67 -47.64 82.78 Favored 'General case' 0 C--N 1.369 1.416 0 CA-C-N 123.689 2.949 . . . . 0.0 116.351 174.075 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 36' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -69.07 -31.42 70.16 Favored 'General case' 0 N--CA 1.49 1.557 0 N-CA-C 116.305 1.965 . . . . 0.0 116.305 179.491 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 37' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -73.38 -34.53 43.56 Favored 'Isoleucine or valine' 0 C--O 1.2 -1.519 0 CA-C-O 114.978 -2.439 . . . . 0.0 113.908 159.526 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 38' ' ' VAL . . . . . 0.402 ' HA ' ' HB3' ' B' ' 41' ' ' ALA . 2.6 t -76.05 -49.31 26.02 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.314 0 CA-C-N 123.969 3.077 . . . . 0.0 112.448 -176.639 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 31.5 mt-30 -55.06 -38.76 68.44 Favored 'General case' 0 CA--C 1.57 1.749 0 CA-C-O 117.631 -1.176 . . . . 0.0 112.908 156.43 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 40' ' ' ASP . . . . . . . . . . . . 0.42 7.1 t0 -52.41 -45.32 65.85 Favored 'General case' 0 N--CA 1.504 2.255 0 N-CA-C 116.737 2.125 . . . . 0.0 116.737 154.485 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 41' ' ' ALA . . . . . 0.402 ' HB3' ' HA ' ' B' ' 38' ' ' VAL 0.296 . . -84.16 -53.78 5.28 Favored 'General case' 0 CA--C 1.553 1.068 0 N-CA-C 115.807 1.78 . . . . 0.0 115.807 -161.136 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . 0.316 1.5 pp -82.48 -24.4 34.21 Favored 'General case' 0 N--CA 1.494 1.754 0 N-CA-C 117.286 2.328 . . . . 0.0 117.286 160.951 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 43' ' ' SER . . . . . . . . . . . . . 25.1 t -110.92 12.69 22.2 Favored 'General case' 0 N--CA 1.494 1.77 0 CA-C-N 122.875 2.579 . . . . 0.0 116.541 -178.893 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 44' ' ' LYS . . . . . . . . . . . . 0.434 26.4 mtmm 71.07 -99.04 0.0 OUTLIER Pre-proline 0 CA--C 1.579 2.093 0 CA-C-N 121.754 2.07 . . . . 0.0 111.426 167.51 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 71.4 Cg_endo -82.27 108.3 1.75 Allowed 'Trans proline' 0 CA--C 1.569 2.226 0 CA-C-N 126.145 3.23 . . . . 0.0 115.686 165.281 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 46' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -80.6 -158.93 0.01 OUTLIER Pre-proline 0 CA--C 1.592 2.579 0 O-C-N 121.238 -0.913 . . . . 0.0 110.949 145.27 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -64.54 83.18 0.16 Allowed 'Trans proline' 0 CA--C 1.569 2.259 0 CA-C-N 124.228 2.546 . . . . 0.0 114.182 159.553 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 48' ' ' VAL . . . . . . . . . . . . 0.288 29.8 m -130.76 -38.48 0.61 Allowed 'Isoleucine or valine' 0 N--CA 1.499 2.011 0 N-CA-C 117.516 2.413 . . . . 0.0 117.516 -169.239 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 49' ' ' THR . . . . . . . . . . . . . 6.9 m -130.97 131.52 44.46 Favored 'General case' 0 CA--C 1.578 2.049 2 O-C-N 111.806 -6.809 . . . . 0.0 112.237 2.366 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 50' ' ' GLY . . . . . . . . . . . . . . . 72.33 69.4 1.4 Allowed Glycine 0 N--CA 1.505 3.253 0 N-CA-C 118.593 2.197 . . . . 0.0 118.593 165.515 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 51' ' ' TYR . . . . . . . . . . . . 0.273 0.5 OUTLIER -144.46 -57.54 0.36 Allowed 'General case' 0 CA--C 1.578 2.023 0 N-CA-C 117.075 2.25 . . . . 0.0 117.075 -143.169 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 52' ' ' ARG . . . . . . . . . . . . 0.484 12.5 ttt180 110.2 -155.52 0.0 OUTLIER 'General case' 0 N--CA 1.534 3.731 0 N-CA-C 117.963 2.579 . . . . 0.0 117.963 -178.529 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 53' ' ' ASN . . . . . 0.438 ' HB2' ' O ' ' A' ' 54' ' ' ASP . 10.5 t-20 60.94 160.18 0.05 Allowed 'General case' 0 N--CA 1.518 2.93 0 O-C-N 118.73 -2.481 . . . . 0.0 114.338 -163.901 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 54' ' ' ASP . . . . . 0.42 ' HA ' ' CG ' ' B' ' 53' ' ' ASN . 37.9 m-20 -74.89 95.06 2.89 Favored 'General case' 0 N--CA 1.477 0.923 2 O-C-N 110.787 -7.446 . . . . 0.0 109.737 -14.845 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 55' ' ' ALA . . . . . . . . . . . . . . . -94.94 -89.92 0.23 Allowed 'General case' 0 CA--C 1.566 1.575 0 CA-C-O 122.619 1.2 . . . . 0.0 113.322 -157.923 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 56' ' ' GLU . . . . . 0.802 ' O ' ' HB3' ' B' ' 59' ' ' ALA . 18.4 tt0 3.43 -60.37 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.913 0 N-CA-C 121.449 3.87 . . . . 0.0 121.449 110.631 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 57' ' ' ARG . . . . . . . . . . . . 0.526 23.0 ttm-85 -84.1 -27.84 27.93 Favored 'General case' 0 CA--C 1.574 1.896 0 O-C-N 120.039 -1.663 . . . . 0.0 112.621 -169.255 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 58' ' ' LEU . . . . . 0.658 ' HA ' ' H ' ' B' ' 61' ' ' GLU 0.601 34.5 mt -84.98 1.01 49.4 Favored 'General case' 0 CA--C 1.6 2.868 0 O-C-N 118.122 -2.861 . . . . 0.0 115.133 156.638 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 59' ' ' ALA . . . . . 0.802 ' HB3' ' O ' ' B' ' 56' ' ' GLU . . . -56.48 -41.81 77.22 Favored 'General case' 0 N--CA 1.5 2.059 1 O-C-N 116.249 -4.032 . . . . 0.0 116.592 135.86 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -66.09 -7.11 15.64 Favored 'General case' 0 N--CA 1.507 2.384 0 N-CA-C 118.528 2.788 . . . . 0.0 118.528 156.795 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 61' ' ' GLU . . . . . 0.658 ' H ' ' HA ' ' B' ' 58' ' ' LEU 0.338 0.0 OUTLIER -58.12 -52.49 65.31 Favored 'General case' 0 N--CA 1.503 2.215 0 O-C-N 118.928 -2.358 . . . . 0.0 112.306 151.809 . . . . . . . . 4 4 . 1 . 003 nuclear build full ' B' B ' 62' ' ' GLN . . . . . 0.648 ' O ' HG13 ' B' ' 66' ' ' VAL 0.264 4.4 tp60 -52.04 -47.83 64.87 Favored 'General case' 0 CA--C 1.568 1.657 0 CA-C-O 116.409 -1.758 . . . . 0.0 115.159 168.6 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 25.4 m -35.81 -56.89 0.68 Allowed 'General case' 0 N--CA 1.513 2.699 0 N-CA-C 119.261 3.06 . . . . 0.0 119.261 161.825 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 64' ' ' GLU . . . . . . . . . . . . 0.408 26.2 mt-10 -77.61 0.84 21.63 Favored 'General case' 0 CA--C 1.583 2.249 0 CA-C-N 114.636 -1.165 . . . . 0.0 113.616 -177.035 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 65' ' ' LEU . . . . . . . . . . . . 0.299 0.2 OUTLIER -101.63 -40.34 7.05 Favored 'General case' 0 CA--C 1.576 1.955 0 C-N-CA 126.92 2.088 . . . . 0.0 115.386 158.396 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 66' ' ' VAL . . . . . 0.648 HG13 ' O ' ' B' ' 62' ' ' GLN 0.332 21.9 m . . . . . 0 N--CA 1.513 2.691 0 N-CA-C 117.467 2.395 . . . . 0.0 117.467 -167.288 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.559 1.289 0 N-CA-C 114.034 1.124 . . . . 0.0 114.034 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 12.5 ptm180 -90.09 102.38 15.09 Favored 'General case' 0 N--CA 1.488 1.429 0 CA-C-O 122.284 1.04 . . . . 0.0 111.147 161.232 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 12.3 m-20 -98.0 68.81 2.02 Favored 'General case' 0 CA--C 1.564 1.51 0 O-C-N 121.065 -1.022 . . . . 0.0 108.572 160.612 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 7.4 p-10 -158.39 75.92 3.58 Favored Pre-proline 0 CA--C 1.57 1.737 0 C-N-CA 123.725 0.81 . . . . 0.0 112.478 179.738 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 4.4 Cg_exo -99.07 154.01 0.63 Allowed 'Trans proline' 0 C--N 1.362 1.281 0 CA-C-N 121.936 1.727 . . . . 0.0 113.889 -157.743 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 61.7 m80 -72.34 138.42 47.3 Favored 'General case' 0 CA--C 1.562 1.413 0 CA-C-N 113.546 -1.661 . . . . 0.0 113.633 177.356 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' PHE . . . . . 0.806 ' CZ ' HD12 ' B' ' 34' ' ' LEU 0.268 35.5 p90 -116.43 170.97 8.15 Favored 'General case' 0 CA--C 1.565 1.549 0 O-C-N 120.065 -1.647 . . . . 0.0 110.438 113.902 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 93.1 m-20 -89.13 94.53 9.97 Favored 'General case' 0 N--CA 1.485 1.319 0 O-C-N 119.764 -1.835 . . . . 0.0 107.556 162.364 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' PHE . . . . . 0.635 ' CG ' HD13 ' B' ' 34' ' ' LEU . 8.9 t80 -66.9 162.83 20.92 Favored 'General case' 0 CA--C 1.556 1.202 0 CA-C-O 124.344 2.021 . . . . 0.0 111.345 160.904 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 38.3 tpt85 170.96 103.35 0.01 OUTLIER 'General case' 0 N--CA 1.486 1.346 0 O-C-N 119.785 -1.822 . . . . 0.0 106.881 -119.19 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' MET . . . . . 0.595 ' SD ' HD23 ' A' ' 19' ' ' LEU . 11.6 mtm -138.85 122.9 11.3 Favored Pre-proline 0 CA--C 1.561 1.375 0 CA-C-O 117.296 -1.335 . . . . 0.0 110.872 -153.763 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 75.1 Cg_exo -43.0 143.11 1.96 Allowed 'Trans proline' 0 CA--C 1.562 1.923 0 C-N-CA 122.952 2.435 . . . . 0.0 116.013 163.32 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' MET . . . . . 0.403 ' SD ' ' HG3' ' A' ' 17' ' ' GLU . 9.5 tpp -55.34 -28.68 55.35 Favored 'General case' 0 N--CA 1.491 1.609 0 N-CA-C 119.533 3.16 . . . . 0.0 119.533 -163.987 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . 0.268 9.2 pt-20 -62.7 -48.63 78.43 Favored 'General case' 0 CA--C 1.566 1.586 0 N-CA-C 116.411 2.004 . . . . 0.0 116.411 160.959 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -60.13 -44.19 94.61 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.288 0 CA-C-N 123.114 2.688 . . . . 0.0 113.438 174.345 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -80.84 -21.28 40.9 Favored 'General case' 0 CA--C 1.556 1.181 0 N-CA-C 116.63 2.085 . . . . 0.0 116.63 175.759 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.403 ' HG3' ' SD ' ' A' ' 13' ' ' MET . 38.9 mt-10 -67.34 -47.61 69.97 Favored 'General case' 0 N--CA 1.49 1.555 0 CA-C-N 123.183 2.719 . . . . 0.0 113.766 151.946 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 46.7 mtmt -57.6 -57.04 14.44 Favored 'General case' 0 N--CA 1.485 1.307 0 CA-C-N 121.609 2.004 . . . . 0.0 114.353 174.157 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.595 HD23 ' SD ' ' A' ' 11' ' ' MET 0.267 12.0 tp -64.18 -40.0 95.18 Favored 'General case' 0 CA--C 1.563 1.445 0 C-N-CA 124.812 1.245 . . . . 0.0 113.499 176.081 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 10.6 ttpt -80.26 -25.12 39.65 Favored 'General case' 0 CA--C 1.569 1.705 0 CA-C-N 120.537 1.517 . . . . 0.0 114.947 176.201 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' PHE . . . . . 0.407 ' O ' ' HB3' ' A' ' 25' ' ' ALA . 18.7 m-30 -70.43 -71.48 0.24 Allowed 'General case' 0 N--CA 1.488 1.468 0 CA-C-O 114.074 -2.869 . . . . 0.0 110.764 162.23 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.644 HH21 HD11 ' A' ' 37' ' ' ILE 0.261 7.3 tpt180 -14.09 -56.26 0.0 OUTLIER 'General case' 0 CA--C 1.595 2.683 0 CA-C-N 125.92 3.964 . . . . 0.0 116.042 159.515 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.512 ' HB2' ' CB ' ' A' ' 33' ' ' GLU . . . -55.77 -79.42 0.02 OUTLIER 'General case' 0 CA--C 1.586 2.329 0 N-CA-C 118.421 2.748 . . . . 0.0 118.421 157.921 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 66.5 mm-40 -74.9 -29.3 60.95 Favored 'General case' 0 CA--C 1.574 1.904 0 N-CA-C 119.34 3.089 . . . . 0.0 119.34 -175.437 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.407 ' HB3' ' O ' ' A' ' 21' ' ' PHE . . . -43.22 -50.94 6.35 Favored 'General case' 0 CA--C 1.577 1.994 0 N-CA-C 116.081 1.882 . . . . 0.0 116.081 152.129 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . 0.313 0.1 OUTLIER -112.67 -46.74 3.12 Favored 'General case' 0 CA--C 1.578 2.032 0 N-CA-C 114.967 1.469 . . . . 0.0 114.967 -158.77 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 153.9 22.32 0.04 OUTLIER Glycine 0 N--CA 1.501 3.029 0 N-CA-C 119.377 2.511 . . . . 0.0 119.377 179.211 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.511 HH12 HD13 ' A' ' 37' ' ' ILE . 84.4 mtm180 -132.91 163.66 28.66 Favored 'General case' 0 CA--C 1.576 1.961 0 N-CA-C 104.748 -2.315 . . . . 0.0 104.748 -177.645 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 9.4 t -137.76 115.15 11.1 Favored 'General case' 0 N--CA 1.503 2.219 0 O-C-N 117.157 -3.465 . . . . 0.0 107.071 -171.766 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 19.9 mtp -53.05 -40.7 64.17 Favored 'General case' 0 N--CA 1.491 1.62 0 N-CA-C 118.224 2.676 . . . . 0.0 118.224 -126.724 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 13.0 t-20 -45.58 -43.58 12.24 Favored 'General case' 0 CA--C 1.598 2.793 0 CA-C-N 125.505 3.775 . . . . 0.0 114.857 165.151 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . 0.416 89.1 p -56.95 -58.29 8.79 Favored 'General case' 0 N--CA 1.503 2.214 0 N-CA-C 120.348 3.462 . . . . 0.0 120.348 149.555 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 33' ' ' GLU . . . . . 0.512 ' CB ' ' HB2' ' A' ' 23' ' ' ALA . 10.5 tm-20 -64.82 -61.14 2.36 Favored 'General case' 0 N--CA 1.507 2.389 0 CA-C-N 123.127 2.694 . . . . 0.0 117.761 176.804 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.819 HD12 ' CZ ' ' B' ' 7' ' ' PHE . 0.0 OUTLIER -38.23 -53.44 1.45 Allowed 'General case' 0 CA--C 1.545 0.77 0 CA-C-O 115.748 -2.072 . . . . 0.0 108.126 169.019 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.495 ' HG ' ' CE1' ' B' ' 9' ' ' PHE . 11.9 mt -63.99 -56.29 16.17 Favored 'General case' 0 C--N 1.367 1.343 0 CA-C-N 123.03 2.65 . . . . 0.0 115.171 178.848 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . 0.276 1.5 tm0? -58.56 -31.1 67.68 Favored 'General case' 0 CA--C 1.57 1.727 0 CA-C-O 116.612 -1.661 . . . . 0.0 114.626 176.874 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 37' ' ' ILE . . . . . 0.644 HD11 HH21 ' A' ' 22' ' ' ARG . 2.8 tp -79.28 -31.7 14.58 Favored 'Isoleucine or valine' 0 CA--C 1.567 1.62 0 CA-C-N 122.318 2.327 . . . . 0.0 116.414 164.393 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.433 HG21 HD22 ' A' ' 34' ' ' LEU . 3.1 t -77.19 -48.72 24.29 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.911 0 CA-C-N 122.285 2.311 . . . . 0.0 110.934 178.821 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 29.6 mt-30 -51.36 -46.21 62.66 Favored 'General case' 0 CA--C 1.551 0.987 0 CA-C-O 116.198 -1.858 . . . . 0.0 113.005 155.824 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' ASP . . . . . 0.407 ' HB3' ' HA ' ' A' ' 37' ' ' ILE 0.297 42.0 t0 -44.51 -55.24 5.26 Favored 'General case' 0 N--CA 1.502 2.157 0 CA-C-N 121.763 2.074 . . . . 0.0 113.644 158.497 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . 0.283 . . -76.44 -17.98 59.04 Favored 'General case' 0 CA--C 1.544 0.721 0 N-CA-C 119.324 3.083 . . . . 0.0 119.324 -161.678 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.419 HD13 ' HE ' ' B' ' 22' ' ' ARG 0.251 1.3 pt? -131.1 26.22 4.9 Favored 'General case' 0 CA--C 1.563 1.464 0 N-CA-C 117.358 2.355 . . . . 0.0 117.358 158.042 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 94.9 p -151.91 -52.94 0.12 Allowed 'General case' 0 N--CA 1.492 1.633 0 N-CA-C 116.023 1.86 . . . . 0.0 116.023 161.895 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 44.0 tttm -60.94 96.95 0.09 OUTLIER Pre-proline 0 N--CA 1.527 3.406 0 N-CA-C 120.742 3.608 . . . . 0.0 120.742 -105.373 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 27.5 Cg_endo -89.24 64.68 2.52 Favored 'Trans proline' 0 CA--C 1.563 1.967 0 CA-C-N 124.538 2.657 . . . . 0.0 115.904 172.989 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 48.2 t -152.02 80.23 6.07 Favored Pre-proline 0 CA--C 1.574 1.893 0 N-CA-C 116.052 1.871 . . . . 0.0 116.052 -164.971 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_endo -98.66 87.34 0.08 OUTLIER 'Cis proline' 0 CA--C 1.571 2.347 0 CA-C-N 122.484 1.923 . . . . 0.0 110.963 -23.598 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 12.2 p -154.34 -51.62 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.506 2.352 0 O-C-N 120.691 -1.256 . . . . 0.0 113.162 -156.766 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . 0.374 13.1 p 88.6 126.62 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.622 0 C-N-CA 125.696 1.598 . . . . 0.0 110.008 -171.172 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -118.98 70.01 0.33 Allowed Glycine 0 CA--C 1.546 1.982 0 N-CA-C 114.635 0.614 . . . . 0.0 114.635 167.401 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -130.56 24.33 5.1 Favored 'General case' 0 N--CA 1.506 2.366 2 O-C-N 114.415 -5.168 . . . . 0.0 115.626 -10.285 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . 0.29 40.3 mmt180 58.62 -39.91 0.06 Allowed 'General case' 0 N--CA 1.509 2.514 0 N-CA-C 115.863 1.801 . . . . 0.0 115.863 -128.912 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 53' ' ' ASN . . . . . 0.534 ' HA ' ' HB2' ' A' ' 55' ' ' ALA . 8.9 m120 -69.05 -152.44 0.02 OUTLIER 'General case' 0 CA--C 1.589 2.449 0 O-C-N 120.388 -1.445 . . . . 0.0 113.863 158.029 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 54' ' ' ASP . . . . . 0.539 ' H ' HD13 ' B' ' 58' ' ' LEU 0.469 0.5 OUTLIER 84.56 -93.64 0.01 OUTLIER 'General case' 0 N--CA 1.485 1.293 0 O-C-N 117.869 -3.019 . . . . 0.0 104.274 -98.81 . . . . . . . . 4 4 . 1 . 004 nuclear build full ' A' A ' 55' ' ' ALA . . . . . 0.534 ' HB2' ' HA ' ' A' ' 53' ' ' ASN 0.499 . . -91.87 -106.31 0.11 Allowed 'General case' 0 CA--C 1.569 1.698 2 O-C-N 114.137 -5.352 . . . . 0.0 113.99 9.208 . . . . . . . . 4 3 . 1 . 004 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.587 ' C ' ' HB3' ' A' ' 59' ' ' ALA 0.32 15.1 mm-40 -9.05 1.82 0.0 OUTLIER 'General case' 0 C--N 1.265 -3.101 1 N-CA-C 125.24 5.274 . . . . 0.0 125.24 100.13 . . . . . . . . 4 3 . 1 . 004 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.46 ' HB2' ' O ' ' A' ' 54' ' ' ASP 0.271 1.1 mpt_? -148.65 -22.79 0.32 Allowed 'General case' 0 N--CA 1.494 1.753 0 N-CA-C 118.914 2.931 . . . . 0.0 118.914 -162.813 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . 0.294 0.7 OUTLIER -66.05 -31.41 72.28 Favored 'General case' 0 N--CA 1.503 2.178 0 C-N-CA 117.243 -1.783 . . . . 0.0 115.124 126.995 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 59' ' ' ALA . . . . . 0.587 ' HB3' ' C ' ' A' ' 56' ' ' GLU . . . -48.33 -62.85 1.28 Allowed 'General case' 0 N--CA 1.49 1.559 0 N-CA-C 116.158 1.911 . . . . 0.0 116.158 159.587 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -98.65 -7.06 28.56 Favored 'General case' 0 CA--C 1.543 0.679 0 N-CA-C 114.071 1.137 . . . . 0.0 114.071 -167.307 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . 0.313 43.4 tp10 -67.38 -52.57 38.4 Favored 'General case' 0 CA--C 1.551 1.004 0 CA-C-O 115.147 -2.359 . . . . 0.0 112.151 149.584 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 62' ' ' GLN . . . . . 0.457 ' O ' HG13 ' A' ' 66' ' ' VAL 0.28 7.2 tp60 -72.73 -63.15 1.22 Allowed 'General case' 0 C--N 1.37 1.488 0 CA-C-N 124.884 3.493 . . . . 0.0 111.801 178.909 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 22.8 t -99.85 56.66 0.97 Allowed 'General case' 0 CA--C 1.56 1.348 0 N-CA-C 116.727 2.121 . . . . 0.0 116.727 170.882 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 8.0 tt0 -87.14 -49.52 7.24 Favored 'General case' 0 CA--C 1.57 1.737 0 O-C-N 119.311 -2.118 . . . . 0.0 112.466 101.39 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . 0.294 2.3 mp -90.64 27.31 1.78 Allowed 'General case' 0 N--CA 1.505 2.28 0 N-CA-C 117.137 2.273 . . . . 0.0 117.137 -162.491 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.457 HG13 ' O ' ' A' ' 62' ' ' GLN . 24.7 m . . . . . 0 N--CA 1.503 2.178 0 C-N-CA 126.259 1.824 . . . . 0.0 113.313 161.762 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.563 1.472 0 N-CA-C 114.433 1.271 . . . . 0.0 114.433 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 2' ' ' ARG . . . . . . . . . . . . 0.502 47.5 mtp180 71.61 -147.97 0.07 Allowed 'General case' 0 N--CA 1.499 2.019 1 O-C-N 113.662 -5.649 . . . . 0.0 114.213 -10.43 . . . . . . . . 3 2 . 1 . 004 nuclear build full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . 0.321 25.9 t70 76.99 102.65 0.07 Allowed 'General case' 0 CA--C 1.571 1.766 0 C-N-CA 124.511 1.124 . . . . 0.0 113.364 -171.957 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 4' ' ' ASP . . . . . . . . . . . . 0.419 2.9 p30 50.72 76.61 0.53 Allowed Pre-proline 0 CA--C 1.576 1.979 0 N-CA-C 120.517 3.525 . . . . 0.0 120.517 168.282 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 4.5 Cg_exo -107.83 149.36 0.08 OUTLIER 'Trans proline' 0 CA--C 1.557 1.669 0 C-N-CA 122.457 2.105 . . . . 0.0 114.011 -165.39 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 6' ' ' HIS . . . . . . . . . . . . . 77.5 m80 -85.82 135.28 33.78 Favored 'General case' 0 CA--C 1.579 2.059 0 CA-C-N 114.959 -1.019 . . . . 0.0 112.117 174.647 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 7' ' ' PHE . . . . . 0.819 ' CZ ' HD12 ' A' ' 34' ' ' LEU . 3.0 p90 -135.94 161.7 34.9 Favored 'General case' 0 CA--C 1.571 1.778 0 O-C-N 119.896 -1.752 . . . . 0.0 112.345 151.058 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 8' ' ' ASN . . . . . . . . . . . . . 7.8 p-10 -62.32 102.75 0.33 Allowed 'General case' 0 CA--C 1.575 1.909 0 N-CA-C 116.001 1.852 . . . . 0.0 116.001 171.782 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 9' ' ' PHE . . . . . 0.622 ' CG ' HD13 ' A' ' 34' ' ' LEU . 4.9 t80 -126.81 105.99 9.04 Favored 'General case' 0 CA--C 1.538 0.516 0 N-CA-C 107.661 -1.237 . . . . 0.0 107.661 159.662 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 10' ' ' ARG . . . . . . . . . . . . 0.469 0.0 OUTLIER 92.79 87.45 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.566 1 O-C-N 114.162 -5.337 . . . . 0.0 109.339 -11.415 . . . . . . . . 4 3 . 1 . 004 nuclear build full ' B' B ' 11' ' ' MET . . . . . 0.633 ' SD ' HD23 ' B' ' 19' ' ' LEU . 8.4 mtm -148.87 126.29 5.6 Favored Pre-proline 0 CA--C 1.566 1.565 0 CA-C-O 117.045 -1.455 . . . . 0.0 110.371 -160.261 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 12' ' ' PRO . . . . . . . . . . . . . 76.9 Cg_exo -42.55 140.47 2.68 Favored 'Trans proline' 0 C--N 1.371 1.72 0 C-N-CA 123.242 2.628 . . . . 0.0 116.261 161.944 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 13' ' ' MET . . . . . 0.452 ' SD ' ' HG3' ' B' ' 17' ' ' GLU . 23.4 tpp -54.76 -29.19 53.29 Favored 'General case' 0 N--CA 1.495 1.78 0 N-CA-C 119.006 2.965 . . . . 0.0 119.006 -163.886 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -61.95 -48.25 81.22 Favored 'General case' 0 N--CA 1.492 1.672 0 N-CA-C 117.008 2.225 . . . . 0.0 117.008 163.972 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -58.92 -50.58 79.08 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.138 0 CA-C-N 121.163 1.801 . . . . 0.0 113.001 172.123 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -73.83 -26.09 60.41 Favored 'General case' 0 CA--C 1.545 0.759 0 N-CA-C 116.7 2.111 . . . . 0.0 116.7 175.826 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 17' ' ' GLU . . . . . 0.452 ' HG3' ' SD ' ' B' ' 13' ' ' MET . 43.2 mt-10 -64.13 -48.2 76.98 Favored 'General case' 0 N--CA 1.49 1.565 0 CA-C-N 123.908 3.049 . . . . 0.0 112.959 156.883 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . 0.615 23.5 pttt -67.26 -40.28 86.19 Favored 'General case' 0 N--CA 1.488 1.442 0 N-CA-C 117.415 2.376 . . . . 0.0 117.415 178.963 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 19' ' ' LEU . . . . . 0.633 HD23 ' SD ' ' B' ' 11' ' ' MET . 12.5 tp -69.75 -35.88 75.33 Favored 'General case' 0 CA--C 1.565 1.52 0 N-CA-C 115.081 1.512 . . . . 0.0 115.081 168.234 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 20' ' ' LYS . . . . . . . . . . . . . 14.3 ttpt -86.57 -30.74 21.64 Favored 'General case' 0 CA--C 1.567 1.627 0 N-CA-C 114.721 1.378 . . . . 0.0 114.721 178.814 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 21' ' ' PHE . . . . . 0.438 ' O ' ' HB3' ' B' ' 25' ' ' ALA . 24.5 m-85 -59.66 -68.56 0.27 Allowed 'General case' 0 N--CA 1.492 1.629 0 CA-C-O 114.188 -2.815 . . . . 0.0 111.514 155.23 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 22' ' ' ARG . . . . . 0.419 ' HE ' HD13 ' A' ' 42' ' ' LEU 0.306 13.9 ttm-85 -25.68 -47.79 0.02 OUTLIER 'General case' 0 CA--C 1.597 2.788 0 CA-C-N 125.583 3.811 . . . . 0.0 116.979 163.411 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -61.36 -61.78 2.3 Favored 'General case' 0 CA--C 1.581 2.148 0 N-CA-C 119.936 3.31 . . . . 0.0 119.936 160.668 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 49.4 mt-10 -68.04 -51.34 47.96 Favored 'General case' 0 N--CA 1.502 2.128 0 N-CA-C 116.743 2.127 . . . . 0.0 116.743 175.041 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 25' ' ' ALA . . . . . 0.438 ' HB3' ' O ' ' B' ' 21' ' ' PHE . . . -40.92 -46.57 2.81 Favored 'General case' 0 CA--C 1.586 2.357 0 N-CA-C 117.455 2.391 . . . . 0.0 117.455 162.953 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 26' ' ' ASN . . . . . . . . . . . . . 77.8 m-20 -86.07 -42.23 14.11 Favored 'General case' 0 N--CA 1.503 2.224 0 N-CA-C 117.168 2.284 . . . . 0.0 117.168 170.896 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 27' ' ' GLY . . . . . . . . . . . . . . . 99.53 57.0 0.95 Allowed Glycine 0 N--CA 1.493 2.455 0 N-CA-C 116.174 1.23 . . . . 0.0 116.174 -159.878 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 28' ' ' ARG . . . . . . . . . . . . . 10.7 ptt-85 -156.33 100.48 1.99 Allowed 'General case' 0 N--CA 1.493 1.688 0 N-CA-C 106.683 -1.599 . . . . 0.0 106.683 176.936 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 29' ' ' SER . . . . . . . . . . . . . 31.6 t -79.92 133.38 36.21 Favored 'General case' 0 N--CA 1.5 2.026 0 O-C-N 119.259 -2.151 . . . . 0.0 108.381 -156.322 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 30' ' ' MET . . . . . . . . . . . . . 25.1 mtp -47.21 -41.01 17.47 Favored 'General case' 0 N--CA 1.501 2.111 0 N-CA-C 119.089 2.996 . . . . 0.0 119.089 -143.371 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 31' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -47.91 -40.72 22.68 Favored 'General case' 0 CA--C 1.593 2.609 0 CA-C-N 125.318 3.69 . . . . 0.0 115.392 166.006 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 32' ' ' SER . . . . . . . . . . . . 0.37 37.4 t -54.25 -72.51 0.06 Allowed 'General case' 0 CA--C 1.576 1.946 0 N-CA-C 118.255 2.687 . . . . 0.0 118.255 145.57 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -57.3 -57.2 13.68 Favored 'General case' 0 N--CA 1.522 3.165 0 CA-C-N 125.382 3.719 . . . . 0.0 116.926 -177.693 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 34' ' ' LEU . . . . . 0.806 HD12 ' CZ ' ' A' ' 7' ' ' PHE . 0.1 OUTLIER -40.59 -55.77 2.25 Favored 'General case' 0 CA--C 1.547 0.833 0 CA-C-O 115.698 -2.096 . . . . 0.0 108.382 169.054 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 35' ' ' LEU . . . . . 0.415 HD23 ' HA ' ' B' ' 35' ' ' LEU . 12.8 mt -59.78 -45.83 91.09 Favored 'General case' 0 C--N 1.367 1.365 0 CA-C-N 122.922 2.601 . . . . 0.0 116.135 175.575 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 36' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -56.12 -56.57 19.29 Favored 'General case' 0 CA--C 1.547 0.834 0 CA-C-O 117.534 -1.222 . . . . 0.0 113.276 175.27 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 37' ' ' ILE . . . . . . . . . . . . . 2.9 tp -63.8 -25.14 37.52 Favored 'Isoleucine or valine' 0 CA--C 1.563 1.461 0 CA-C-O 115.006 -2.426 . . . . 0.0 117.379 169.517 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 38' ' ' VAL . . . . . 0.492 HG21 HD22 ' B' ' 34' ' ' LEU . 3.5 t -83.29 -49.56 16.49 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.069 0 C-N-CA 127.311 2.244 . . . . 0.0 111.335 -177.018 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 26.6 mt-30 -49.66 -45.98 49.23 Favored 'General case' 0 CA--C 1.565 1.54 0 CA-C-O 118.286 -0.864 . . . . 0.0 112.214 154.614 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 40' ' ' ASP . . . . . . . . . . . . 0.343 0.2 OUTLIER -53.25 -41.28 65.31 Favored 'General case' 0 N--CA 1.492 1.636 0 N-CA-C 119.029 2.974 . . . . 0.0 119.029 157.759 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -68.3 -47.37 67.78 Favored 'General case' 0 N--CA 1.486 1.35 0 N-CA-C 114.715 1.376 . . . . 0.0 114.715 -165.646 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 1.4 pp -100.95 -12.34 19.0 Favored 'General case' 0 CA--C 1.567 1.63 0 N-CA-C 117.794 2.516 . . . . 0.0 117.794 171.708 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 43' ' ' SER . . . . . . . . . . . . . 6.6 m -75.19 -37.39 61.22 Favored 'General case' 0 N--CA 1.502 2.138 0 CA-C-N 122.5 2.409 . . . . 0.0 114.793 159.251 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 44' ' ' LYS . . . . . . . . . . . . 0.425 9.3 pttm 64.7 164.39 0.12 Allowed Pre-proline 0 CA--C 1.595 2.706 0 N-CA-C 117.265 2.32 . . . . 0.0 117.265 173.095 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 45' ' ' PRO . . . . . 0.419 ' HB2' HG11 ' B' ' 48' ' ' VAL . 20.3 Cg_endo -68.23 105.6 1.24 Allowed 'Trans proline' 0 CA--C 1.568 2.195 0 N-CA-C 118.415 2.429 . . . . 0.0 118.415 -173.335 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 46' ' ' SER . . . . . . . . . . . . . 61.6 m -105.37 -70.78 0.03 OUTLIER Pre-proline 0 CA--C 1.577 1.998 0 CA-C-O 115.607 -2.139 . . . . 0.0 112.093 165.147 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 70.6 Cg_endo -77.11 56.44 5.43 Favored 'Trans proline' 0 CA--C 1.574 2.491 0 CA-C-N 126.155 3.234 . . . . 0.0 116.952 171.495 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 48' ' ' VAL . . . . . 0.419 HG11 ' HB2' ' B' ' 45' ' ' PRO . 3.3 p -99.01 -35.06 4.68 Favored 'Isoleucine or valine' 0 CA--C 1.576 1.957 0 C-N-CA 125.361 1.464 . . . . 0.0 114.621 -178.051 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 49' ' ' THR . . . . . . . . . . . . 0.467 1.9 t 69.58 70.72 0.25 Allowed 'General case' 0 N--CA 1.499 2.008 0 N-CA-C 116.462 2.023 . . . . 0.0 116.462 151.021 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 50' ' ' GLY . . . . . . . . . . . . . . . 115.95 -63.96 0.34 Allowed Glycine 0 N--CA 1.497 2.722 0 CA-C-O 122.442 1.023 . . . . 0.0 112.288 -178.503 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 51' ' ' TYR . . . . . . . . . . . . . 57.9 m-85 -32.98 73.22 0.0 OUTLIER 'General case' 0 CA--C 1.596 2.734 0 N-CA-C 120.814 3.635 . . . . 0.0 120.814 148.8 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 52' ' ' ARG . . . . . . . . . . . . . 96.8 mtt-85 -151.03 115.06 5.01 Favored 'General case' 0 N--CA 1.51 2.551 0 O-C-N 118.355 -2.716 . . . . 0.0 115.346 -170.356 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 53' ' ' ASN . . . . . 0.445 HD21 ' HB2' ' A' ' 57' ' ' ARG 0.614 0.1 OUTLIER 80.71 145.77 0.08 Allowed 'General case' 0 CA--C 1.568 1.636 2 O-C-N 112.816 -6.178 . . . . 0.0 117.572 -16.249 . . . . . . . . 5 4 . 1 . 004 nuclear build full ' B' B ' 54' ' ' ASP . . . . . 0.51 ' HB3' ' HB2' ' B' ' 57' ' ' ARG 1.141 0.0 OUTLIER 107.85 24.77 0.0 OUTLIER 'General case' 0 N--CA 1.519 2.983 2 O-C-N 114.102 -5.374 . . . . 0.0 123.808 -6.143 . . . . . . . . 5 4 . 1 . 004 nuclear build full ' B' B ' 55' ' ' ALA . . . . . . . . . . . . 0.622 . . -87.97 5.36 41.09 Favored 'General case' 0 CA--C 1.568 1.65 1 O-C-N 114.666 -5.021 . . . . 0.0 118.73 116.94 . . . . . . . . 3 2 . 1 . 004 nuclear build full ' B' B ' 56' ' ' GLU . . . . . 0.425 ' HB3' ' HA ' ' B' ' 54' ' ' ASP . 9.6 tp10 -53.05 -8.34 0.1 Allowed 'General case' 0 CA--C 1.585 2.289 0 N-CA-C 119.981 3.326 . . . . 0.0 119.981 123.511 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 57' ' ' ARG . . . . . 0.51 ' HB2' ' HB3' ' B' ' 54' ' ' ASP . 0.1 OUTLIER -94.71 -45.57 7.29 Favored 'General case' 0 N--CA 1.475 0.793 0 O-C-N 119.674 -1.891 . . . . 0.0 113.471 163.126 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 58' ' ' LEU . . . . . 0.539 HD13 ' H ' ' A' ' 54' ' ' ASP . 7.8 mp -43.55 -53.73 5.39 Favored 'General case' 0 N--CA 1.527 3.424 0 CA-C-N 123.026 2.648 . . . . 0.0 117.5 166.875 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 59' ' ' ALA . . . . . 0.42 ' HB3' ' C ' ' B' ' 56' ' ' GLU 0.41 . . -13.6 -86.53 0.0 OUTLIER 'General case' 0 CA--C 1.555 1.14 1 N-CA-C 123.01 4.448 . . . . 0.0 123.01 132.982 . . . . . . . . 4 3 . 1 . 004 nuclear build full ' B' B ' 60' ' ' ASP . . . . . 0.404 ' HA ' ' N ' ' B' ' 65' ' ' LEU . 2.1 m-20 -68.59 0.12 4.5 Favored 'General case' 0 CA--C 1.559 1.315 0 N-CA-C 119.845 3.276 . . . . 0.0 119.845 -175.396 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 61' ' ' GLU . . . . . . . . . . . . 0.268 0.3 OUTLIER -59.56 -92.01 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.873 0 CA-C-O 115.377 -2.249 . . . . 0.0 106.62 138.137 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 62' ' ' GLN . . . . . 0.535 ' O ' HG13 ' B' ' 66' ' ' VAL 0.517 14.0 mm-40 -88.15 88.47 7.65 Favored 'General case' 0 N--CA 1.488 1.441 0 CA-C-O 127.108 3.337 . . . . 0.0 112.028 -178.523 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 63' ' ' SER . . . . . 0.79 ' H ' ' H ' ' B' ' 65' ' ' LEU 2.11 4.6 t -123.88 8.69 8.75 Favored 'General case' 0 CA--C 1.598 2.805 2 O-C-N 114.609 -5.057 . . . . 0.0 122.063 69.084 . . . . . . . . 4 3 . 1 . 004 nuclear build full ' B' B ' 64' ' ' GLU . . . . . . . . . . . . 2.413 23.9 tt0 84.83 -34.74 0.05 Allowed 'General case' 0 CA--C 1.583 2.224 1 O-C-N 116.154 -4.091 . . . . 0.0 110.474 -114.587 . . . . . . . . 3 2 . 1 . 004 nuclear build full ' B' B ' 65' ' ' LEU . . . . . 0.79 ' H ' ' H ' ' B' ' 63' ' ' SER . 4.4 mt -171.64 -62.95 0.02 OUTLIER 'General case' 0 N--CA 1.518 2.936 0 N-CA-C 121.324 3.824 . . . . 0.0 121.324 -112.642 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 66' ' ' VAL . . . . . 0.777 ' H ' ' HA ' ' B' ' 63' ' ' SER 0.582 0.1 OUTLIER . . . . . 0 N--CA 1.491 1.593 0 N-CA-C 121.411 3.856 . . . . 0.0 121.411 -160.885 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.563 1.471 0 N-CA-C 114.863 1.431 . . . . 0.0 114.863 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . 0.4 0.0 OUTLIER 72.26 -154.36 0.08 Allowed 'General case' 0 N--CA 1.499 2.002 1 O-C-N 113.68 -5.638 . . . . 0.0 114.335 -8.864 . . . . . . . . 4 3 . 1 . 005 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -115.65 62.4 0.7 Allowed 'General case' 0 CA--C 1.565 1.531 0 C-N-CA 125.011 1.325 . . . . 0.0 107.881 167.785 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 2.1 p30 -161.95 75.94 2.24 Favored Pre-proline 0 CA--C 1.568 1.64 0 O-C-N 121.285 -0.885 . . . . 0.0 112.969 -178.656 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 6.0 Cg_exo -100.2 155.35 0.5 Allowed 'Trans proline' 0 CA--C 1.553 1.472 0 C-N-CA 121.974 1.783 . . . . 0.0 113.835 -159.382 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 77.5 m80 -76.37 138.31 40.34 Favored 'General case' 0 CA--C 1.56 1.361 0 CA-C-N 113.664 -1.607 . . . . 0.0 113.479 -178.093 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' PHE . . . . . 0.809 ' CZ ' HD12 ' B' ' 34' ' ' LEU 0.274 36.2 p90 -116.03 164.56 14.26 Favored 'General case' 0 CA--C 1.561 1.381 0 CA-C-O 123.927 1.822 . . . . 0.0 110.244 117.003 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 26.6 p-10 -82.1 89.34 6.45 Favored 'General case' 0 CA--C 1.564 1.515 0 O-C-N 119.72 -1.863 . . . . 0.0 109.385 161.803 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' PHE . . . . . 0.598 ' CG ' HD13 ' B' ' 34' ' ' LEU . 9.0 t80 -66.39 167.93 9.75 Favored 'General case' 0 CA--C 1.557 1.24 0 CA-C-O 123.96 1.838 . . . . 0.0 110.334 159.243 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 38.8 tpt85 159.85 110.03 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.482 0 O-C-N 119.411 -2.056 . . . . 0.0 106.128 -116.23 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 2.2 mpt? -119.26 -168.66 0.13 Allowed Pre-proline 0 CA--C 1.576 1.949 0 C-N-CA 120.0 -0.68 . . . . 0.0 112.711 -168.048 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -98.11 161.57 0.81 Allowed 'Trans proline' 0 CA--C 1.566 2.09 0 CA-C-O 123.393 1.331 . . . . 0.0 114.119 133.098 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' MET . . . . . 0.441 ' SD ' ' HG3' ' A' ' 17' ' ' GLU . 22.3 tpp -58.86 -33.81 70.89 Favored 'General case' 0 N--CA 1.497 1.911 0 N-CA-C 117.432 2.382 . . . . 0.0 117.432 -162.235 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . 0.25 9.1 pt-20 -62.26 -42.35 99.25 Favored 'General case' 0 N--CA 1.49 1.551 0 N-CA-C 116.39 1.996 . . . . 0.0 116.39 166.043 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.427 ' CG1' HG12 ' B' ' 38' ' ' VAL . 0.4 OUTLIER -61.0 -48.84 87.26 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.211 0 CA-C-N 122.566 2.439 . . . . 0.0 112.872 173.358 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 4.8 ttt180 -71.7 -33.76 69.05 Favored 'General case' 0 CA--C 1.547 0.85 0 CA-C-O 116.153 -1.88 . . . . 0.0 115.635 174.185 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.441 ' HG3' ' SD ' ' A' ' 13' ' ' MET . 40.7 mt-10 -59.44 -42.92 93.02 Favored 'General case' 0 N--CA 1.492 1.628 0 CA-C-N 123.986 3.085 . . . . 0.0 114.671 159.997 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . 0.271 39.9 mtmt -63.95 -49.57 72.05 Favored 'General case' 0 CA--C 1.566 1.582 0 CA-C-N 120.724 1.602 . . . . 0.0 115.142 172.054 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.644 ' HG ' ' SD ' ' A' ' 30' ' ' MET 0.303 13.3 tp -67.35 -38.84 85.47 Favored 'General case' 0 CA--C 1.57 1.745 0 C-N-CA 125.824 1.65 . . . . 0.0 114.616 173.173 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 31.9 ttpt -88.0 -25.97 22.86 Favored 'General case' 0 CA--C 1.561 1.403 0 CA-C-O 117.261 -1.352 . . . . 0.0 113.663 -179.743 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 19.1 m-85 -64.04 -74.48 0.1 Allowed 'General case' 0 N--CA 1.489 1.492 0 CA-C-O 112.211 -3.756 . . . . 0.0 109.822 154.104 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . 0.275 6.0 tpp180 -14.31 -60.17 0.01 OUTLIER 'General case' 0 CA--C 1.589 2.468 1 CA-C-N 126.402 4.183 . . . . 0.0 115.473 165.754 . . . . . . . . 3 2 . 1 . 005 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.513 ' HB2' ' HB3' ' A' ' 33' ' ' GLU . . . -50.38 -78.95 0.02 OUTLIER 'General case' 0 CA--C 1.584 2.257 0 N-CA-C 120.375 3.472 . . . . 0.0 120.375 156.592 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 30.4 mt-10 -67.92 -34.47 76.67 Favored 'General case' 0 N--CA 1.503 2.201 0 N-CA-C 118.969 2.951 . . . . 0.0 118.969 -179.277 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -39.23 -47.79 1.7 Allowed 'General case' 0 CA--C 1.584 2.266 0 N-CA-C 116.119 1.896 . . . . 0.0 116.119 152.607 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' ASN . . . . . 0.402 ' CG ' HD22 ' B' ' 65' ' ' LEU . 0.1 OUTLIER -95.32 -51.99 4.36 Favored 'General case' 0 CA--C 1.577 2.015 0 N-CA-C 116.757 2.132 . . . . 0.0 116.757 -176.145 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 132.99 -13.3 5.0 Favored Glycine 0 CA--C 1.561 2.929 0 N-CA-C 120.445 2.938 . . . . 0.0 120.445 -150.089 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.47 ' HD3' ' HB3' ' B' ' 64' ' ' GLU . 75.8 mtm180 -90.61 151.32 21.34 Favored 'General case' 0 N--CA 1.497 1.907 0 CA-C-N 121.605 2.702 . . . . 0.0 105.608 172.195 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 35.3 t -121.64 106.01 10.95 Favored 'General case' 0 N--CA 1.502 2.143 0 O-C-N 118.14 -2.85 . . . . 0.0 106.477 -168.346 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' MET . . . . . 0.644 ' SD ' ' HG ' ' A' ' 19' ' ' LEU . 0.0 OUTLIER -38.85 -44.89 1.09 Allowed 'General case' 0 N--CA 1.494 1.729 0 N-CA-C 120.785 3.624 . . . . 0.0 120.785 -140.156 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 6.5 t-20 -45.96 -47.05 16.57 Favored 'General case' 0 CA--C 1.599 2.854 0 O-C-N 117.459 -3.276 . . . . 0.0 114.3 165.552 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . 0.332 31.2 t -47.35 -73.43 0.04 OUTLIER 'General case' 0 N--CA 1.504 2.245 0 N-CA-C 118.069 2.618 . . . . 0.0 118.069 142.929 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 33' ' ' GLU . . . . . 0.513 ' HB3' ' HB2' ' A' ' 23' ' ' ALA . 8.4 tm-20 -64.17 -55.23 23.24 Favored 'General case' 0 N--CA 1.501 2.103 0 N-CA-C 119.347 3.092 . . . . 0.0 119.347 -172.913 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.752 HD12 ' CZ ' ' B' ' 7' ' ' PHE . 0.2 OUTLIER -36.88 -52.8 0.94 Allowed 'General case' 0 CA--C 1.554 1.116 0 CA-C-O 115.764 -2.065 . . . . 0.0 107.341 163.691 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.471 HD22 HG21 ' B' ' 15' ' ' VAL . 14.0 mt -62.58 -51.99 65.18 Favored 'General case' 0 C--N 1.372 1.561 0 CA-C-N 122.925 2.602 . . . . 0.0 115.896 177.534 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -63.7 -36.05 82.57 Favored 'General case' 0 N--CA 1.484 1.257 0 N-CA-C 114.5 1.296 . . . . 0.0 114.5 -177.824 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 12.7 tt -73.01 -43.26 58.98 Favored 'Isoleucine or valine' 0 C--O 1.189 -2.099 0 CA-C-O 113.108 -3.33 . . . . 0.0 114.198 160.347 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.592 HG21 HD22 ' A' ' 34' ' ' LEU . 3.1 t -65.09 -50.17 75.74 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.647 1 CA-C-N 126.61 4.277 . . . . 0.0 113.888 -177.457 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 38.0 mt-30 -46.49 -57.93 4.25 Favored 'General case' 0 C--N 1.365 1.24 0 CA-C-O 114.131 -2.842 . . . . 0.0 108.949 158.377 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . 0.548 4.6 t70 -36.68 -56.2 0.84 Allowed 'General case' 0 N--CA 1.496 1.827 0 N-CA-C 118.301 2.704 . . . . 0.0 118.301 161.997 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . 0.261 . . -84.44 -20.33 31.96 Favored 'General case' 0 CA--C 1.544 0.713 0 N-CA-C 118.013 2.597 . . . . 0.0 118.013 -149.2 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . 0.304 1.1 pt? -96.51 -42.82 7.89 Favored 'General case' 0 N--CA 1.485 1.298 0 N-CA-C 117.933 2.568 . . . . 0.0 117.933 147.869 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 13.0 t -170.65 82.77 0.09 Allowed 'General case' 0 N--CA 1.483 1.223 0 CA-C-N 120.4 1.455 . . . . 0.0 107.474 -174.931 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . 0.32 4.2 tmtt? -37.54 -43.54 1.38 Allowed Pre-proline 0 N--CA 1.531 3.575 1 N-CA-C 122.308 4.188 . . . . 0.0 122.308 172.585 . . . . . . . . 3 2 . 1 . 005 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 11.5 Cg_endo -62.37 141.26 86.52 Favored 'Trans proline' 0 CA--C 1.563 1.929 0 N-CA-C 120.736 3.322 . . . . 0.0 120.736 -161.702 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 15.8 m -88.17 -40.87 0.48 Allowed Pre-proline 0 N--CA 1.502 2.164 0 O-C-N 116.587 -3.821 . . . . 0.0 119.24 35.174 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' PRO . . . . . 0.435 ' HA ' ' HA ' ' A' ' 48' ' ' VAL . 33.5 Cg_exo -66.96 96.89 0.39 Allowed 'Trans proline' 0 C--N 1.375 1.926 0 CA-C-N 125.827 3.117 . . . . 0.0 116.279 -169.993 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 48' ' ' VAL . . . . . 0.435 ' HA ' ' HA ' ' A' ' 47' ' ' PRO . 2.3 m -160.02 -66.34 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.509 2.507 0 O-C-N 116.448 -3.908 . . . . 0.0 107.496 30.423 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 49' ' ' THR . . . . . 0.423 ' H ' HG23 ' A' ' 48' ' ' VAL . 9.0 t -70.06 39.21 0.04 OUTLIER 'General case' 0 CA--C 1.577 2.014 0 N-CA-C 118.394 2.739 . . . . 0.0 118.394 162.747 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 97.81 -115.83 5.37 Favored Glycine 0 N--CA 1.489 2.178 0 N-CA-C 110.551 -1.02 . . . . 0.0 110.551 -147.297 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 71.8 m-85 -87.63 105.62 17.47 Favored 'General case' 0 CA--C 1.581 2.17 2 O-C-N 113.457 -5.731 . . . . 0.0 111.593 -3.775 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . 0.325 7.6 tpt180 -81.35 -131.06 0.02 OUTLIER 'General case' 0 N--CA 1.51 2.527 0 O-C-N 118.355 -2.716 . . . . 0.0 113.072 -176.109 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 53' ' ' ASN . . . . . 0.557 ' CB ' ' HA ' ' B' ' 53' ' ' ASN 0.401 8.9 m120 72.66 110.78 0.06 Allowed 'General case' 0 N--CA 1.509 2.519 0 N-CA-C 119.976 3.325 . . . . 0.0 119.976 131.133 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 54' ' ' ASP . . . . . 0.504 ' CB ' ' HB2' ' B' ' 53' ' ' ASN 1.268 0.0 OUTLIER 46.62 5.34 0.0 OUTLIER 'General case' 0 N--CA 1.511 2.581 1 N-CA-C 123.486 4.624 . . . . 0.0 123.486 -173.96 . . . . . . . . 5 4 . 1 . 005 nuclear build full ' A' A ' 55' ' ' ALA . . . . . 0.48 ' HB3' ' C ' ' A' ' 53' ' ' ASN 0.396 . . -10.51 -71.22 0.0 OUTLIER 'General case' 0 CA--C 1.592 2.573 2 O-C-N 114.17 -5.332 . . . . 0.0 124.005 94.597 . . . . . . . . 4 3 . 1 . 005 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.421 ' HA ' ' HB3' ' A' ' 59' ' ' ALA . 31.3 mp0 -53.13 -0.78 0.02 OUTLIER 'General case' 0 CA--C 1.595 2.693 0 N-CA-C 118.935 2.939 . . . . 0.0 118.935 155.448 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.44 ' HB2' ' CB ' ' A' ' 54' ' ' ASP . 27.0 ttt180 -88.38 -42.03 12.44 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 119.834 -1.792 . . . . 0.0 113.712 163.333 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 5.7 mp -61.2 -44.65 96.95 Favored 'General case' 0 CA--C 1.578 2.049 0 CA-C-O 121.563 0.697 . . . . 0.0 112.06 171.781 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 59' ' ' ALA . . . . . 0.421 ' HB3' ' HA ' ' A' ' 56' ' ' GLU . . . -36.7 -65.83 0.26 Allowed 'General case' 0 N--CA 1.484 1.274 0 N-CA-C 119.036 2.976 . . . . 0.0 119.036 146.149 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -78.42 1.58 21.65 Favored 'General case' 0 N--CA 1.486 1.328 0 N-CA-C 116.97 2.211 . . . . 0.0 116.97 -177.852 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 29.5 tt0 -74.77 -64.99 0.92 Allowed 'General case' 0 CA--C 1.55 0.953 0 CA-C-O 116.852 -1.546 . . . . 0.0 109.158 159.908 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 1.7 tp60 -70.06 -60.74 2.11 Favored 'General case' 0 C--N 1.363 1.187 0 CA-C-N 122.742 2.519 . . . . 0.0 111.39 176.155 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 63' ' ' SER . . . . . 0.471 ' HA ' HG22 ' A' ' 66' ' ' VAL 0.339 29.9 t -84.89 45.12 1.13 Allowed 'General case' 0 CA--C 1.566 1.578 0 N-CA-C 116.968 2.211 . . . . 0.0 116.968 172.242 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 -94.4 -52.44 4.34 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 119.369 -2.082 . . . . 0.0 113.374 110.645 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 20.7 mt -68.15 -19.57 64.81 Favored 'General case' 0 CA--C 1.576 1.974 0 N-CA-C 117.145 2.276 . . . . 0.0 117.145 -164.374 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.471 HG22 ' HA ' ' A' ' 63' ' ' SER . 26.4 m . . . . . 0 N--CA 1.51 2.533 0 N-CA-C 117.439 2.385 . . . . 0.0 117.439 159.487 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.559 1.289 0 N-CA-C 113.649 0.981 . . . . 0.0 113.649 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 2' ' ' ARG . . . . . . . . . . . . . 25.6 ptt180 -81.01 88.13 5.96 Favored 'General case' 0 CA--C 1.567 1.624 0 CA-C-O 122.243 1.02 . . . . 0.0 112.405 171.928 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -117.66 74.89 0.96 Allowed 'General case' 0 CA--C 1.567 1.62 0 O-C-N 120.239 -1.538 . . . . 0.0 107.009 160.793 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 4' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -104.55 152.42 39.38 Favored Pre-proline 0 CA--C 1.56 1.358 1 O-C-N 115.861 -4.275 . . . . 0.0 111.341 42.678 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 21.7 Cg_exo -64.77 -172.25 0.19 Allowed 'Trans proline' 0 CA--C 1.572 2.412 0 C-N-CA 122.714 2.276 . . . . 0.0 115.921 158.51 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 6' ' ' HIS . . . . . . . . . . . . . 80.1 m80 -96.02 145.52 25.38 Favored 'General case' 0 CA--C 1.581 2.153 0 CA-C-N 113.154 -1.839 . . . . 0.0 111.287 177.978 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 7' ' ' PHE . . . . . 0.752 ' CZ ' HD12 ' A' ' 34' ' ' LEU . 2.3 p90 -128.93 162.46 27.51 Favored 'General case' 0 CA--C 1.574 1.868 0 O-C-N 119.188 -2.195 . . . . 0.0 112.838 144.108 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 8' ' ' ASN . . . . . . . . . . . . . 7.9 p-10 -64.05 103.54 0.61 Allowed 'General case' 0 CA--C 1.572 1.789 0 O-C-N 120.153 -1.592 . . . . 0.0 115.134 171.646 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 9' ' ' PHE . . . . . 0.633 ' CG ' HD13 ' A' ' 34' ' ' LEU . 3.7 t80 -126.02 105.72 9.1 Favored 'General case' 0 CA--C 1.539 0.543 0 O-C-N 120.971 -1.08 . . . . 0.0 108.135 160.88 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 10' ' ' ARG . . . . . . . . . . . . 0.467 0.1 OUTLIER 94.64 87.39 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.596 1 O-C-N 114.081 -5.387 . . . . 0.0 109.519 -12.543 . . . . . . . . 4 3 . 1 . 005 nuclear build full ' B' B ' 11' ' ' MET . . . . . 0.599 ' SD ' HD23 ' B' ' 19' ' ' LEU . 8.5 mtm -148.84 123.85 4.94 Favored Pre-proline 0 CA--C 1.566 1.568 0 CA-C-O 117.152 -1.404 . . . . 0.0 110.201 -159.133 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 12' ' ' PRO . . . . . . . . . . . . . 77.9 Cg_exo -40.76 143.16 0.62 Allowed 'Trans proline' 0 C--N 1.371 1.76 0 C-N-CA 123.467 2.778 . . . . 0.0 116.935 162.688 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 13' ' ' MET . . . . . 0.417 ' SD ' ' HG3' ' B' ' 17' ' ' GLU . 15.4 tpp -56.35 -32.47 64.74 Favored 'General case' 0 N--CA 1.493 1.691 0 N-CA-C 118.449 2.759 . . . . 0.0 118.449 -160.712 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 14' ' ' GLU . . . . . . . . . . . . 0.281 10.3 pt-20 -60.47 -50.92 71.64 Favored 'General case' 0 N--CA 1.49 1.534 0 N-CA-C 115.87 1.804 . . . . 0.0 115.87 162.36 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 15' ' ' VAL . . . . . 0.471 HG21 HD22 ' A' ' 35' ' ' LEU . 0.2 OUTLIER -58.35 -45.21 89.57 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.265 0 CA-C-N 122.924 2.602 . . . . 0.0 113.972 177.854 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 1.1 ttt180 -74.98 -34.4 61.99 Favored 'General case' 0 CA--C 1.544 0.727 0 CA-C-O 115.912 -1.994 . . . . 0.0 116.099 173.709 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 17' ' ' GLU . . . . . 0.417 ' HG3' ' SD ' ' B' ' 13' ' ' MET . 43.4 mt-10 -63.61 -39.37 94.2 Favored 'General case' 0 N--CA 1.497 1.886 0 CA-C-N 124.206 3.185 . . . . 0.0 114.052 161.632 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 44.5 mtmt -61.52 -60.55 3.52 Favored 'General case' 0 CA--C 1.568 1.641 0 CA-C-N 120.572 1.533 . . . . 0.0 114.199 169.913 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 19' ' ' LEU . . . . . 0.607 HD21 ' HG ' ' B' ' 34' ' ' LEU . 13.9 tp -60.86 -37.72 83.1 Favored 'General case' 0 N--CA 1.488 1.469 0 N-CA-C 115.249 1.574 . . . . 0.0 115.249 175.324 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 20' ' ' LYS . . . . . . . . . . . . . 19.8 ttpt -85.51 -30.87 23.09 Favored 'General case' 0 CA--C 1.561 1.366 0 CA-C-O 117.242 -1.361 . . . . 0.0 114.252 179.949 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 20.9 m-30 -64.91 -77.04 0.06 Allowed 'General case' 0 N--CA 1.491 1.598 0 CA-C-O 113.193 -3.289 . . . . 0.0 109.668 157.62 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 22' ' ' ARG . . . . . 0.514 ' HE ' HD12 ' B' ' 37' ' ' ILE 0.316 0.0 OUTLIER -19.89 -53.44 0.01 OUTLIER 'General case' 0 CA--C 1.585 2.327 0 CA-C-N 125.776 3.898 . . . . 0.0 116.39 171.022 . . . . . . . . 4 4 . 1 . 005 nuclear build full ' B' B ' 23' ' ' ALA . . . . . 0.498 ' HB2' ' CB ' ' B' ' 33' ' ' GLU . . . -51.85 -80.63 0.01 OUTLIER 'General case' 0 CA--C 1.587 2.395 0 N-CA-C 118.978 2.955 . . . . 0.0 118.978 154.966 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 64.3 mm-40 -65.34 -35.28 80.5 Favored 'General case' 0 N--CA 1.501 2.099 0 N-CA-C 119.123 3.009 . . . . 0.0 119.123 -179.546 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 25' ' ' ALA . . . . . . . . . . . . . . . -39.25 -50.25 1.95 Allowed 'General case' 0 CA--C 1.588 2.43 0 N-CA-C 116.288 1.958 . . . . 0.0 116.288 153.38 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 26' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -95.65 -47.14 6.33 Favored 'General case' 0 CA--C 1.576 1.951 0 N-CA-C 116.592 2.071 . . . . 0.0 116.592 -174.059 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 27' ' ' GLY . . . . . . . . . . . . . . . 128.29 14.86 2.35 Favored Glycine 0 N--CA 1.498 2.822 0 N-CA-C 119.024 2.37 . . . . 0.0 119.024 -161.227 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 28' ' ' ARG . . . . . . . . . . . . . 79.0 mtm-85 -112.26 149.23 32.63 Favored 'General case' 0 N--CA 1.492 1.643 0 N-CA-C 104.779 -2.304 . . . . 0.0 104.779 168.766 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 29' ' ' SER . . . . . . . . . . . . . 92.3 p -117.93 109.58 16.68 Favored 'General case' 0 N--CA 1.503 2.185 0 O-C-N 118.053 -2.905 . . . . 0.0 105.786 -167.89 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 30' ' ' MET . . . . . . . . . . . . . 18.5 mtp -42.35 -42.73 3.27 Favored 'General case' 0 N--CA 1.499 1.985 0 N-CA-C 118.8 2.889 . . . . 0.0 118.8 -140.457 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 31' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -47.02 -42.63 18.53 Favored 'General case' 0 CA--C 1.592 2.586 0 CA-C-N 125.727 3.876 . . . . 0.0 115.556 165.444 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 32' ' ' SER . . . . . . . . . . . . 0.294 32.1 t -53.33 -67.8 0.23 Allowed 'General case' 0 N--CA 1.499 2.002 0 N-CA-C 119.048 2.981 . . . . 0.0 119.048 144.829 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 33' ' ' GLU . . . . . 0.498 ' CB ' ' HB2' ' B' ' 23' ' ' ALA . 0.1 OUTLIER -62.36 -59.85 4.4 Favored 'General case' 0 N--CA 1.513 2.687 0 CA-C-N 124.112 3.142 . . . . 0.0 117.066 -178.569 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 34' ' ' LEU . . . . . 0.809 HD12 ' CZ ' ' A' ' 7' ' ' PHE . 0.1 OUTLIER -34.74 -56.96 0.54 Allowed 'General case' 0 CA--C 1.547 0.832 0 CA-C-O 115.413 -2.232 . . . . 0.0 109.61 164.426 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 35' ' ' LEU . . . . . 0.412 ' HA ' HD23 ' B' ' 35' ' ' LEU . 10.1 mt -61.55 -49.28 77.31 Favored 'General case' 0 C--N 1.367 1.359 0 CA-C-N 123.145 2.702 . . . . 0.0 116.164 177.055 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 36' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -54.92 -52.88 61.58 Favored 'General case' 0 CA--C 1.574 1.901 0 CA-C-O 116.874 -1.536 . . . . 0.0 114.026 173.95 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 37' ' ' ILE . . . . . 0.514 HD12 ' HE ' ' B' ' 22' ' ' ARG . 4.3 tt -64.29 -30.71 50.88 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.861 0 CA-C-N 122.546 2.43 . . . . 0.0 115.957 168.821 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 38' ' ' VAL . . . . . 0.538 HG13 HD22 ' A' ' 19' ' ' LEU . 3.5 t -73.96 -46.75 45.19 Favored 'Isoleucine or valine' 0 CA--C 1.575 1.923 0 CA-C-N 121.441 1.928 . . . . 0.0 110.967 -179.71 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 31.2 mt-30 -52.08 -43.07 63.68 Favored 'General case' 0 CA--C 1.572 1.801 0 N-CA-C 114.13 1.159 . . . . 0.0 114.13 155.413 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 40' ' ' ASP . . . . . . . . . . . . 0.385 15.6 m-20 -53.53 -42.01 66.99 Favored 'General case' 0 N--CA 1.495 1.817 0 N-CA-C 116.782 2.141 . . . . 0.0 116.782 156.055 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 41' ' ' ALA . . . . . 0.505 ' HB3' ' HA ' ' B' ' 38' ' ' VAL . . . -70.34 -38.2 74.82 Favored 'General case' 0 CA--C 1.562 1.427 0 N-CA-C 115.27 1.581 . . . . 0.0 115.27 -171.609 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 42' ' ' LEU . . . . . 0.493 HD11 ' HB2' ' A' ' 19' ' ' LEU . 3.8 mt -85.52 -35.88 20.85 Favored 'General case' 0 CA--C 1.565 1.535 0 C-N-CA 125.635 1.574 . . . . 0.0 114.258 174.066 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 43' ' ' SER . . . . . . . . . . . . . 47.6 t -61.53 -61.76 2.3 Favored 'General case' 0 N--CA 1.497 1.875 0 N-CA-C 114.673 1.36 . . . . 0.0 114.673 164.742 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 44' ' ' LYS . . . . . . . . . . . . 0.533 6.8 mtmp? 96.8 -72.42 0.0 OUTLIER Pre-proline 0 CA--C 1.582 2.198 0 N-CA-C 116.327 1.973 . . . . 0.0 116.327 179.871 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 79.8 Cg_endo -88.75 139.46 3.92 Favored 'Trans proline' 0 CA--C 1.563 1.975 0 CA-C-N 125.253 2.912 . . . . 0.0 116.775 -163.538 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 46' ' ' SER . . . . . . . . . . . . . 26.5 t -85.25 147.78 48.28 Favored Pre-proline 0 CA--C 1.582 2.206 0 O-C-N 120.177 -1.577 . . . . 0.0 110.756 114.112 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 84.9 Cg_endo -73.98 71.07 4.32 Favored 'Trans proline' 0 CA--C 1.573 2.428 0 CA-C-N 123.844 2.409 . . . . 0.0 115.72 -179.325 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 48' ' ' VAL . . . . . . . . . . . . . 8.2 p -165.97 120.17 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.644 0 N-CA-C 108.162 -1.051 . . . . 0.0 108.162 -169.513 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 49' ' ' THR . . . . . . . . . . . . . 76.7 p -129.02 57.13 1.65 Allowed 'General case' 0 N--CA 1.505 2.281 0 CA-C-O 122.22 1.009 . . . . 0.0 113.164 -179.207 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 50' ' ' GLY . . . . . . . . . . . . . . . -99.53 36.33 4.14 Favored Glycine 0 N--CA 1.497 2.764 0 N-CA-C 117.723 1.849 . . . . 0.0 117.723 173.144 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 51' ' ' TYR . . . . . . . . . . . . 0.25 0.0 OUTLIER -135.85 13.95 3.38 Favored 'General case' 0 CA--C 1.584 2.286 0 N-CA-C 115.884 1.809 . . . . 0.0 115.884 -172.907 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 52' ' ' ARG . . . . . . . . . . . . 0.779 11.6 mpt_? 102.22 -23.06 0.02 OUTLIER 'General case' 0 CA--C 1.621 3.689 1 N-CA-C 128.49 6.478 . . . . 0.0 128.49 169.76 . . . . . . . . 3 2 . 1 . 005 nuclear build full ' B' B ' 53' ' ' ASN . . . . . 0.686 ' C ' ' HB3' ' B' ' 55' ' ' ALA 0.596 0.0 OUTLIER -176.23 -161.1 0.07 Allowed 'General case' 0 N--CA 1.503 2.213 2 O-C-N 106.107 -10.371 . . . . 0.0 121.428 -12.276 . . . . . . . . 5 4 . 1 . 005 nuclear build full ' B' B ' 54' ' ' ASP . . . . . 0.471 ' HA ' ' HB2' ' B' ' 57' ' ' ARG 0.585 0.0 OUTLIER -64.9 -4.86 4.95 Favored 'General case' 0 N--CA 1.506 2.339 1 CA-C-N 126.205 4.093 . . . . 0.0 117.386 175.22 . . . . . . . . 5 4 . 1 . 005 nuclear build full ' B' B ' 55' ' ' ALA . . . . . 0.686 ' HB3' ' C ' ' B' ' 53' ' ' ASN 0.347 . . -0.59 -131.0 0.0 OUTLIER 'General case' 0 CA--C 1.566 1.582 1 N-CA-C 124.543 5.016 . . . . 0.0 124.543 108.752 . . . . . . . . 4 3 . 1 . 005 nuclear build full ' B' B ' 56' ' ' GLU . . . . . 0.596 ' O ' ' HB3' ' B' ' 59' ' ' ALA 0.299 6.6 tp10 -38.79 -25.69 0.01 OUTLIER 'General case' 0 CA--C 1.583 2.247 0 N-CA-C 119.582 3.179 . . . . 0.0 119.582 155.641 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 57' ' ' ARG . . . . . 0.471 ' HB2' ' HA ' ' B' ' 54' ' ' ASP . 0.2 OUTLIER -94.46 -31.62 13.88 Favored 'General case' 0 CA--C 1.564 1.481 0 O-C-N 119.047 -2.283 . . . . 0.0 110.165 -176.788 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 58' ' ' LEU . . . . . 0.425 ' HA ' ' H ' ' B' ' 61' ' ' GLU 0.626 89.5 mt -89.09 0.37 56.76 Favored 'General case' 0 CA--C 1.592 2.594 0 O-C-N 118.051 -2.905 . . . . 0.0 115.751 157.496 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 59' ' ' ALA . . . . . 0.596 ' HB3' ' O ' ' B' ' 56' ' ' GLU . . . -56.17 -39.02 71.7 Favored 'General case' 0 N--CA 1.485 1.295 0 O-C-N 117.422 -3.299 . . . . 0.0 117.762 133.003 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 60' ' ' ASP . . . . . 0.461 ' HA ' ' HB2' ' B' ' 63' ' ' SER . 11.8 t70 -56.57 -27.8 58.72 Favored 'General case' 0 N--CA 1.508 2.472 0 CA-C-N 123.532 2.878 . . . . 0.0 117.22 158.389 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 61' ' ' GLU . . . . . 0.489 ' OE1' HD21 ' B' ' 65' ' ' LEU 0.42 0.5 OUTLIER -53.8 -65.62 0.54 Allowed 'General case' 0 N--CA 1.494 1.737 0 CA-C-O 116.305 -1.807 . . . . 0.0 111.251 154.782 . . . . . . . . 4 4 . 1 . 005 nuclear build full ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 4.4 tp-100 -60.22 -55.59 31.94 Favored 'General case' 0 CA--C 1.57 1.726 0 CA-C-N 122.798 2.545 . . . . 0.0 112.906 -174.662 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 63' ' ' SER . . . . . 0.49 ' HA ' ' CG1' ' B' ' 66' ' ' VAL . 23.8 m -9.69 -64.51 0.0 OUTLIER 'General case' 0 N--CA 1.506 2.354 1 N-CA-C 124.262 4.912 . . . . 0.0 124.262 150.829 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 64' ' ' GLU . . . . . 0.47 ' HB3' ' HD3' ' A' ' 28' ' ' ARG 0.399 66.8 mt-10 -93.85 8.44 41.17 Favored 'General case' 0 CA--C 1.591 2.548 0 CA-C-N 115.625 -0.716 . . . . 0.0 111.62 -179.883 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 65' ' ' LEU . . . . . 0.489 HD21 ' OE1' ' B' ' 61' ' ' GLU . 0.0 OUTLIER -105.69 22.37 15.66 Favored 'General case' 0 CA--C 1.61 3.287 0 C-N-CA 127.398 2.279 . . . . 0.0 112.634 144.53 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 66' ' ' VAL . . . . . 0.49 ' CG1' ' HA ' ' B' ' 63' ' ' SER . 1.0 OUTLIER . . . . . 0 N--CA 1.507 2.384 0 C-N-CA 127.743 2.417 . . . . 0.0 108.033 -171.336 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.564 1.505 0 N-CA-C 114.031 1.122 . . . . 0.0 114.031 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 1.1 mpm_? -84.51 69.38 10.56 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 120.614 -1.304 . . . . 0.0 114.074 -168.627 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 9.1 p-10 -148.38 63.09 1.09 Allowed 'General case' 0 N--CA 1.491 1.589 0 O-C-N 120.944 -1.097 . . . . 0.0 109.495 -178.597 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 6.7 p-10 -144.89 81.18 10.9 Favored Pre-proline 0 CA--C 1.567 1.601 0 O-C-N 121.078 -1.014 . . . . 0.0 111.155 176.078 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 5.5 Cg_exo -100.19 146.1 0.39 Allowed 'Trans proline' 0 C--N 1.366 1.476 0 C-N-CA 122.065 1.844 . . . . 0.0 112.618 -160.58 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 66.1 m80 -68.31 146.79 52.96 Favored 'General case' 0 N--CA 1.485 1.294 0 N-CA-C 114.415 1.265 . . . . 0.0 114.415 -179.971 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' PHE . . . . . 0.846 ' CZ ' HD12 ' B' ' 34' ' ' LEU . 20.2 p90 -138.62 160.12 40.4 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 120.918 -1.114 . . . . 0.0 112.336 135.275 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 21.1 m120 -55.22 100.81 0.04 OUTLIER 'General case' 0 CA--C 1.572 1.808 0 N-CA-C 114.869 1.433 . . . . 0.0 114.869 174.168 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' PHE . . . . . 0.643 ' CD2' HD13 ' B' ' 34' ' ' LEU . 10.1 t80 -130.97 103.78 6.74 Favored 'General case' 0 C--N 1.34 0.179 0 N-CA-C 106.685 -1.598 . . . . 0.0 106.685 165.479 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . 0.495 0.0 OUTLIER 88.42 68.66 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.691 1 O-C-N 114.367 -5.208 . . . . 0.0 112.533 -9.774 . . . . . . . . 4 3 . 1 . 006 nuclear build full ' A' A ' 11' ' ' MET . . . . . 0.611 ' SD ' HD23 ' A' ' 19' ' ' LEU . 8.4 ptp -144.02 116.77 5.71 Favored Pre-proline 0 CA--C 1.571 1.779 0 CA-C-O 115.114 -2.374 . . . . 0.0 109.27 -164.545 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 63.3 Cg_exo -34.69 143.94 0.06 OUTLIER 'Trans proline' 0 C--N 1.379 2.176 0 C-N-CA 124.667 3.578 . . . . 0.0 119.631 -172.564 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' MET . . . . . 0.408 ' SD ' ' HG3' ' A' ' 17' ' ' GLU . 4.4 tpp -44.35 -41.59 6.2 Favored 'General case' 0 CA--C 1.581 2.141 0 N-CA-C 116.598 2.073 . . . . 0.0 116.598 -161.042 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -63.43 -44.29 95.01 Favored 'General case' 0 CA--C 1.571 1.788 0 N-CA-C 117.379 2.363 . . . . 0.0 117.379 167.979 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 1.6 t -54.56 -45.15 71.21 Favored 'Isoleucine or valine' 0 N--CA 1.513 2.705 0 CA-C-N 122.935 2.607 . . . . 0.0 113.301 169.63 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 7.1 ttt180 -74.87 -43.25 55.43 Favored 'General case' 0 C--O 1.212 -0.918 0 CA-C-O 116.107 -1.902 . . . . 0.0 115.093 174.908 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.408 ' HG3' ' SD ' ' A' ' 13' ' ' MET . 47.9 mt-10 -58.26 -32.1 68.05 Favored 'General case' 0 N--CA 1.493 1.681 0 CA-C-N 124.126 3.148 . . . . 0.0 115.266 163.296 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . 0.292 54.1 mtmt -67.82 -54.0 22.52 Favored 'General case' 0 CA--C 1.564 1.516 0 CA-C-N 121.112 1.778 . . . . 0.0 114.737 166.182 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.663 HD21 ' HG ' ' A' ' 34' ' ' LEU 0.288 14.9 tp -67.08 -33.84 76.37 Favored 'General case' 0 CA--C 1.574 1.874 0 N-CA-C 115.254 1.576 . . . . 0.0 115.254 175.632 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.496 ' HB2' ' SD ' ' A' ' 30' ' ' MET . 15.0 ttpt -91.71 -28.58 17.34 Favored 'General case' 0 CA--C 1.555 1.162 0 C-N-CA 126.788 2.035 . . . . 0.0 114.143 -178.671 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 22.1 m-30 -63.18 -71.21 0.17 Allowed 'General case' 0 N--CA 1.49 1.526 0 CA-C-O 113.265 -3.255 . . . . 0.0 109.383 153.841 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . 0.304 0.0 OUTLIER -25.09 -53.35 0.04 OUTLIER 'General case' 0 CA--C 1.587 2.399 0 CA-C-N 125.71 3.868 . . . . 0.0 116.158 171.393 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.524 ' HB2' ' HB3' ' A' ' 33' ' ' GLU . . . -50.61 -79.22 0.02 OUTLIER 'General case' 0 CA--C 1.585 2.296 0 N-CA-C 119.806 3.261 . . . . 0.0 119.806 154.557 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 75.2 mm-40 -69.67 -33.86 73.17 Favored 'General case' 0 N--CA 1.499 2.007 0 N-CA-C 118.809 2.892 . . . . 0.0 118.809 -177.251 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -40.72 -48.73 3.02 Favored 'General case' 0 CA--C 1.584 2.257 0 N-CA-C 116.307 1.965 . . . . 0.0 116.307 152.72 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . 0.254 0.0 OUTLIER -98.51 -40.04 8.44 Favored 'General case' 0 CA--C 1.577 1.988 0 N-CA-C 117.416 2.376 . . . . 0.0 117.416 -172.097 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 137.83 6.22 1.55 Allowed Glycine 0 N--CA 1.5 2.919 0 N-CA-C 120.368 2.907 . . . . 0.0 120.368 -168.595 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.464 HH12 HG11 ' B' ' 66' ' ' VAL . 32.4 mtm-85 -116.83 165.78 12.91 Favored 'General case' 0 N--CA 1.492 1.653 0 CA-C-N 120.989 2.394 . . . . 0.0 108.17 173.885 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 8.6 t -123.76 116.78 23.57 Favored 'General case' 0 N--CA 1.496 1.841 0 N-CA-C 105.206 -2.146 . . . . 0.0 105.206 -177.952 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' MET . . . . . 0.496 ' SD ' ' HB2' ' A' ' 20' ' ' LYS . 13.2 mtp -43.38 -42.57 4.7 Favored 'General case' 0 N--CA 1.497 1.908 0 N-CA-C 119.101 3.0 . . . . 0.0 119.101 -143.886 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . 0.258 0.1 OUTLIER -48.09 -41.97 27.65 Favored 'General case' 0 CA--C 1.592 2.594 0 CA-C-N 125.255 3.661 . . . . 0.0 114.957 166.522 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . 0.333 34.8 t -52.6 -64.04 0.95 Allowed 'General case' 0 N--CA 1.499 2.005 0 N-CA-C 120.507 3.521 . . . . 0.0 120.507 145.569 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 33' ' ' GLU . . . . . 0.524 ' HB3' ' HB2' ' A' ' 23' ' ' ALA . 2.8 tp10 -72.48 -53.24 12.66 Favored 'General case' 0 N--CA 1.512 2.639 0 CA-C-N 123.461 2.846 . . . . 0.0 117.852 -177.523 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.663 ' HG ' HD21 ' A' ' 19' ' ' LEU . 0.2 OUTLIER -38.47 -54.18 1.5 Allowed 'General case' 0 CA--C 1.554 1.133 0 CA-C-O 115.773 -2.06 . . . . 0.0 109.429 162.097 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.518 HD21 ' HG2' ' B' ' 11' ' ' MET . 15.1 mt -63.38 -54.96 28.66 Favored 'General case' 0 C--N 1.37 1.481 0 CA-C-N 123.51 2.868 . . . . 0.0 114.935 176.398 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -52.4 -44.32 65.29 Favored 'General case' 0 CA--C 1.564 1.512 0 CA-C-O 116.818 -1.563 . . . . 0.0 115.04 175.868 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -68.58 -41.08 82.71 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.533 0 CA-C-N 121.946 2.157 . . . . 0.0 114.532 169.928 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.407 HG21 HD22 ' A' ' 34' ' ' LEU . 3.8 t -71.76 -46.24 62.37 Favored 'Isoleucine or valine' 0 CA--C 1.583 2.218 0 CA-C-N 121.393 1.906 . . . . 0.0 111.241 -178.108 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 26.5 mt-30 -51.8 -43.05 62.92 Favored 'General case' 0 N--CA 1.488 1.465 0 C-N-CA 124.65 1.18 . . . . 0.0 114.134 156.261 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' ASP . . . . . 0.629 ' O ' HD23 ' B' ' 58' ' ' LEU 0.459 24.2 m-20 -46.5 -56.47 5.93 Favored 'General case' 0 N--CA 1.488 1.461 0 N-CA-C 114.225 1.195 . . . . 0.0 114.225 155.622 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . 0.362 . . -83.35 -39.71 20.38 Favored 'General case' 0 CA--C 1.543 0.704 0 N-CA-C 118.526 2.787 . . . . 0.0 118.526 -154.634 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.487 HD13 ' HB3' ' B' ' 18' ' ' LYS . 1.4 pp -102.08 -0.8 32.88 Favored 'General case' 0 CA--C 1.563 1.457 0 N-CA-C 117.841 2.534 . . . . 0.0 117.841 159.706 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 26.8 t -126.39 -7.15 6.39 Favored 'General case' 0 N--CA 1.496 1.842 0 CA-C-N 123.521 2.873 . . . . 0.0 118.697 178.873 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . 0.334 4.2 tmmm? -93.01 -53.04 0.26 Allowed Pre-proline 0 N--CA 1.506 2.359 0 CA-C-N 123.833 3.015 . . . . 0.0 118.91 -168.346 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -89.42 147.86 5.23 Favored 'Trans proline' 0 CA--C 1.567 2.139 0 CA-C-N 124.894 2.783 . . . . 0.0 118.99 -157.613 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 86.8 p -74.83 128.89 84.5 Favored Pre-proline 0 N--CA 1.5 2.029 0 O-C-N 117.407 -3.308 . . . . 0.0 115.306 48.707 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 84.8 Cg_endo -76.61 -72.6 0.01 OUTLIER 'Trans proline' 0 CA--C 1.555 1.573 0 CA-C-N 122.943 2.087 . . . . 0.0 115.02 -167.976 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 6.8 p -161.48 -68.26 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.496 1.867 0 CA-C-N 110.017 -3.265 . . . . 0.0 108.016 166.829 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 11.2 t -80.04 26.04 0.36 Allowed 'General case' 0 CA--C 1.567 1.631 0 N-CA-C 119.204 3.039 . . . . 0.0 119.204 -179.63 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 67.8 -49.51 0.34 Allowed Glycine 0 CA--C 1.562 2.997 0 N-CA-C 118.782 2.273 . . . . 0.0 118.782 -167.802 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . 0.549 7.9 m-85 78.25 -35.17 0.19 Allowed 'General case' 0 N--CA 1.496 1.842 0 N-CA-C 120.954 3.687 . . . . 0.0 120.954 -177.715 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . 0.403 39.1 ttt180 112.3 -58.5 0.0 OUTLIER 'General case' 0 N--CA 1.508 2.458 0 C-N-CA 127.251 2.22 . . . . 0.0 116.515 -169.248 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 53' ' ' ASN . . . . . 0.446 ' H ' ' HB2' ' A' ' 56' ' ' GLU 0.399 58.3 m-80 -87.81 -59.02 2.36 Favored 'General case' 0 CA--C 1.564 1.513 2 O-C-N 112.497 -6.377 . . . . 0.0 118.191 22.555 . . . . . . . . 4 3 . 1 . 006 nuclear build full ' A' A ' 54' ' ' ASP . . . . . 0.671 ' HB2' ' H ' ' B' ' 54' ' ' ASP . 21.2 m-20 -92.67 60.36 3.46 Favored 'General case' 0 CA--C 1.556 1.188 2 O-C-N 109.575 -8.203 . . . . 0.0 114.693 6.067 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 55' ' ' ALA . . . . . 0.806 ' HA ' ' H ' ' A' ' 58' ' ' LEU 0.431 . . -74.68 -2.85 28.07 Favored 'General case' 0 CA--C 1.589 2.461 0 O-C-N 116.398 -3.939 . . . . 0.0 119.999 125.061 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.738 ' O ' ' HB3' ' A' ' 59' ' ' ALA . 1.8 tm-20 -53.05 -26.78 17.02 Favored 'General case' 0 CA--C 1.591 2.545 0 O-C-N 118.158 -2.839 . . . . 0.0 116.546 129.969 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.546 ' HB2' ' HB3' ' A' ' 54' ' ' ASP 0.383 4.8 mpt_? -79.38 -13.31 59.7 Favored 'General case' 0 CA--C 1.572 1.792 0 O-C-N 116.595 -3.815 . . . . 0.0 114.873 158.303 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.806 ' H ' ' HA ' ' A' ' 55' ' ' ALA 0.34 3.4 mp -75.06 3.1 9.08 Favored 'General case' 0 CA--C 1.609 3.223 0 O-C-N 116.536 -3.853 . . . . 0.0 115.51 144.401 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 59' ' ' ALA . . . . . 0.738 ' HB3' ' O ' ' A' ' 56' ' ' GLU . . . -71.49 -12.95 61.65 Favored 'General case' 0 N--CA 1.507 2.392 1 O-C-N 115.954 -4.216 . . . . 0.0 119.854 135.454 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 60' ' ' ASP . . . . . 0.485 ' HB3' ' O ' ' A' ' 57' ' ' ARG . 9.2 t70 -65.59 -26.14 67.71 Favored 'General case' 0 N--CA 1.524 3.228 0 O-C-N 118.231 -2.793 . . . . 0.0 118.513 138.111 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.597 ' H ' ' HA ' ' A' ' 58' ' ' LEU 0.606 42.3 mm-40 -58.73 -21.97 56.48 Favored 'General case' 0 CA--C 1.569 1.705 0 C-N-CA 116.889 -1.924 . . . . 0.0 113.998 150.119 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 62' ' ' GLN . . . . . 0.438 ' O ' HG13 ' A' ' 66' ' ' VAL 0.356 1.3 mp0 -68.35 -36.24 78.94 Favored 'General case' 0 N--CA 1.491 1.604 0 CA-C-N 123.667 2.939 . . . . 0.0 114.62 151.308 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 75.6 m -42.65 -54.06 4.18 Favored 'General case' 0 N--CA 1.532 3.671 1 CA-C-N 127.336 4.607 . . . . 0.0 117.465 168.677 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . 0.475 0.4 OUTLIER -31.95 -102.78 0.0 OUTLIER 'General case' 0 CA--C 1.587 2.388 0 N-CA-C 117.267 2.321 . . . . 0.0 117.267 133.969 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . 0.251 0.7 OUTLIER -76.71 49.39 0.62 Allowed 'General case' 0 CA--C 1.588 2.437 0 CA-C-N 124.153 3.16 . . . . 0.0 118.852 -174.021 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.438 HG13 ' O ' ' A' ' 62' ' ' GLN . 0.9 OUTLIER . . . . . 0 N--CA 1.5 2.029 0 C-N-CA 125.589 1.556 . . . . 0.0 107.636 173.347 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.557 1.224 0 N-CA-C 113.674 0.99 . . . . 0.0 113.674 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 2' ' ' ARG . . . . . . . . . . . . . 88.5 mtt180 -94.94 81.73 3.76 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.566 -0.709 . . . . 0.0 110.6 169.7 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . 0.292 5.2 p-10 -168.72 -39.96 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.611 0 N-CA-C 114.982 1.475 . . . . 0.0 114.982 178.162 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 4' ' ' ASP . . . . . . . . . . . . . 23.4 m-20 -109.14 113.87 58.53 Favored Pre-proline 0 CA--C 1.582 2.192 0 N-CA-C 115.684 1.735 . . . . 0.0 115.684 178.744 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 5' ' ' PRO . . . . . . . . . . . . 0.619 7.6 Cg_exo 52.93 -84.55 0.0 OUTLIER 'Trans proline' 0 N--CA 1.492 1.407 1 N-CA-C 126.262 5.447 . . . . 0.0 126.262 89.797 . . . . . . . . 3 2 . 1 . 006 nuclear build full ' B' B ' 6' ' ' HIS . . . . . . . . . . . . . 64.9 m80 -75.17 111.73 10.71 Favored 'General case' 0 CA--C 1.564 1.503 0 N-CA-C 115.508 1.67 . . . . 0.0 115.508 -149.396 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 7' ' ' PHE . . . . . 0.607 ' CZ ' HD12 ' A' ' 34' ' ' LEU 0.292 30.7 p90 -122.09 -166.22 1.37 Allowed 'General case' 0 CA--C 1.563 1.462 0 O-C-N 120.35 -1.469 . . . . 0.0 108.919 128.772 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 8' ' ' ASN . . . . . . . . . . . . . 34.6 m-20 -116.09 105.65 12.85 Favored 'General case' 0 CA--C 1.555 1.166 0 O-C-N 120.102 -1.624 . . . . 0.0 107.37 166.598 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 9' ' ' PHE . . . . . 0.632 ' CE2' HD22 ' A' ' 34' ' ' LEU 0.25 5.0 t80 -71.75 92.72 1.22 Allowed 'General case' 0 CA--C 1.576 1.977 0 CA-C-O 126.676 3.131 . . . . 0.0 113.256 176.126 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 10' ' ' ARG . . . . . . . . . . . . . 28.5 ptt85 -81.9 130.14 34.98 Favored 'General case' 0 N--CA 1.48 1.05 1 CA-C-N 108.291 -4.05 . . . . 0.0 111.256 168.498 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 11' ' ' MET . . . . . 0.551 ' HE2' ' CD2' ' B' ' 9' ' ' PHE . 28.3 mtm -136.44 121.91 13.31 Favored Pre-proline 0 CA--C 1.565 1.527 0 CA-C-O 117.509 -1.234 . . . . 0.0 111.7 -163.703 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 12' ' ' PRO . . . . . . . . . . . . . 80.3 Cg_exo -43.66 145.03 1.95 Allowed 'Trans proline' 0 C--N 1.378 2.123 0 C-N-CA 123.913 3.076 . . . . 0.0 116.02 169.23 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 13' ' ' MET . . . . . . . . . . . . . 15.7 tpp -60.8 -34.06 73.93 Favored 'General case' 0 N--CA 1.492 1.655 0 N-CA-C 117.083 2.253 . . . . 0.0 117.083 -150.559 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -59.7 -49.31 78.23 Favored 'General case' 0 CA--C 1.573 1.861 0 N-CA-C 117.688 2.477 . . . . 0.0 117.688 161.335 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -58.28 -48.06 85.91 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.453 0 CA-C-N 123.369 2.804 . . . . 0.0 113.331 174.253 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 4.2 ttt180 -71.21 -37.23 72.08 Favored 'General case' 0 C--O 1.216 -0.703 0 CA-C-O 115.951 -1.976 . . . . 0.0 115.519 173.024 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 17' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -60.6 -35.81 77.02 Favored 'General case' 0 CA--C 1.569 1.709 0 CA-C-N 124.119 3.145 . . . . 0.0 114.185 161.578 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 18' ' ' LYS . . . . . 0.487 ' HB3' HD13 ' A' ' 42' ' ' LEU 0.291 44.1 mtmt -67.79 -48.71 65.54 Favored 'General case' 0 CA--C 1.566 1.574 0 CA-C-N 121.443 1.929 . . . . 0.0 115.483 169.55 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 19' ' ' LEU . . . . . 0.451 ' HB3' ' CE ' ' B' ' 30' ' ' MET 0.278 0.4 OUTLIER -70.49 -36.29 73.73 Favored 'General case' 0 CA--C 1.574 1.891 0 CA-C-N 120.904 1.684 . . . . 0.0 115.06 173.604 . . . . . . . . 4 4 . 1 . 006 nuclear build full ' B' B ' 20' ' ' LYS . . . . . 0.439 ' HB2' ' SD ' ' B' ' 30' ' ' MET . 15.8 ttpt -88.34 -27.89 21.35 Favored 'General case' 0 CA--C 1.555 1.168 0 C-N-CA 125.822 1.649 . . . . 0.0 113.682 178.729 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 22.1 m-30 -64.09 -72.89 0.13 Allowed 'General case' 0 N--CA 1.49 1.545 1 CA-C-O 111.469 -4.11 . . . . 0.0 109.598 156.052 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . 0.253 12.0 tpp180 -13.19 -61.04 0.01 OUTLIER 'General case' 0 CA--C 1.592 2.558 1 CA-C-N 127.07 4.487 . . . . 0.0 116.34 164.519 . . . . . . . . 3 2 . 1 . 006 nuclear build full ' B' B ' 23' ' ' ALA . . . . . 0.426 ' HB2' ' CB ' ' B' ' 33' ' ' GLU . . . -54.96 -75.86 0.03 OUTLIER 'General case' 0 CA--C 1.59 2.486 0 N-CA-C 119.29 3.07 . . . . 0.0 119.29 160.561 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 52.6 mt-10 -68.46 -34.77 76.54 Favored 'General case' 0 N--CA 1.504 2.263 0 N-CA-C 118.819 2.896 . . . . 0.0 118.819 -179.345 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 25' ' ' ALA . . . . . . . . . . . . . . . -38.31 -46.87 1.15 Allowed 'General case' 0 CA--C 1.579 2.062 0 N-CA-C 115.973 1.842 . . . . 0.0 115.973 152.321 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 26' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -98.66 -51.21 3.99 Favored 'General case' 0 CA--C 1.577 1.984 0 N-CA-C 117.458 2.392 . . . . 0.0 117.458 -173.651 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 27' ' ' GLY . . . . . . . . . . . . . . . 117.69 23.47 3.68 Favored Glycine 0 CA--C 1.563 3.082 0 N-CA-C 119.575 2.59 . . . . 0.0 119.575 -151.251 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 28' ' ' ARG . . . . . 0.517 HH21 ' HG3' ' B' ' 36' ' ' GLN . 16.8 mtt85 -112.47 147.44 36.52 Favored 'General case' 0 CA--C 1.572 1.821 0 N-CA-C 103.769 -2.678 . . . . 0.0 103.769 158.984 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 29' ' ' SER . . . . . . . . . . . . . 35.6 t -113.42 112.18 23.2 Favored 'General case' 0 N--CA 1.505 2.302 0 O-C-N 117.793 -3.067 . . . . 0.0 105.67 -172.884 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 30' ' ' MET . . . . . 0.451 ' CE ' ' HB3' ' B' ' 19' ' ' LEU . 22.7 mtp -40.65 -45.61 2.4 Favored 'General case' 0 N--CA 1.5 2.038 0 N-CA-C 118.822 2.897 . . . . 0.0 118.822 -144.364 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 31' ' ' ASN . . . . . . . . . . . . . 20.0 t-20 -44.44 -44.03 8.18 Favored 'General case' 0 CA--C 1.594 2.673 0 CA-C-N 125.494 3.77 . . . . 0.0 115.576 165.045 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 32' ' ' SER . . . . . . . . . . . . 0.279 56.3 m -57.36 -60.42 3.67 Favored 'General case' 0 N--CA 1.5 2.034 0 N-CA-C 120.7 3.593 . . . . 0.0 120.7 148.464 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 33' ' ' GLU . . . . . 0.426 ' CB ' ' HB2' ' B' ' 23' ' ' ALA . 0.1 OUTLIER -67.49 -61.64 1.8 Allowed 'General case' 0 N--CA 1.51 2.542 0 CA-C-N 123.666 2.939 . . . . 0.0 115.293 177.667 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 34' ' ' LEU . . . . . 0.846 HD12 ' CZ ' ' A' ' 7' ' ' PHE . 0.0 OUTLIER -32.17 -53.78 0.3 Allowed 'General case' 0 N--CA 1.481 1.091 0 CA-C-O 115.289 -2.291 . . . . 0.0 109.266 163.967 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 35' ' ' LEU . . . . . 0.59 HD21 ' HB2' ' A' ' 11' ' ' MET . 11.8 mt -62.28 -54.42 41.01 Favored 'General case' 0 C--N 1.368 1.382 0 CA-C-N 123.528 2.876 . . . . 0.0 115.053 176.275 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 36' ' ' GLN . . . . . 0.517 ' HG3' HH21 ' B' ' 28' ' ' ARG . 0.9 OUTLIER -59.86 -39.46 85.29 Favored 'General case' 0 CA--C 1.569 1.679 0 CA-C-O 116.302 -1.809 . . . . 0.0 115.582 175.479 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 37' ' ' ILE . . . . . 0.454 ' HA ' ' HB3' ' B' ' 40' ' ' ASP . 10.4 tt -68.55 -26.3 33.02 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.622 0 CA-C-N 123.452 2.842 . . . . 0.0 115.253 162.668 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 38' ' ' VAL . . . . . 0.507 ' CG1' HD22 ' A' ' 19' ' ' LEU . 4.3 t -86.68 -47.05 16.36 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.094 0 CA-C-N 125.037 3.562 . . . . 0.0 112.77 -178.891 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 27.8 mt-30 -46.07 -49.37 16.5 Favored 'General case' 0 N--CA 1.484 1.269 0 CA-C-O 116.119 -1.896 . . . . 0.0 113.068 150.961 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 40' ' ' ASP . . . . . 0.454 ' HB3' ' HA ' ' B' ' 37' ' ' ILE 0.374 50.1 t0 -44.01 -61.3 1.5 Allowed 'General case' 0 N--CA 1.494 1.76 0 CA-C-N 120.892 1.678 . . . . 0.0 114.638 154.533 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -82.62 19.21 1.33 Allowed 'General case' 0 CA--C 1.55 0.98 0 N-CA-C 120.556 3.539 . . . . 0.0 120.556 -162.39 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -147.78 -9.54 0.41 Allowed 'General case' 0 N--CA 1.484 1.232 0 N-CA-C 116.358 1.985 . . . . 0.0 116.358 143.772 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 43' ' ' SER . . . . . . . . . . . . . 86.7 p -149.56 10.62 0.75 Allowed 'General case' 0 N--CA 1.486 1.37 0 N-CA-C 118.144 2.646 . . . . 0.0 118.144 -163.071 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 44' ' ' LYS . . . . . . . . . . . . 0.313 7.6 tmtt? -32.36 -61.49 0.32 Allowed Pre-proline 0 N--CA 1.523 3.18 1 N-CA-C 125.042 5.201 . . . . 0.0 125.042 -159.05 . . . . . . . . 3 2 . 1 . 006 nuclear build full ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 12.4 Cg_endo -66.49 101.21 0.52 Allowed 'Trans proline' 0 CA--C 1.567 2.145 0 N-CA-C 120.709 3.311 . . . . 0.0 120.709 -136.881 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 46' ' ' SER . . . . . . . . . . . . . 69.7 m -69.2 140.52 90.7 Favored Pre-proline 0 CA--C 1.585 2.323 0 O-C-N 120.602 -1.311 . . . . 0.0 112.187 120.504 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -75.0 90.6 1.07 Allowed 'Trans proline' 0 CA--C 1.569 2.255 0 C-N-CA 122.545 2.163 . . . . 0.0 116.267 -166.491 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 48' ' ' VAL . . . . . . . . . . . . . 34.8 m -133.93 17.84 1.31 Allowed 'Isoleucine or valine' 0 N--CA 1.502 2.127 0 N-CA-C 118.4 2.741 . . . . 0.0 118.4 -178.246 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 49' ' ' THR . . . . . . . . . . . . . 61.2 p -145.3 96.9 2.91 Favored 'General case' 0 N--CA 1.496 1.858 2 O-C-N 109.269 -8.394 . . . . 0.0 109.846 11.844 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 50' ' ' GLY . . . . . . . . . . . . . . . -170.14 -93.0 0.09 OUTLIER Glycine 0 N--CA 1.488 2.151 0 CA-C-O 119.534 -0.592 . . . . 0.0 112.286 176.957 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 51' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -156.69 38.11 0.32 Allowed 'General case' 0 CA--C 1.586 2.329 2 O-C-N 115.237 -4.684 . . . . 0.0 113.498 -12.895 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 52' ' ' ARG . . . . . . . . . . . . . 33.1 ptt85 -84.8 141.54 30.42 Favored 'General case' 0 N--CA 1.505 2.28 0 O-C-N 119.72 -1.862 . . . . 0.0 115.081 -177.561 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 53' ' ' ASN . . . . . 0.458 ' HB2' ' H ' ' B' ' 55' ' ' ALA 0.77 0.6 OUTLIER -56.54 128.29 35.44 Favored 'General case' 0 N--CA 1.496 1.871 0 CA-C-N 122.211 2.278 . . . . 0.0 114.828 172.324 . . . . . . . . 4 4 . 1 . 006 nuclear build full ' B' B ' 54' ' ' ASP . . . . . 0.671 ' H ' ' HB2' ' A' ' 54' ' ' ASP 0.341 3.4 m-20 -101.11 48.03 0.9 Allowed 'General case' 0 CA--C 1.583 2.226 0 CA-C-O 126.984 3.278 . . . . 0.0 110.718 135.95 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 55' ' ' ALA . . . . . 0.897 ' HB1' HD22 ' B' ' 58' ' ' LEU 0.331 . . -87.01 -9.03 56.54 Favored 'General case' 0 CA--C 1.555 1.166 1 O-C-N 116.212 -4.055 . . . . 0.0 117.822 136.302 . . . . . . . . 4 3 . 1 . 006 nuclear build full ' B' B ' 56' ' ' GLU . . . . . 0.452 ' HA ' ' CB ' ' B' ' 59' ' ' ALA . 6.8 mm-40 -37.64 -14.65 0.0 OUTLIER 'General case' 0 CA--C 1.584 2.264 1 N-CA-C 124.572 5.027 . . . . 0.0 124.572 113.901 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 57' ' ' ARG . . . . . 0.631 ' H ' ' C ' ' B' ' 54' ' ' ASP . 0.1 OUTLIER -90.59 -44.17 9.72 Favored 'General case' 0 CA--C 1.565 1.536 0 O-C-N 119.297 -2.127 . . . . 0.0 114.798 155.618 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 58' ' ' LEU . . . . . 0.897 HD22 ' HB1' ' B' ' 55' ' ' ALA . 0.8 OUTLIER -42.2 -62.7 0.88 Allowed 'General case' 0 N--CA 1.527 3.394 0 CA-C-N 122.024 2.193 . . . . 0.0 115.708 164.984 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 59' ' ' ALA . . . . . 0.452 ' CB ' ' HA ' ' B' ' 56' ' ' GLU 0.374 . . -5.09 -76.92 0.0 OUTLIER 'General case' 0 CA--C 1.547 0.862 1 N-CA-C 124.717 5.08 . . . . 0.0 124.717 131.946 . . . . . . . . 4 3 . 1 . 006 nuclear build full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 6.0 t0 -60.32 -9.32 3.34 Favored 'General case' 0 CA--C 1.573 1.844 0 CA-C-N 124.744 3.429 . . . . 0.0 116.854 170.741 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 61.4 tt0 -70.75 -45.74 64.24 Favored 'General case' 0 N--CA 1.499 2.014 0 CA-C-N 122.984 2.629 . . . . 0.0 113.609 155.926 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 62' ' ' GLN . . . . . 0.661 ' O ' HG13 ' B' ' 66' ' ' VAL 0.289 0.3 OUTLIER -75.18 -66.17 0.79 Allowed 'General case' 0 N--CA 1.492 1.647 0 CA-C-N 122.316 2.325 . . . . 0.0 111.953 170.904 . . . . . . . . 4 4 . 1 . 006 nuclear build full ' B' B ' 63' ' ' SER . . . . . . . . . . . . 0.374 46.7 p -54.17 -5.02 0.06 Allowed 'General case' 0 CA--C 1.578 2.056 1 N-CA-C 122.081 4.104 . . . . 0.0 122.081 168.944 . . . . . . . . 3 2 . 1 . 006 nuclear build full ' B' B ' 64' ' ' GLU . . . . . . . . . . . . . 21.7 tt0 -95.16 -40.4 9.62 Favored 'General case' 0 N--CA 1.496 1.855 0 CA-C-N 124.409 3.277 . . . . 0.0 113.831 144.269 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 3.0 mp -105.88 46.22 0.93 Allowed 'General case' 0 N--CA 1.502 2.135 0 CA-C-N 122.14 2.246 . . . . 0.0 113.575 -173.655 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 66' ' ' VAL . . . . . 0.661 HG13 ' O ' ' B' ' 62' ' ' GLN . 2.6 m . . . . . 0 N--CA 1.505 2.318 0 C-N-CA 125.636 1.574 . . . . 0.0 111.795 173.916 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.562 1.421 0 N-CA-C 113.497 0.925 . . . . 0.0 113.497 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 89.5 mtm180 -80.3 74.48 7.13 Favored 'General case' 0 N--CA 1.496 1.87 0 CA-C-O 122.546 1.165 . . . . 0.0 113.49 -177.896 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 13.8 t70 -159.15 -41.56 0.06 Allowed 'General case' 0 N--CA 1.489 1.492 0 O-C-N 120.901 -1.124 . . . . 0.0 112.976 174.671 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -145.15 82.74 9.66 Favored Pre-proline 0 CA--C 1.57 1.717 0 O-C-N 120.531 -1.355 . . . . 0.0 108.12 162.594 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 5.7 Cg_exo -99.74 146.61 0.45 Allowed 'Trans proline' 0 C--N 1.366 1.473 0 CA-C-N 122.688 1.996 . . . . 0.0 113.782 -154.049 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 73.5 m80 -67.56 137.35 55.64 Favored 'General case' 0 CA--C 1.564 1.508 0 CA-C-N 114.377 -1.283 . . . . 0.0 113.383 173.031 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' PHE . . . . . 0.726 ' CZ ' HD12 ' B' ' 34' ' ' LEU 0.267 27.5 p90 -120.52 167.74 12.08 Favored 'General case' 0 CA--C 1.562 1.415 0 O-C-N 119.557 -1.965 . . . . 0.0 110.576 115.314 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 98.5 m-20 -89.99 90.87 8.34 Favored 'General case' 0 N--CA 1.487 1.411 0 O-C-N 119.695 -1.878 . . . . 0.0 108.059 166.365 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' PHE . . . . . 0.658 ' CD2' HD13 ' B' ' 34' ' ' LEU . 8.5 t80 -63.67 150.77 43.57 Favored 'General case' 0 CA--C 1.557 1.217 0 CA-C-O 125.457 2.551 . . . . 0.0 112.344 168.749 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -154.32 94.55 1.73 Allowed 'General case' 0 C--N 1.307 -1.28 0 CA-C-N 111.616 -2.538 . . . . 0.0 107.825 -139.539 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 11' ' ' MET . . . . . 0.504 ' SD ' ' CD2' ' A' ' 9' ' ' PHE . 0.8 OUTLIER -114.77 115.59 43.71 Favored Pre-proline 0 CA--C 1.56 1.352 0 CA-C-O 117.219 -1.372 . . . . 0.0 111.785 -158.796 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 80.8 Cg_exo -42.47 140.61 2.55 Favored 'Trans proline' 0 CA--C 1.56 1.81 0 C-N-CA 122.79 2.327 . . . . 0.0 115.772 161.233 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' MET . . . . . 0.409 ' SD ' ' HG3' ' A' ' 17' ' ' GLU . 22.9 tpp -55.68 -32.36 63.19 Favored 'General case' 0 N--CA 1.492 1.668 0 N-CA-C 118.376 2.732 . . . . 0.0 118.376 -157.671 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . 0.256 9.4 pt-20 -60.9 -46.49 90.45 Favored 'General case' 0 CA--C 1.568 1.66 0 N-CA-C 116.568 2.062 . . . . 0.0 116.568 162.186 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.432 ' CG1' HG12 ' B' ' 38' ' ' VAL . 0.6 OUTLIER -57.24 -49.6 79.35 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.234 0 CA-C-N 122.925 2.602 . . . . 0.0 112.82 172.7 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 1.4 ttt180 -72.39 -33.95 67.56 Favored 'General case' 0 C--O 1.216 -0.703 0 CA-C-O 116.086 -1.911 . . . . 0.0 115.433 175.39 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.409 ' HG3' ' SD ' ' A' ' 13' ' ' MET . 39.6 mt-10 -61.89 -40.32 95.01 Favored 'General case' 0 CA--C 1.566 1.563 0 CA-C-N 124.062 3.119 . . . . 0.0 114.53 161.093 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . 0.255 46.3 mtmt -67.92 -48.5 65.79 Favored 'General case' 0 CA--C 1.564 1.484 0 CA-C-N 121.577 1.989 . . . . 0.0 115.366 173.024 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.614 ' HB3' ' CE ' ' A' ' 30' ' ' MET 0.365 0.2 OUTLIER -68.16 -37.3 80.86 Favored 'General case' 0 CA--C 1.574 1.876 0 C-N-CA 124.791 1.236 . . . . 0.0 112.461 172.362 . . . . . . . . 4 4 . 1 . 007 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.523 ' HA ' ' HB3' ' A' ' 23' ' ' ALA . 27.8 ttpt -90.17 -22.83 21.52 Favored 'General case' 0 CA--C 1.567 1.612 0 O-C-N 119.155 -2.216 . . . . 0.0 115.382 179.534 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 21' ' ' PHE . . . . . 0.41 ' O ' ' HB3' ' A' ' 25' ' ' ALA . 14.8 m-85 -62.8 -68.02 0.37 Allowed 'General case' 0 N--CA 1.492 1.657 0 CA-C-O 114.009 -2.901 . . . . 0.0 110.511 151.88 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.417 ' HE ' HG13 ' A' ' 37' ' ' ILE 0.349 32.2 ttt85 -28.45 -45.19 0.03 OUTLIER 'General case' 0 CA--C 1.601 2.933 0 CA-C-N 125.682 3.856 . . . . 0.0 116.917 166.635 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.523 ' HB3' ' HA ' ' A' ' 20' ' ' LYS 0.288 . . -54.2 -80.29 0.02 OUTLIER 'General case' 0 CA--C 1.58 2.103 0 N-CA-C 118.111 2.634 . . . . 0.0 118.111 153.796 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 51.8 mm-40 -66.6 -36.93 83.79 Favored 'General case' 0 CA--C 1.578 2.049 0 N-CA-C 118.742 2.867 . . . . 0.0 118.742 -178.3 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.41 ' HB3' ' O ' ' A' ' 21' ' ' PHE . . . -42.6 -51.55 5.13 Favored 'General case' 0 CA--C 1.59 2.483 0 N-CA-C 116.399 2.0 . . . . 0.0 116.399 156.308 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 12.0 m120 -79.04 -47.12 16.78 Favored 'General case' 0 N--CA 1.501 2.104 0 N-CA-C 116.15 1.907 . . . . 0.0 116.15 173.749 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 113.52 35.61 1.56 Allowed Glycine 0 N--CA 1.499 2.884 0 N-CA-C 117.132 1.613 . . . . 0.0 117.132 -154.476 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 75.7 mtm180 -131.27 155.44 47.14 Favored 'General case' 0 CA--C 1.576 1.975 0 N-CA-C 104.308 -2.479 . . . . 0.0 104.308 177.721 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 77.3 p -126.03 109.85 12.88 Favored 'General case' 0 N--CA 1.509 2.508 0 O-C-N 117.47 -3.269 . . . . 0.0 107.654 -171.822 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' MET . . . . . 0.614 ' CE ' ' HB3' ' A' ' 19' ' ' LEU . 0.1 OUTLIER -45.56 -38.52 6.53 Favored 'General case' 0 N--CA 1.496 1.863 0 N-CA-C 120.265 3.432 . . . . 0.0 120.265 -137.739 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 11.0 t-20 -47.3 -46.51 25.14 Favored 'General case' 0 CA--C 1.597 2.771 0 CA-C-N 124.931 3.514 . . . . 0.0 114.411 163.808 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . 0.314 17.5 t -48.77 -76.22 0.02 OUTLIER 'General case' 0 N--CA 1.5 2.05 0 N-CA-C 117.582 2.438 . . . . 0.0 117.582 143.923 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 33' ' ' GLU . . . . . 0.458 ' HB3' ' HB2' ' A' ' 23' ' ' ALA . 10.6 tm-20 -60.74 -53.58 55.66 Favored 'General case' 0 N--CA 1.506 2.351 0 CA-C-N 123.559 2.89 . . . . 0.0 118.745 -172.104 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.644 HD13 ' CG ' ' B' ' 9' ' ' PHE . 0.2 OUTLIER -42.99 -53.98 4.49 Favored 'General case' 0 CA--C 1.567 1.618 0 CA-C-O 115.699 -2.096 . . . . 0.0 106.244 167.52 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.481 ' HG ' ' CE1' ' B' ' 9' ' ' PHE . 19.7 mt -62.93 -44.56 95.75 Favored 'General case' 0 C--N 1.375 1.701 0 CA-C-N 124.093 3.133 . . . . 0.0 115.759 177.545 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 36' ' ' GLN . . . . . 0.437 ' O ' ' HB2' ' A' ' 40' ' ' ASP . 0.0 OUTLIER -61.47 -44.46 97.06 Favored 'General case' 0 N--CA 1.48 1.046 0 CA-C-O 115.632 -2.128 . . . . 0.0 113.8 177.892 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 37' ' ' ILE . . . . . 0.417 HG13 ' HE ' ' A' ' 22' ' ' ARG . 0.4 OUTLIER -69.79 -35.12 63.74 Favored 'Isoleucine or valine' 0 CA--C 1.564 1.504 0 CA-C-N 121.278 1.853 . . . . 0.0 115.027 165.95 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.584 HG21 HD22 ' A' ' 34' ' ' LEU . 6.6 t -76.51 -46.56 31.55 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.839 0 CA-C-N 121.93 2.15 . . . . 0.0 111.641 -173.147 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 14.0 tp60 -62.61 -36.77 83.82 Favored 'General case' 0 CA--C 1.567 1.613 0 O-C-N 121.142 -0.974 . . . . 0.0 112.957 160.58 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' ASP . . . . . 0.437 ' HB2' ' O ' ' A' ' 36' ' ' GLN 0.446 0.3 OUTLIER -41.35 -53.4 3.3 Favored 'General case' 0 N--CA 1.502 2.164 0 N-CA-C 116.467 2.025 . . . . 0.0 116.467 149.101 . . . . . . . . 4 4 . 1 . 007 nuclear build full ' A' A ' 41' ' ' ALA . . . . . 0.408 ' HB3' ' HA ' ' A' ' 38' ' ' VAL . . . -77.85 -33.73 52.08 Favored 'General case' 0 CA--C 1.553 1.092 0 N-CA-C 118.031 2.604 . . . . 0.0 118.031 -164.722 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.42 HD21 ' HG ' ' B' ' 19' ' ' LEU 0.304 0.5 OUTLIER -125.81 22.61 7.43 Favored 'General case' 0 N--CA 1.488 1.466 0 N-CA-C 115.45 1.648 . . . . 0.0 115.45 172.452 . . . . . . . . 4 4 . 1 . 007 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 57.9 p -126.99 -50.58 1.45 Allowed 'General case' 0 N--CA 1.495 1.817 0 N-CA-C 117.098 2.258 . . . . 0.0 117.098 148.198 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . 0.296 80.3 tttt -69.55 -51.25 16.72 Favored Pre-proline 0 N--CA 1.505 2.303 0 N-CA-C 120.312 3.449 . . . . 0.0 120.312 -117.979 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -81.69 108.82 1.94 Allowed 'Trans proline' 0 CA--C 1.563 1.966 0 N-CA-C 119.186 2.725 . . . . 0.0 119.186 -155.728 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . 0.256 50.7 m -124.15 -80.75 0.0 OUTLIER Pre-proline 0 CA--C 1.571 1.76 0 CA-C-O 114.964 -2.446 . . . . 0.0 109.997 153.982 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 43.9 Cg_endo -79.55 63.47 8.73 Favored 'Trans proline' 0 CA--C 1.573 2.459 0 CA-C-N 126.788 3.46 . . . . 0.0 114.511 169.235 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 75.2 t -142.01 -52.15 0.22 Allowed 'Isoleucine or valine' 0 N--CA 1.499 1.982 0 CA-C-N 114.841 -1.072 . . . . 0.0 113.342 -157.78 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 12.2 t -150.13 149.13 29.82 Favored 'General case' 0 N--CA 1.497 1.875 2 O-C-N 112.751 -6.218 . . . . 0.0 114.264 18.54 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 96.39 -50.38 1.64 Allowed Glycine 0 N--CA 1.495 2.601 0 N-CA-C 119.261 2.465 . . . . 0.0 119.261 154.21 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -70.63 72.06 0.5 Allowed 'General case' 0 CA--C 1.576 1.945 0 N-CA-C 115.984 1.846 . . . . 0.0 115.984 -177.091 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -114.54 76.01 0.96 Allowed 'General case' 0 CA--C 1.587 2.375 0 N-CA-C 114.253 1.205 . . . . 0.0 114.253 -170.766 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 53' ' ' ASN . . . . . 0.436 ' O ' ' HB2' ' A' ' 56' ' ' GLU . 0.1 OUTLIER -147.8 155.45 41.68 Favored 'General case' 0 N--CA 1.487 1.378 1 O-C-N 112.579 -6.326 . . . . 0.0 117.967 -18.678 . . . . . . . . 4 4 . 1 . 007 nuclear build full ' A' A ' 54' ' ' ASP . . . . . 0.553 ' HB2' ' HB2' ' A' ' 57' ' ' ARG 2.253 1.1 p30 -73.0 27.77 0.06 Allowed 'General case' 0 N--CA 1.504 2.264 0 CA-C-N 121.7 2.046 . . . . 0.0 111.593 169.795 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . 0.307 . . -104.45 9.46 35.61 Favored 'General case' 0 CA--C 1.553 1.071 0 O-C-N 117.58 -3.2 . . . . 0.0 118.496 144.779 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.436 ' HB2' ' O ' ' A' ' 53' ' ' ASN . 41.9 mt-10 -48.92 -26.68 2.61 Favored 'General case' 0 CA--C 1.595 2.684 0 N-CA-C 118.986 2.958 . . . . 0.0 118.986 113.191 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.553 ' HB2' ' HB2' ' A' ' 54' ' ' ASP 0.316 2.5 tmt_? -83.16 -60.8 2.04 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 118.741 -2.474 . . . . 0.0 114.395 170.473 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.56 HD22 ' HA ' ' B' ' 41' ' ' ALA 0.35 4.2 pp -56.24 -27.54 55.35 Favored 'General case' 0 CA--C 1.577 1.994 0 N-CA-C 115.784 1.772 . . . . 0.0 115.784 169.751 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -43.6 -64.12 0.71 Allowed 'General case' 0 N--CA 1.484 1.252 0 N-CA-C 117.641 2.46 . . . . 0.0 117.641 145.354 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -68.27 -11.26 59.1 Favored 'General case' 0 N--CA 1.493 1.724 0 CA-C-N 122.733 2.515 . . . . 0.0 117.465 178.091 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 9.3 mm-40 -74.68 -56.72 4.5 Favored 'General case' 0 N--CA 1.483 1.196 0 O-C-N 120.876 -1.14 . . . . 0.0 111.201 170.623 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 62' ' ' GLN . . . . . 0.555 ' O ' HG13 ' A' ' 66' ' ' VAL 0.273 1.8 mm-40 -73.1 -62.16 1.56 Allowed 'General case' 0 C--N 1.355 0.828 0 CA-C-N 120.845 1.657 . . . . 0.0 112.972 169.427 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . 0.375 41.7 t -79.68 39.16 0.4 Allowed 'General case' 0 CA--C 1.581 2.163 0 N-CA-C 118.739 2.866 . . . . 0.0 118.739 172.341 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 8.0 mt-10 -98.37 -57.43 2.2 Favored 'General case' 0 N--CA 1.5 2.056 0 O-C-N 118.316 -2.74 . . . . 0.0 113.273 111.391 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.92 -39.21 93.65 Favored 'General case' 0 CA--C 1.568 1.664 0 N-CA-C 117.801 2.519 . . . . 0.0 117.801 -160.227 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.555 HG13 ' O ' ' A' ' 62' ' ' GLN 0.396 12.0 m . . . . . 0 N--CA 1.511 2.609 0 N-CA-C 120.073 3.361 . . . . 0.0 120.073 164.613 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.566 1.582 0 N-CA-C 116.263 1.949 . . . . 0.0 116.263 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 2' ' ' ARG . . . . . . . . . . . . 0.378 39.9 ptt180 44.7 46.98 8.75 Favored 'General case' 0 N--CA 1.502 2.14 0 N-CA-C 120.488 3.514 . . . . 0.0 120.488 -179.076 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -155.18 -51.39 0.09 Allowed 'General case' 0 N--CA 1.488 1.446 0 O-C-N 120.982 -1.074 . . . . 0.0 111.764 171.913 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 4' ' ' ASP . . . . . . . . . . . . 0.272 4.7 p-10 -137.66 87.33 17.46 Favored Pre-proline 0 CA--C 1.573 1.853 0 O-C-N 121.44 -0.788 . . . . 0.0 111.904 157.21 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 7.3 Cg_exo -95.41 145.9 1.38 Allowed 'Trans proline' 0 C--N 1.37 1.709 0 CA-C-N 122.636 1.977 . . . . 0.0 115.514 -161.254 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 6' ' ' HIS . . . . . . . . . . . . . 80.3 m80 -79.51 126.19 30.55 Favored 'General case' 0 CA--C 1.566 1.575 0 CA-C-N 113.99 -1.459 . . . . 0.0 112.277 175.278 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 7' ' ' PHE . . . . . 0.591 ' CZ ' HD12 ' A' ' 34' ' ' LEU . 0.8 OUTLIER -128.93 155.61 45.04 Favored 'General case' 0 CA--C 1.567 1.609 0 O-C-N 120.655 -1.278 . . . . 0.0 111.067 154.322 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 8' ' ' ASN . . . . . . . . . . . . . 6.7 p-10 -59.18 103.27 0.17 Allowed 'General case' 0 CA--C 1.575 1.904 0 N-CA-C 115.709 1.744 . . . . 0.0 115.709 171.15 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 9' ' ' PHE . . . . . 0.644 ' CG ' HD13 ' A' ' 34' ' ' LEU . 2.6 t80 -126.49 104.95 8.42 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 124.515 1.126 . . . . 0.0 108.557 158.365 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 10' ' ' ARG . . . . . . . . . . . . 0.472 34.8 tpt85 97.66 83.55 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.784 1 O-C-N 113.746 -5.596 . . . . 0.0 111.297 -19.161 . . . . . . . . 3 2 . 1 . 007 nuclear build full ' B' B ' 11' ' ' MET . . . . . 0.455 ' HG2' HD21 ' A' ' 35' ' ' LEU . 16.1 mtt -151.5 130.13 6.25 Favored Pre-proline 0 CA--C 1.567 1.621 0 CA-C-O 117.26 -1.352 . . . . 0.0 110.46 -155.842 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 12' ' ' PRO . . . . . . . . . . . . . 83.8 Cg_exo -43.92 147.87 1.16 Allowed 'Trans proline' 0 CA--C 1.559 1.734 0 C-N-CA 123.172 2.582 . . . . 0.0 117.971 168.101 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 13' ' ' MET . . . . . . . . . . . . . 2.0 tpt -47.27 -39.84 15.4 Favored 'General case' 0 CA--C 1.575 1.917 0 N-CA-C 117.867 2.543 . . . . 0.0 117.867 -166.393 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -63.85 -50.92 66.97 Favored 'General case' 0 N--CA 1.487 1.421 0 N-CA-C 116.722 2.119 . . . . 0.0 116.722 171.15 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 15' ' ' VAL . . . . . 0.466 HG12 HG12 ' A' ' 38' ' ' VAL . 0.0 OUTLIER -59.35 -51.15 76.04 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.612 0 CA-C-N 121.145 1.793 . . . . 0.0 113.65 176.522 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -67.0 -31.63 72.32 Favored 'General case' 0 CA--C 1.547 0.847 0 CA-C-O 115.987 -1.959 . . . . 0.0 116.266 170.811 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 17' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -60.23 -47.47 85.82 Favored 'General case' 0 N--CA 1.492 1.629 0 CA-C-N 123.775 2.989 . . . . 0.0 113.822 160.691 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . 0.671 3.9 pttt -72.13 -35.43 69.1 Favored 'General case' 0 CA--C 1.568 1.641 0 N-CA-C 118.359 2.726 . . . . 0.0 118.359 177.459 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 19' ' ' LEU . . . . . 0.646 ' HB3' ' HE1' ' B' ' 30' ' ' MET 0.361 0.4 OUTLIER -68.81 -40.13 79.7 Favored 'General case' 0 CA--C 1.587 2.37 0 O-C-N 120.753 -1.217 . . . . 0.0 113.637 164.568 . . . . . . . . 4 4 . 1 . 007 nuclear build full ' B' B ' 20' ' ' LYS . . . . . . . . . . . . . 28.8 ttpt -88.75 -30.39 19.09 Favored 'General case' 0 CA--C 1.56 1.358 0 O-C-N 120.135 -1.603 . . . . 0.0 115.09 -177.368 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 35.5 m-85 -58.52 -69.61 0.18 Allowed 'General case' 0 N--CA 1.49 1.526 0 CA-C-O 112.211 -3.757 . . . . 0.0 110.387 153.708 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . 0.295 23.5 ttt180 -21.99 -56.76 0.03 OUTLIER 'General case' 0 CA--C 1.589 2.46 1 CA-C-N 126.717 4.326 . . . . 0.0 116.579 168.219 . . . . . . . . 3 2 . 1 . 007 nuclear build full ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -51.99 -71.94 0.06 Allowed 'General case' 0 CA--C 1.575 1.927 0 N-CA-C 121.199 3.778 . . . . 0.0 121.199 157.544 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 66.7 mm-40 -73.25 -32.11 64.52 Favored 'General case' 0 N--CA 1.497 1.917 0 N-CA-C 118.019 2.6 . . . . 0.0 118.019 -177.996 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 25' ' ' ALA . . . . . . . . . . . . . . . -41.71 -48.36 4.17 Favored 'General case' 0 CA--C 1.578 2.023 0 N-CA-C 116.775 2.139 . . . . 0.0 116.775 151.462 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 26' ' ' ASN . . . . . . . . . . . . 0.253 0.1 OUTLIER -93.82 -41.2 9.77 Favored 'General case' 0 CA--C 1.581 2.169 0 N-CA-C 116.862 2.171 . . . . 0.0 116.862 -179.349 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 27' ' ' GLY . . . . . . . . . . . . . . . 113.94 49.98 0.52 Allowed Glycine 0 N--CA 1.497 2.72 0 N-CA-C 116.152 1.221 . . . . 0.0 116.152 -167.218 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 28' ' ' ARG . . . . . . . . . . . . . 5.2 ttt85 -156.24 86.95 1.03 Allowed 'General case' 0 N--CA 1.496 1.837 0 N-CA-C 106.817 -1.549 . . . . 0.0 106.817 -164.826 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 29' ' ' SER . . . . . . . . . . . . . 12.3 t -81.9 129.57 34.8 Favored 'General case' 0 N--CA 1.5 2.027 0 O-C-N 118.58 -2.575 . . . . 0.0 107.747 -150.95 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 30' ' ' MET . . . . . 0.646 ' HE1' ' HB3' ' B' ' 19' ' ' LEU . 0.0 OUTLIER -46.62 -39.79 11.84 Favored 'General case' 0 N--CA 1.496 1.871 0 N-CA-C 119.546 3.165 . . . . 0.0 119.546 -143.349 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 31' ' ' ASN . . . . . . . . . . . . 0.261 0.1 OUTLIER -48.55 -39.38 23.37 Favored 'General case' 0 CA--C 1.589 2.456 0 CA-C-N 125.781 3.9 . . . . 0.0 114.997 166.332 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 32' ' ' SER . . . . . . . . . . . . 0.319 33.5 t -56.77 -67.19 0.33 Allowed 'General case' 0 CA--C 1.576 1.952 0 N-CA-C 119.39 3.108 . . . . 0.0 119.39 147.385 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . 0.25 6.2 tp10 -66.23 -55.1 17.83 Favored 'General case' 0 N--CA 1.52 3.068 0 CA-C-N 124.963 3.529 . . . . 0.0 115.809 -178.298 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 34' ' ' LEU . . . . . 0.726 HD12 ' CZ ' ' A' ' 7' ' ' PHE . 0.1 OUTLIER -39.71 -54.91 2.0 Favored 'General case' 0 CA--C 1.553 1.086 0 CA-C-O 115.057 -2.401 . . . . 0.0 108.086 167.239 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 35' ' ' LEU . . . . . . . . . . . . . 11.6 mt -63.08 -54.66 34.5 Favored 'General case' 0 C--N 1.373 1.622 0 CA-C-N 124.485 3.312 . . . . 0.0 115.124 177.533 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 36' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -56.59 -38.13 71.59 Favored 'General case' 0 CA--C 1.566 1.592 0 N-CA-C 115.484 1.661 . . . . 0.0 115.484 177.858 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 37' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -69.66 -38.05 75.48 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.474 0 N-CA-C 115.658 1.725 . . . . 0.0 115.658 164.885 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 38' ' ' VAL . . . . . 0.477 HG21 HD22 ' B' ' 34' ' ' LEU . 3.1 t -73.83 -48.07 40.87 Favored 'Isoleucine or valine' 0 CA--C 1.577 1.989 0 C-N-CA 127.14 2.176 . . . . 0.0 111.732 -178.849 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -47.17 -51.44 18.28 Favored 'General case' 0 CA--C 1.556 1.208 0 CA-C-O 117.508 -1.234 . . . . 0.0 113.427 153.416 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 40' ' ' ASP . . . . . . . . . . . . 0.936 0.5 OUTLIER -52.14 -37.41 54.32 Favored 'General case' 0 CA--C 1.573 1.833 0 N-CA-C 118.879 2.918 . . . . 0.0 118.879 160.706 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 41' ' ' ALA . . . . . 0.56 ' HA ' HD22 ' A' ' 58' ' ' LEU . . . -68.86 -49.01 61.94 Favored 'General case' 0 CA--C 1.554 1.126 0 N-CA-C 115.892 1.812 . . . . 0.0 115.892 -170.263 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 1.4 pp -117.74 -0.8 11.71 Favored 'General case' 0 CA--C 1.566 1.585 0 N-CA-C 117.534 2.42 . . . . 0.0 117.534 178.364 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 43' ' ' SER . . . . . . . . . . . . . 6.8 m -75.34 -26.82 58.91 Favored 'General case' 0 N--CA 1.497 1.913 0 CA-C-N 120.945 1.702 . . . . 0.0 115.028 148.298 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 44' ' ' LYS . . . . . . . . . . . . 0.677 45.0 pttt 67.48 -110.55 0.0 OUTLIER Pre-proline 0 CA--C 1.588 2.44 0 CA-C-O 114.582 -2.628 . . . . 0.0 116.056 173.064 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -74.55 148.87 38.11 Favored 'Trans proline' 0 CA--C 1.562 1.877 0 CA-C-N 127.423 3.687 . . . . 0.0 117.508 -171.813 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 46' ' ' SER . . . . . . . . . . . . . 73.0 m -115.71 177.8 1.12 Allowed Pre-proline 0 CA--C 1.584 2.265 0 CA-C-N 113.853 -1.522 . . . . 0.0 110.259 138.623 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_exo -67.31 85.92 0.34 Allowed 'Trans proline' 0 CA--C 1.571 2.356 0 CA-C-N 123.866 2.416 . . . . 0.0 116.658 179.253 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 48' ' ' VAL . . . . . . . . . . . . 0.375 48.7 t -106.38 -88.08 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.507 2.415 0 CA-C-O 118.292 -0.861 . . . . 0.0 110.907 -179.241 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 49' ' ' THR . . . . . 0.537 HG21 HH21 ' A' ' 57' ' ' ARG . 2.6 m -149.42 140.1 22.63 Favored 'General case' 0 CA--C 1.575 1.923 2 O-C-N 110.979 -7.326 . . . . 0.0 110.354 -12.251 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 50' ' ' GLY . . . . . . . . . . . . . . . 143.34 93.14 0.17 Allowed Glycine 0 N--CA 1.493 2.447 0 CA-C-O 118.396 -1.224 . . . . 0.0 112.71 173.144 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 51' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -29.77 149.86 0.0 OUTLIER 'General case' 0 N--CA 1.501 2.097 3 CA-C-N 128.263 6.032 . . . . 0.0 124.554 4.62 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 52' ' ' ARG . . . . . 0.518 HH21 ' ND2' ' B' ' 53' ' ' ASN . 1.2 tpt180 -95.04 167.35 11.44 Favored 'General case' 0 CA--C 1.586 2.34 0 C-N-CA 124.831 1.253 . . . . 0.0 111.69 156.52 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 53' ' ' ASN . . . . . 0.518 ' ND2' HH21 ' B' ' 52' ' ' ARG 0.763 0.0 OUTLIER -71.86 85.19 0.95 Allowed 'General case' 0 N--CA 1.501 2.111 0 O-C-N 118.791 -2.443 . . . . 0.0 111.372 169.411 . . . . . . . . 4 4 . 1 . 007 nuclear build full ' B' B ' 54' ' ' ASP . . . . . 0.499 ' HA ' ' HB2' ' B' ' 57' ' ' ARG 0.538 4.2 p30 -76.72 31.18 0.13 Allowed 'General case' 0 C--N 1.36 1.024 0 N-CA-C 119.261 3.059 . . . . 0.0 119.261 145.278 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 55' ' ' ALA . . . . . 0.449 ' O ' ' HB2' ' B' ' 59' ' ' ALA . . . -112.45 -15.88 13.01 Favored 'General case' 0 CA--C 1.548 0.891 0 N-CA-C 119.388 3.107 . . . . 0.0 119.388 141.664 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 45.5 mm-40 -66.98 -1.49 4.15 Favored 'General case' 0 N--CA 1.498 1.97 0 N-CA-C 118.154 2.65 . . . . 0.0 118.154 137.137 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 57' ' ' ARG . . . . . 0.499 ' HB2' ' HA ' ' B' ' 54' ' ' ASP 0.375 0.0 OUTLIER -105.13 -24.37 12.77 Favored 'General case' 0 CA--C 1.596 2.737 0 O-C-N 119.944 -1.722 . . . . 0.0 115.418 160.16 . . . . . . . . 4 4 . 1 . 007 nuclear build full ' B' B ' 58' ' ' LEU . . . . . 0.493 HD23 ' H ' ' B' ' 59' ' ' ALA 0.486 0.0 OUTLIER -65.33 -43.68 90.19 Favored 'General case' 0 N--CA 1.52 3.064 0 O-C-N 117.809 -3.057 . . . . 0.0 118.802 161.396 . . . . . . . . 4 4 . 1 . 007 nuclear build full ' B' B ' 59' ' ' ALA . . . . . 0.493 ' H ' HD23 ' B' ' 58' ' ' LEU 0.374 . . -8.64 -83.78 0.0 OUTLIER 'General case' 0 N--CA 1.477 0.902 1 N-CA-C 123.265 4.543 . . . . 0.0 123.265 120.617 . . . . . . . . 4 3 . 1 . 007 nuclear build full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 64.2 m-20 -51.19 -12.83 0.14 Allowed 'General case' 0 CA--C 1.572 1.824 0 CA-C-N 123.979 3.081 . . . . 0.0 119.137 170.233 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 5.9 tm-20 -64.42 -60.2 3.44 Favored 'General case' 0 N--CA 1.496 1.84 0 CA-C-N 122.546 2.43 . . . . 0.0 114.545 152.435 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 62' ' ' GLN . . . . . 0.66 ' O ' HG13 ' B' ' 66' ' ' VAL . 0.1 OUTLIER -70.83 -63.51 1.08 Allowed 'General case' 0 CA--C 1.558 1.271 0 CA-C-N 121.058 1.754 . . . . 0.0 114.179 173.529 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 63' ' ' SER . . . . . . . . . . . . 0.287 5.3 p -70.51 31.18 0.04 OUTLIER 'General case' 0 CA--C 1.571 1.751 0 N-CA-C 120.225 3.417 . . . . 0.0 120.225 165.487 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 64' ' ' GLU . . . . . . . . . . . . . 81.1 mt-10 -104.38 -47.95 3.97 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 119.585 -1.947 . . . . 0.0 111.627 123.171 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 3.6 mp -85.41 42.52 0.96 Allowed 'General case' 0 N--CA 1.502 2.162 0 N-CA-C 116.666 2.099 . . . . 0.0 116.666 -174.884 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 66' ' ' VAL . . . . . 0.66 HG13 ' O ' ' B' ' 62' ' ' GLN . 8.4 m . . . . . 0 N--CA 1.496 1.837 0 C-N-CA 126.657 1.983 . . . . 0.0 109.362 172.549 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 1.437 0 N-CA-C 116.032 1.864 . . . . 0.0 116.032 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 70.2 mtm-85 59.15 42.21 19.16 Favored 'General case' 0 N--CA 1.5 2.044 0 N-CA-C 116.634 2.087 . . . . 0.0 116.634 173.719 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 5.8 p-10 -120.62 115.42 23.34 Favored 'General case' 0 CA--C 1.553 1.088 0 N-CA-C 106.0 -1.852 . . . . 0.0 106.0 -177.858 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 23.8 p-10 -145.02 86.87 7.47 Favored Pre-proline 0 CA--C 1.57 1.745 1 O-C-N 113.557 -5.714 . . . . 0.0 113.18 27.768 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 65.2 Cg_endo -67.5 157.7 60.54 Favored 'Trans proline' 0 CA--C 1.564 2.024 0 C-N-CA 123.044 2.496 . . . . 0.0 117.566 175.949 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' HIS . . . . . 0.444 ' HA ' ' HA ' ' B' ' 10' ' ' ARG . 76.0 m80 -85.1 145.13 27.81 Favored 'General case' 0 CA--C 1.565 1.538 0 N-CA-C 115.296 1.591 . . . . 0.0 115.296 -171.28 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 7' ' ' PHE . . . . . 0.793 ' CZ ' HD12 ' B' ' 34' ' ' LEU . 1.3 p90 -128.31 136.78 51.46 Favored 'General case' 0 N--CA 1.487 1.407 0 O-C-N 120.094 -1.629 . . . . 0.0 109.351 135.987 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 58.5 m-20 -73.53 92.47 1.91 Allowed 'General case' 0 CA--C 1.558 1.257 0 O-C-N 120.953 -1.092 . . . . 0.0 110.748 175.75 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' PHE . . . . . 0.696 ' CD2' HD13 ' B' ' 34' ' ' LEU . 3.9 t80 -68.87 163.35 24.51 Favored 'General case' 0 CA--C 1.562 1.423 0 CA-C-O 124.69 2.186 . . . . 0.0 110.466 164.347 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 173.18 98.74 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.783 0 CA-C-N 113.114 -1.857 . . . . 0.0 107.135 -124.304 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 7.3 mtt -145.75 131.74 9.54 Favored Pre-proline 0 N--CA 1.496 1.852 0 CA-C-O 116.751 -1.595 . . . . 0.0 112.275 -153.125 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 79.9 Cg_exo -43.27 150.16 0.43 Allowed 'Trans proline' 0 CA--C 1.561 1.846 0 C-N-CA 123.113 2.542 . . . . 0.0 116.936 170.585 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 21.2 tpp -64.38 -28.72 69.89 Favored 'General case' 0 N--CA 1.491 1.619 0 N-CA-C 116.987 2.217 . . . . 0.0 116.987 -164.192 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 9.1 pm0 -57.54 -48.01 80.46 Favored 'General case' 0 CA--C 1.566 1.571 0 N-CA-C 116.973 2.212 . . . . 0.0 116.973 156.365 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.401 ' CG1' HG12 ' B' ' 38' ' ' VAL . 2.0 t -60.97 -47.28 94.26 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.047 0 CA-C-N 122.019 2.19 . . . . 0.0 115.25 -179.747 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . 0.509 0.1 OUTLIER -114.87 27.43 9.43 Favored 'General case' 0 N--CA 1.485 1.314 0 N-CA-C 118.376 2.732 . . . . 0.0 118.376 170.979 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 5.5 pt-20 -71.61 -45.96 60.62 Favored 'General case' 0 N--CA 1.483 1.222 0 O-C-N 119.141 -2.224 . . . . 0.0 113.517 119.856 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . 0.297 56.0 mtmt -60.98 -52.26 65.77 Favored 'General case' 0 CA--C 1.563 1.469 0 N-CA-C 116.338 1.977 . . . . 0.0 116.338 177.986 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.744 ' HB3' ' CE ' ' A' ' 30' ' ' MET . 6.9 mt -65.67 -43.93 87.79 Favored 'General case' 0 CA--C 1.576 1.946 0 CA-C-N 120.291 1.405 . . . . 0.0 114.326 166.898 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 5.7 ttpt -77.7 -29.36 51.33 Favored 'General case' 0 CA--C 1.572 1.806 0 CA-C-N 123.296 2.771 . . . . 0.0 113.69 -178.499 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' PHE . . . . . 0.429 ' O ' ' HB3' ' A' ' 25' ' ' ALA . 17.3 m-30 -63.71 -67.86 0.39 Allowed 'General case' 0 N--CA 1.485 1.317 0 CA-C-O 115.627 -2.13 . . . . 0.0 111.725 159.792 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . 0.307 14.1 ttt180 -26.06 -49.19 0.03 OUTLIER 'General case' 0 CA--C 1.595 2.697 0 CA-C-N 124.626 3.376 . . . . 0.0 115.889 164.782 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . 0.293 . . -55.26 -76.53 0.03 OUTLIER 'General case' 0 CA--C 1.591 2.52 0 O-C-N 117.174 -3.454 . . . . 0.0 118.225 156.278 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 38.8 mt-10 -69.01 -46.87 66.89 Favored 'General case' 0 N--CA 1.504 2.238 0 N-CA-C 119.342 3.09 . . . . 0.0 119.342 -179.182 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.429 ' HB3' ' O ' ' A' ' 21' ' ' PHE . . . -41.08 -47.27 3.12 Favored 'General case' 0 CA--C 1.577 2.003 0 N-CA-C 117.611 2.448 . . . . 0.0 117.611 158.724 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . 0.329 0.0 OUTLIER -124.6 -43.21 2.04 Favored 'General case' 0 CA--C 1.571 1.776 0 CA-C-O 117.884 -1.055 . . . . 0.0 113.439 -146.713 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 173.26 -27.92 0.09 OUTLIER Glycine 0 N--CA 1.498 2.77 0 N-CA-C 120.78 3.072 . . . . 0.0 120.78 173.802 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . 0.396 36.6 mtm105 -110.3 179.96 3.94 Favored 'General case' 0 N--CA 1.498 1.945 0 CA-C-N 119.635 1.717 . . . . 0.0 107.39 -169.816 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 29' ' ' SER . . . . . 0.449 ' H ' ' HB3' ' A' ' 32' ' ' SER . 80.2 p -131.4 105.81 7.84 Favored 'General case' 0 N--CA 1.502 2.171 0 O-C-N 117.487 -3.258 . . . . 0.0 105.757 -172.0 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 30' ' ' MET . . . . . 0.744 ' CE ' ' HB3' ' A' ' 19' ' ' LEU . 0.0 OUTLIER -38.26 -45.65 1.0 Allowed 'General case' 0 N--CA 1.495 1.81 0 N-CA-C 120.336 3.458 . . . . 0.0 120.336 -139.947 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 15.0 t-20 -42.63 -47.59 5.3 Favored 'General case' 0 CA--C 1.597 2.763 0 O-C-N 117.758 -3.089 . . . . 0.0 115.293 162.788 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' SER . . . . . 0.449 ' HB3' ' H ' ' A' ' 29' ' ' SER 0.277 42.8 t -54.0 -63.94 0.99 Allowed 'General case' 0 N--CA 1.501 2.119 0 N-CA-C 120.073 3.36 . . . . 0.0 120.073 147.052 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 5.9 tm-20 -69.35 -51.77 33.65 Favored 'General case' 0 N--CA 1.515 2.79 0 CA-C-N 123.042 2.655 . . . . 0.0 116.986 -175.598 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.767 HD12 ' CZ ' ' B' ' 7' ' ' PHE . 0.0 OUTLIER -44.08 -54.8 5.21 Favored 'General case' 0 CA--C 1.561 1.387 0 CA-C-O 115.535 -2.174 . . . . 0.0 107.59 162.793 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.423 ' HG ' ' CE1' ' B' ' 9' ' ' PHE . 10.9 mt -64.3 -56.2 16.1 Favored 'General case' 0 N--CA 1.491 1.622 0 CA-C-N 124.759 3.436 . . . . 0.0 115.099 -176.598 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 2.1 tm0? -57.73 -38.59 75.58 Favored 'General case' 0 CA--C 1.563 1.45 0 CA-C-O 115.928 -1.987 . . . . 0.0 113.366 177.206 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -69.59 -33.3 56.19 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.668 0 CA-C-N 122.485 2.402 . . . . 0.0 115.441 166.972 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.691 HG13 HD12 ' B' ' 19' ' ' LEU . 2.3 t -74.98 -49.49 28.35 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.544 0 C-N-CA 128.535 2.734 . . . . 0.0 112.974 178.906 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 34.3 mt-30 -43.34 -55.13 4.25 Favored 'General case' 0 N--CA 1.484 1.254 0 CA-C-O 116.695 -1.622 . . . . 0.0 112.294 151.531 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' ASP . . . . . 0.418 ' HA ' ' HA ' ' A' ' 44' ' ' LYS 0.429 0.9 OUTLIER -41.6 -49.81 4.1 Favored 'General case' 0 N--CA 1.495 1.812 0 N-CA-C 118.072 2.619 . . . . 0.0 118.072 158.789 . . . . . . . . 4 4 . 1 . 008 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . 0.331 . . -87.75 -17.67 31.15 Favored 'General case' 0 CA--C 1.548 0.875 0 N-CA-C 117.784 2.513 . . . . 0.0 117.784 -159.361 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.47 HD13 ' HG3' ' B' ' 18' ' ' LYS . 0.5 OUTLIER -108.64 -15.0 14.52 Favored 'General case' 0 N--CA 1.495 1.775 0 N-CA-C 118.625 2.824 . . . . 0.0 118.625 153.079 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 75.7 p -135.85 -32.94 0.87 Allowed 'General case' 0 N--CA 1.496 1.838 0 N-CA-C 116.905 2.187 . . . . 0.0 116.905 -173.138 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' LYS . . . . . 0.418 ' HA ' ' HA ' ' A' ' 40' ' ' ASP 0.703 6.5 tmtt? 56.34 -87.61 0.0 OUTLIER Pre-proline 0 CA--C 1.596 2.724 1 N-CA-C 123.134 4.494 . . . . 0.0 123.134 -125.999 . . . . . . . . 4 3 . 1 . 008 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 47.2 Cg_endo -81.53 143.74 13.78 Favored 'Trans proline' 0 CA--C 1.557 1.658 0 CA-C-N 126.282 3.279 . . . . 0.0 119.296 -132.0 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 19.4 m -140.01 -58.17 0.02 OUTLIER Pre-proline 0 CA--C 1.573 1.842 0 CA-C-O 116.06 -1.924 . . . . 0.0 112.408 133.499 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 41.8 Cg_endo -90.11 36.51 0.34 Allowed 'Trans proline' 0 C--N 1.375 1.965 0 N-CA-C 121.125 3.471 . . . . 0.0 121.125 -157.022 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . 0.429 10.2 t -142.23 -87.01 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.515 2.787 0 N-CA-C 108.144 -1.058 . . . . 0.0 108.144 154.65 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 4.4 t -169.84 150.94 4.02 Favored 'General case' 0 CA--C 1.58 2.104 2 O-C-N 111.677 -6.89 . . . . 0.0 113.389 -14.655 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -102.33 41.27 2.17 Favored Glycine 0 N--CA 1.508 3.466 0 N-CA-C 116.998 1.559 . . . . 0.0 116.998 147.995 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' TYR . . . . . 0.588 ' HA ' ' HE ' ' B' ' 57' ' ' ARG . 10.1 m-30 -99.7 106.78 18.74 Favored 'General case' 0 CA--C 1.572 1.807 0 C-N-CA 124.28 1.032 . . . . 0.0 109.406 176.704 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 38.9 ttp180 -135.37 136.78 41.75 Favored 'General case' 0 N--CA 1.51 2.571 0 N-CA-C 115.08 1.511 . . . . 0.0 115.08 179.767 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' ASN . . . . . 0.746 ' HA ' ' HB2' ' A' ' 55' ' ' ALA 0.357 3.3 m120 111.68 176.6 0.0 OUTLIER 'General case' 0 N--CA 1.525 3.322 0 C-N-CA 129.122 2.969 . . . . 0.0 110.689 -179.048 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 54' ' ' ASP . . . . . 0.437 ' HA ' ' HB3' ' A' ' 53' ' ' ASN . 6.7 p30 -86.19 123.93 32.02 Favored 'General case' 0 C--N 1.359 1.02 2 O-C-N 108.316 -8.99 . . . . 0.0 105.934 -14.916 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 55' ' ' ALA . . . . . 0.917 ' H ' ' H ' ' A' ' 57' ' ' ARG 0.458 . . -129.89 -125.98 0.21 Allowed 'General case' 0 C--N 1.292 -1.91 0 CA-C-N 111.796 -2.456 . . . . 0.0 106.981 -108.286 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.53 ' HA ' ' HB3' ' A' ' 59' ' ' ALA . 20.7 mm-40 -6.17 -17.37 0.0 OUTLIER 'General case' 0 CA--C 1.601 2.932 1 N-CA-C 125.789 5.478 . . . . 0.0 125.789 90.241 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.917 ' H ' ' H ' ' A' ' 55' ' ' ALA 0.323 0.0 OUTLIER -120.96 -37.87 2.91 Favored 'General case' 0 CA--C 1.564 1.494 0 O-C-N 118.305 -2.747 . . . . 0.0 111.593 -169.286 . . . . . . . . 4 4 . 1 . 008 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 4.2 tp -75.18 -13.03 60.42 Favored 'General case' 0 CA--C 1.58 2.115 0 N-CA-C 115.627 1.714 . . . . 0.0 115.627 144.056 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 59' ' ' ALA . . . . . 0.53 ' HB3' ' HA ' ' A' ' 56' ' ' GLU . . . -54.55 -51.31 65.63 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 119.451 -2.031 . . . . 0.0 114.734 148.652 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 2.6 t70 -71.36 -14.52 62.21 Favored 'General case' 0 N--CA 1.482 1.143 0 N-CA-C 116.868 2.173 . . . . 0.0 116.868 171.186 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . 0.278 13.4 tp10 -73.15 -59.72 2.58 Favored 'General case' 0 N--CA 1.484 1.273 0 CA-C-N 119.602 1.092 . . . . 0.0 112.642 167.946 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 62' ' ' GLN . . . . . 0.437 ' O ' HG13 ' A' ' 66' ' ' VAL . 8.0 tp60 -67.62 -59.61 3.21 Favored 'General case' 0 CA--C 1.555 1.144 0 CA-C-N 121.75 2.068 . . . . 0.0 110.703 172.734 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 63' ' ' SER . . . . . 0.439 ' HA ' HG22 ' A' ' 66' ' ' VAL 0.297 46.0 t -92.72 52.07 1.81 Allowed 'General case' 0 CA--C 1.562 1.42 0 N-CA-C 118.497 2.777 . . . . 0.0 118.497 172.928 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -110.25 -21.07 12.41 Favored 'General case' 0 CA--C 1.577 1.995 0 O-C-N 119.81 -1.806 . . . . 0.0 115.643 109.197 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 20.8 mt -91.37 -7.31 51.2 Favored 'General case' 0 N--CA 1.509 2.476 0 CA-C-N 122.84 2.564 . . . . 0.0 116.452 -174.161 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.439 HG22 ' HA ' ' A' ' 63' ' ' SER . 13.8 m . . . . . 0 N--CA 1.503 2.218 0 N-CA-C 118.28 2.696 . . . . 0.0 118.28 164.497 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.565 1.544 0 N-CA-C 113.837 1.051 . . . . 0.0 113.837 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 2' ' ' ARG . . . . . . . . . . . . . 36.4 ptt180 -62.15 -41.97 98.8 Favored 'General case' 0 N--CA 1.506 2.346 1 N-CA-C 121.854 4.02 . . . . 0.0 121.854 -177.429 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . 0.389 15.7 t70 69.54 106.23 0.06 Allowed 'General case' 0 CA--C 1.568 1.649 0 CA-C-N 111.902 -2.408 . . . . 0.0 116.156 -171.886 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 4' ' ' ASP . . . . . . . . . . . . 0.519 2.7 p30 66.19 67.27 0.71 Allowed Pre-proline 0 CA--C 1.569 1.694 0 N-CA-C 120.419 3.488 . . . . 0.0 120.419 166.893 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -62.3 165.07 15.83 Favored 'Trans proline' 0 CA--C 1.568 2.196 0 C-N-CA 122.276 1.984 . . . . 0.0 116.991 150.205 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 6' ' ' HIS . . . . . . . . . . . . . 76.6 m80 -88.27 153.46 21.2 Favored 'General case' 0 CA--C 1.569 1.711 0 CA-C-N 111.723 -2.49 . . . . 0.0 112.429 169.544 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 7' ' ' PHE . . . . . 0.767 ' CZ ' HD12 ' A' ' 34' ' ' LEU . 10.0 p90 -130.43 159.69 36.29 Favored 'General case' 0 CA--C 1.568 1.647 0 O-C-N 119.491 -2.006 . . . . 0.0 112.047 129.782 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 8' ' ' ASN . . . . . . . . . . . . . 14.6 p-10 -65.74 87.69 0.09 Allowed 'General case' 0 CA--C 1.567 1.626 0 N-CA-C 114.279 1.214 . . . . 0.0 114.279 168.937 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 9' ' ' PHE . . . . . 0.678 ' CD2' HD13 ' A' ' 34' ' ' LEU 0.254 1.9 t80 -79.76 179.44 7.53 Favored 'General case' 0 CA--C 1.556 1.177 0 CA-C-O 123.724 1.726 . . . . 0.0 110.361 158.932 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 10' ' ' ARG . . . . . 0.444 ' HA ' ' HA ' ' A' ' 6' ' ' HIS 0.425 67.4 mtt180 -127.16 -136.94 0.25 Allowed 'General case' 0 N--CA 1.477 0.886 0 CA-C-N 114.246 -1.343 . . . . 0.0 110.832 -164.418 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 11' ' ' MET . . . . . 0.523 ' SD ' ' CD2' ' B' ' 9' ' ' PHE . 5.1 mmt -146.12 171.14 6.8 Favored Pre-proline 0 CA--C 1.579 2.071 0 O-C-N 117.301 -3.375 . . . . 0.0 110.683 63.331 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 12' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -45.76 131.92 13.31 Favored 'Trans proline' 0 C--N 1.371 1.721 0 O-C-N 117.103 -2.104 . . . . 0.0 113.328 147.882 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 13' ' ' MET . . . . . . . . . . . . . 22.5 tpp -60.17 -27.12 66.86 Favored 'General case' 0 CA--C 1.568 1.637 0 N-CA-C 118.14 2.644 . . . . 0.0 118.14 -154.335 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 14' ' ' GLU . . . . . . . . . . . . 0.271 11.1 pt-20 -57.14 -50.07 73.96 Favored 'General case' 0 CA--C 1.565 1.546 0 N-CA-C 117.001 2.223 . . . . 0.0 117.001 162.309 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 15' ' ' VAL . . . . . 0.471 ' CG1' HG12 ' A' ' 38' ' ' VAL . 0.1 OUTLIER -63.52 -43.06 98.17 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.884 0 CA-C-N 121.037 1.744 . . . . 0.0 114.375 173.756 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 16' ' ' ARG . . . . . . . . . . . . 0.261 4.8 ttt180 -78.97 -32.22 45.26 Favored 'General case' 0 N--CA 1.478 0.943 0 CA-C-O 116.058 -1.925 . . . . 0.0 114.518 175.404 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 17' ' ' GLU . . . . . . . . . . . . . 5.3 pt-20 -64.77 -43.97 91.53 Favored 'General case' 0 N--CA 1.484 1.26 0 CA-C-N 124.0 3.091 . . . . 0.0 113.305 163.209 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 18' ' ' LYS . . . . . 0.47 ' HG3' HD13 ' A' ' 42' ' ' LEU 0.615 16.5 pttt -70.14 -33.25 71.57 Favored 'General case' 0 CA--C 1.565 1.551 0 N-CA-C 117.858 2.54 . . . . 0.0 117.858 173.712 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 19' ' ' LEU . . . . . 0.691 HD12 HG13 ' A' ' 38' ' ' VAL 0.367 0.7 OUTLIER -76.59 -40.27 50.01 Favored 'General case' 0 CA--C 1.567 1.617 0 CA-C-N 121.016 1.735 . . . . 0.0 114.021 166.689 . . . . . . . . 4 4 . 1 . 008 nuclear build full ' B' B ' 20' ' ' LYS . . . . . . . . . . . . . 3.0 ttpt -79.71 -32.77 41.32 Favored 'General case' 0 CA--C 1.563 1.458 0 O-C-N 119.861 -1.774 . . . . 0.0 114.556 179.174 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 18.9 m-85 -60.78 -73.86 0.09 Allowed 'General case' 0 N--CA 1.491 1.619 1 CA-C-O 111.613 -4.042 . . . . 0.0 109.951 155.213 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . 0.276 17.9 ttt180 -22.81 -54.82 0.03 OUTLIER 'General case' 0 N--CA 1.506 2.334 1 CA-C-N 127.601 4.728 . . . . 0.0 117.066 170.655 . . . . . . . . 3 2 . 1 . 008 nuclear build full ' B' B ' 23' ' ' ALA . . . . . 0.516 ' HB2' ' CB ' ' B' ' 33' ' ' GLU . . . -48.63 -79.8 0.01 OUTLIER 'General case' 0 CA--C 1.58 2.102 0 N-CA-C 118.489 2.774 . . . . 0.0 118.489 156.592 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 46.4 mm-40 -65.82 -34.22 77.65 Favored 'General case' 0 N--CA 1.498 1.93 0 N-CA-C 118.978 2.955 . . . . 0.0 118.978 -178.429 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 25' ' ' ALA . . . . . . . . . . . . . . . -41.96 -48.1 4.47 Favored 'General case' 0 CA--C 1.578 2.052 0 N-CA-C 117.536 2.421 . . . . 0.0 117.536 153.712 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 26' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -97.97 -44.52 6.63 Favored 'General case' 0 CA--C 1.576 1.951 0 N-CA-C 116.64 2.089 . . . . 0.0 116.64 -173.614 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 27' ' ' GLY . . . . . . . . . . . . . . . 122.62 13.7 4.58 Favored Glycine 0 N--CA 1.498 2.798 0 N-CA-C 119.05 2.38 . . . . 0.0 119.05 -159.584 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 28' ' ' ARG . . . . . 0.675 ' HE ' ' HG2' ' B' ' 33' ' ' GLU . 61.8 mtm-85 -109.54 154.72 22.31 Favored 'General case' 0 CA--C 1.575 1.924 0 N-CA-C 103.981 -2.6 . . . . 0.0 103.981 167.302 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 29' ' ' SER . . . . . . . . . . . . . 79.1 p -129.35 112.35 13.76 Favored 'General case' 0 N--CA 1.505 2.311 0 O-C-N 117.049 -3.532 . . . . 0.0 106.001 -169.737 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 30' ' ' MET . . . . . 0.468 ' CE ' ' HB3' ' B' ' 19' ' ' LEU . 24.1 mtp -47.15 -38.58 11.95 Favored 'General case' 0 N--CA 1.497 1.915 0 N-CA-C 118.772 2.878 . . . . 0.0 118.772 -135.198 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 31' ' ' ASN . . . . . . . . . . . . 0.26 0.1 OUTLIER -48.21 -43.27 31.85 Favored 'General case' 0 CA--C 1.598 2.816 0 O-C-N 116.906 -3.622 . . . . 0.0 115.315 164.425 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 32' ' ' SER . . . . . . . . . . . . 0.461 75.4 p -54.84 -63.5 1.13 Allowed 'General case' 0 N--CA 1.505 2.319 0 N-CA-C 118.755 2.872 . . . . 0.0 118.755 145.262 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 33' ' ' GLU . . . . . 0.675 ' HG2' ' HE ' ' B' ' 28' ' ' ARG . 3.0 tm-20 -67.18 -50.15 62.11 Favored 'General case' 0 N--CA 1.511 2.624 0 N-CA-C 120.35 3.463 . . . . 0.0 120.35 -177.052 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 34' ' ' LEU . . . . . 0.793 HD12 ' CZ ' ' A' ' 7' ' ' PHE . 0.1 OUTLIER -42.07 -54.69 3.48 Favored 'General case' 0 CA--C 1.554 1.126 0 CA-C-O 114.881 -2.485 . . . . 0.0 107.756 159.807 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 35' ' ' LEU . . . . . 0.415 HD23 ' HA ' ' B' ' 35' ' ' LEU . 12.2 mt -60.38 -40.11 89.71 Favored 'General case' 0 N--CA 1.492 1.633 0 CA-C-N 124.75 3.432 . . . . 0.0 116.766 176.028 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 36' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.22 -46.07 74.94 Favored 'General case' 0 N--CA 1.488 1.438 0 N-CA-C 115.017 1.488 . . . . 0.0 115.017 176.145 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 37' ' ' ILE . . . . . . . . . . . . . 5.3 tt -63.12 -30.2 49.11 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.408 0 CA-C-O 114.858 -2.496 . . . . 0.0 116.101 161.89 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 38' ' ' VAL . . . . . 0.616 ' HA ' ' HB3' ' B' ' 41' ' ' ALA . 2.2 t -83.63 -46.21 18.4 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.923 0 CA-C-N 121.893 2.133 . . . . 0.0 112.704 -172.301 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 33.5 mt-30 -57.28 -38.89 74.63 Favored 'General case' 0 CA--C 1.572 1.82 0 O-C-N 121.148 -0.97 . . . . 0.0 112.497 157.291 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 40' ' ' ASP . . . . . . . . . . . . 0.528 5.2 m-20 -52.93 -41.45 64.46 Favored 'General case' 0 CA--C 1.58 2.103 0 N-CA-C 119.264 3.061 . . . . 0.0 119.264 151.168 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 41' ' ' ALA . . . . . 0.616 ' HB3' ' HA ' ' B' ' 38' ' ' VAL . . . -75.68 -20.62 58.3 Favored 'General case' 0 N--CA 1.493 1.715 0 N-CA-C 116.695 2.109 . . . . 0.0 116.695 -175.663 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 22.4 mt -96.14 -36.35 11.0 Favored 'General case' 0 N--CA 1.488 1.464 0 C-N-CA 125.057 1.343 . . . . 0.0 113.673 170.743 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 43' ' ' SER . . . . . . . . . . . . . 22.8 t -64.0 -41.64 97.42 Favored 'General case' 0 N--CA 1.497 1.891 0 N-CA-C 117.334 2.346 . . . . 0.0 117.334 169.898 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 44' ' ' LYS . . . . . . . . . . . . 0.32 7.4 mmpt? 70.41 150.47 0.13 Allowed Pre-proline 0 CA--C 1.582 2.185 0 N-CA-C 118.135 2.643 . . . . 0.0 118.135 179.304 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 28.2 Cg_endo -99.44 138.31 0.3 Allowed 'Trans proline' 0 C--N 1.377 2.076 0 N-CA-C 118.515 2.467 . . . . 0.0 118.515 -168.197 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 46' ' ' SER . . . . . . . . . . . . . 74.5 m -97.22 -47.96 0.23 Allowed Pre-proline 0 CA--C 1.576 1.963 0 CA-C-O 115.627 -2.13 . . . . 0.0 113.256 141.823 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 67.5 Cg_exo -61.04 76.85 0.08 OUTLIER 'Trans proline' 0 CA--C 1.57 2.31 0 CA-C-N 124.979 2.814 . . . . 0.0 117.679 166.789 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 48' ' ' VAL . . . . . . . . . . . . 0.251 27.9 m -88.9 -27.19 5.39 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.137 0 N-CA-C 118.756 2.873 . . . . 0.0 118.756 -179.223 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 49' ' ' THR . . . . . . . . . . . . . 87.0 m -117.95 100.51 7.61 Favored 'General case' 0 CA--C 1.568 1.662 2 O-C-N 113.148 -5.97 . . . . 0.0 106.938 -22.041 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 50' ' ' GLY . . . . . . . . . . . . . . . 78.84 6.05 88.61 Favored Glycine 0 N--CA 1.497 2.758 0 N-CA-C 120.706 3.042 . . . . 0.0 120.706 -171.316 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 51' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -75.17 -36.66 61.48 Favored 'General case' 0 CA--C 1.584 2.263 0 CA-C-N 121.43 2.615 . . . . 0.0 117.27 -170.902 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 52' ' ' ARG . . . . . . . . . . . . 0.304 48.2 ttt180 -162.1 -88.28 0.03 OUTLIER 'General case' 0 CA--C 1.591 2.555 0 C-N-CA 125.488 1.515 . . . . 0.0 112.129 169.784 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 53' ' ' ASN . . . . . 0.506 ' C ' ' HB3' ' B' ' 55' ' ' ALA . 0.5 OUTLIER -169.12 -167.47 0.73 Allowed 'General case' 0 N--CA 1.503 2.194 2 O-C-N 111.373 -7.079 . . . . 0.0 116.739 3.512 . . . . . . . . 4 4 . 1 . 008 nuclear build full ' B' B ' 54' ' ' ASP . . . . . 0.674 ' HB2' ' HB2' ' A' ' 53' ' ' ASN 0.63 1.2 m-20 -132.45 48.42 2.42 Favored 'General case' 0 CA--C 1.575 1.928 0 CA-C-O 127.207 3.384 . . . . 0.0 118.225 -148.355 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 55' ' ' ALA . . . . . 0.623 ' HB3' ' N ' ' B' ' 54' ' ' ASP 0.527 . . 47.29 -88.2 0.01 OUTLIER 'General case' 0 CA--C 1.571 1.759 2 O-C-N 109.157 -8.464 . . . . 0.0 122.205 41.741 . . . . . . . . 4 3 . 1 . 008 nuclear build full ' B' B ' 56' ' ' GLU . . . . . 0.802 ' O ' ' HB3' ' B' ' 59' ' ' ALA . 42.0 mt-10 -41.47 -22.15 0.02 OUTLIER 'General case' 0 N--CA 1.51 2.536 0 N-CA-C 119.339 3.088 . . . . 0.0 119.339 139.441 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 57' ' ' ARG . . . . . 0.588 ' HE ' ' HA ' ' A' ' 51' ' ' TYR 0.396 1.2 mpt_? -101.28 -8.53 22.05 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 117.069 -3.519 . . . . 0.0 113.203 177.782 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 58' ' ' LEU . . . . . 0.524 ' HA ' ' H ' ' B' ' 61' ' ' GLU 0.556 4.0 mp -83.18 -5.35 59.09 Favored 'General case' 0 CA--C 1.603 3.005 0 O-C-N 119.289 -2.132 . . . . 0.0 116.555 144.987 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 59' ' ' ALA . . . . . 0.802 ' HB3' ' O ' ' B' ' 56' ' ' GLU . . . -45.28 -46.72 12.84 Favored 'General case' 0 N--CA 1.518 2.947 0 O-C-N 117.074 -3.517 . . . . 0.0 115.033 131.193 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -79.4 -8.27 58.98 Favored 'General case' 0 N--CA 1.496 1.874 0 N-CA-C 119.163 3.024 . . . . 0.0 119.163 175.915 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 61' ' ' GLU . . . . . 0.524 ' H ' ' HA ' ' B' ' 58' ' ' LEU . 10.4 tm-20 -56.15 -55.58 31.32 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.027 -1.046 . . . . 0.0 111.782 145.538 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 62' ' ' GLN . . . . . 0.63 ' O ' HG13 ' B' ' 66' ' ' VAL 0.311 4.8 tp60 -54.46 -46.86 73.43 Favored 'General case' 0 CA--C 1.574 1.867 0 N-CA-C 116.074 1.879 . . . . 0.0 116.074 167.479 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 21.6 m -36.32 -59.09 0.66 Allowed 'General case' 0 N--CA 1.511 2.584 0 N-CA-C 118.483 2.772 . . . . 0.0 118.483 166.106 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 64' ' ' GLU . . . . . . . . . . . . 0.416 8.9 mt-10 -87.23 10.28 17.54 Favored 'General case' 0 CA--C 1.573 1.865 0 N-CA-C 113.099 0.777 . . . . 0.0 113.099 -175.171 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 65' ' ' LEU . . . . . 0.515 HD22 ' HA ' ' B' ' 62' ' ' GLN . 0.0 OUTLIER -88.08 -55.01 3.93 Favored 'General case' 0 CA--C 1.58 2.123 0 C-N-CA 125.151 1.38 . . . . 0.0 113.844 143.218 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 66' ' ' VAL . . . . . 0.63 HG13 ' O ' ' B' ' 62' ' ' GLN 0.427 11.2 m . . . . . 0 N--CA 1.515 2.788 0 N-CA-C 118.435 2.754 . . . . 0.0 118.435 -161.344 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.561 1.404 0 N-CA-C 113.703 1.001 . . . . 0.0 113.703 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 18.5 mmm180 -89.06 80.87 6.91 Favored 'General case' 0 N--CA 1.493 1.715 0 CA-C-O 122.668 1.223 . . . . 0.0 113.373 -179.927 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 13.2 p-10 -111.24 47.46 1.0 Allowed 'General case' 0 CA--C 1.572 1.813 0 O-C-N 121.463 -0.773 . . . . 0.0 110.259 158.424 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 26.3 p-10 -139.99 67.98 34.72 Favored Pre-proline 0 CA--C 1.57 1.736 0 O-C-N 120.566 -1.334 . . . . 0.0 113.715 166.918 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 1.9 Cg_endo -109.55 173.51 0.07 OUTLIER 'Trans proline' 0 CA--C 1.556 1.619 0 C-N-CA 121.94 1.76 . . . . 0.0 112.964 -157.554 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . 0.268 1.8 p-80 -143.61 148.35 35.73 Favored 'General case' 0 N--CA 1.486 1.347 0 N-CA-C 118.173 2.657 . . . . 0.0 118.173 -144.581 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 7' ' ' PHE . . . . . 0.53 ' CZ ' HD23 ' B' ' 34' ' ' LEU . 25.5 p90 -131.71 166.18 22.08 Favored 'General case' 0 CA--C 1.561 1.393 0 CA-C-N 113.806 -1.543 . . . . 0.0 109.033 168.91 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 14.1 m120 -74.39 98.39 3.26 Favored 'General case' 0 CA--C 1.563 1.467 0 O-C-N 119.641 -1.912 . . . . 0.0 110.872 162.67 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' PHE . . . . . 0.436 ' HD2' HD11 ' A' ' 34' ' ' LEU . 3.6 t80 -69.97 157.61 37.15 Favored 'General case' 0 CA--C 1.568 1.662 0 CA-C-O 124.26 1.981 . . . . 0.0 109.873 147.283 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 12.3 tpt180 169.27 87.34 0.0 OUTLIER 'General case' 0 N--CA 1.502 2.137 0 O-C-N 119.264 -2.147 . . . . 0.0 106.904 -124.283 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -136.79 121.7 12.79 Favored Pre-proline 0 CA--C 1.575 1.909 0 CA-C-O 117.248 -1.358 . . . . 0.0 112.886 -149.172 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 98.9 Cg_exo -43.26 150.91 0.35 Allowed 'Trans proline' 0 C--N 1.379 2.142 0 C-N-CA 123.875 3.05 . . . . 0.0 118.969 -179.904 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -50.94 -40.19 56.72 Favored 'General case' 0 N--CA 1.499 1.994 0 N-CA-C 117.983 2.586 . . . . 0.0 117.983 -165.805 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 9.6 pt-20 -63.37 -43.25 98.15 Favored 'General case' 0 CA--C 1.564 1.492 0 N-CA-C 116.287 1.958 . . . . 0.0 116.287 165.428 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.429 ' CG1' HG12 ' B' ' 38' ' ' VAL . 1.2 t -59.96 -48.91 86.0 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.064 0 CA-C-N 123.002 2.637 . . . . 0.0 112.637 172.457 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 3.4 ttt180 -69.7 -41.29 75.59 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-N 121.13 1.786 . . . . 0.0 115.797 174.111 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -60.91 -37.68 83.08 Favored 'General case' 0 CA--C 1.565 1.543 0 CA-C-N 123.289 2.768 . . . . 0.0 114.378 166.237 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 48.4 mtmt -62.47 -62.76 1.53 Allowed 'General case' 0 CA--C 1.564 1.488 0 CA-C-N 121.229 1.832 . . . . 0.0 114.481 166.7 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.541 HD21 ' HG ' ' A' ' 34' ' ' LEU . 12.5 tp -56.89 -36.19 69.84 Favored 'General case' 0 N--CA 1.491 1.578 0 N-CA-C 115.855 1.798 . . . . 0.0 115.855 176.319 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 12.1 ttpt -89.29 -27.85 20.28 Favored 'General case' 0 CA--C 1.568 1.656 0 C-N-CA 125.143 1.377 . . . . 0.0 114.046 179.081 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' PHE . . . . . 0.416 ' O ' ' HB3' ' A' ' 25' ' ' ALA . 13.2 m-30 -65.31 -70.67 0.22 Allowed 'General case' 0 N--CA 1.493 1.681 0 CA-C-O 115.103 -2.38 . . . . 0.0 110.926 156.887 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.574 ' HE ' HD12 ' A' ' 37' ' ' ILE 0.35 0.0 OUTLIER -23.55 -47.71 0.01 OUTLIER 'General case' 0 CA--C 1.6 2.869 0 CA-C-N 124.631 3.378 . . . . 0.0 115.102 163.794 . . . . . . . . 4 4 . 1 . 009 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.407 ' HB2' ' CB ' ' A' ' 33' ' ' GLU . . . -57.94 -76.96 0.03 OUTLIER 'General case' 0 CA--C 1.587 2.377 0 N-CA-C 117.61 2.448 . . . . 0.0 117.61 156.726 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -63.45 -45.62 90.02 Favored 'General case' 0 N--CA 1.503 2.198 0 N-CA-C 118.948 2.944 . . . . 0.0 118.948 179.102 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.416 ' HB3' ' O ' ' A' ' 21' ' ' PHE . . . -40.02 -51.67 2.53 Favored 'General case' 0 CA--C 1.589 2.449 0 N-CA-C 116.523 2.045 . . . . 0.0 116.523 159.055 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 91.0 m-20 -82.02 -47.61 12.43 Favored 'General case' 0 N--CA 1.499 2.019 0 N-CA-C 116.238 1.94 . . . . 0.0 116.238 176.356 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 116.23 37.03 1.05 Allowed Glycine 0 CA--C 1.56 2.853 0 N-CA-C 117.776 1.87 . . . . 0.0 117.776 -156.834 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 29.1 mtm-85 -126.3 161.02 28.74 Favored 'General case' 0 CA--C 1.569 1.689 0 N-CA-C 106.532 -1.655 . . . . 0.0 106.532 168.211 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 38.1 t -119.6 115.0 23.09 Favored 'General case' 0 N--CA 1.501 2.105 0 O-C-N 118.842 -2.411 . . . . 0.0 105.411 -177.681 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 22.7 mtp -43.72 -40.93 4.54 Favored 'General case' 0 N--CA 1.5 2.068 0 N-CA-C 119.109 3.003 . . . . 0.0 119.109 -146.175 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -46.17 -44.63 16.14 Favored 'General case' 0 CA--C 1.601 2.906 0 CA-C-N 125.683 3.856 . . . . 0.0 115.371 163.721 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . 0.356 28.7 t -49.07 -75.59 0.03 OUTLIER 'General case' 0 N--CA 1.503 2.191 0 N-CA-C 118.338 2.718 . . . . 0.0 118.338 143.608 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 33' ' ' GLU . . . . . 0.407 ' CB ' ' HB2' ' A' ' 23' ' ' ALA . 10.4 tp10 -60.6 -55.01 38.45 Favored 'General case' 0 N--CA 1.516 2.87 0 CA-C-N 124.217 3.19 . . . . 0.0 116.191 -173.208 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.788 HD12 ' CZ ' ' B' ' 7' ' ' PHE . 0.1 OUTLIER -39.88 -53.9 2.23 Favored 'General case' 0 CA--C 1.55 0.972 0 CA-C-O 115.805 -2.045 . . . . 0.0 108.3 167.481 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.428 HD23 ' HA ' ' A' ' 35' ' ' LEU . 13.1 mt -61.1 -47.24 87.21 Favored 'General case' 0 N--CA 1.486 1.348 0 CA-C-N 123.263 2.756 . . . . 0.0 115.913 174.75 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.56 -44.71 93.21 Favored 'General case' 0 N--CA 1.479 0.989 0 CA-C-O 116.748 -1.596 . . . . 0.0 114.269 177.472 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 37' ' ' ILE . . . . . 0.574 HD12 ' HE ' ' A' ' 22' ' ' ARG . 3.8 tt -69.94 -32.68 52.46 Favored 'Isoleucine or valine' 0 C--O 1.199 -1.598 0 CA-C-O 114.989 -2.434 . . . . 0.0 114.719 166.168 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.478 HG21 HD22 ' A' ' 34' ' ' LEU . 3.0 t -78.21 -48.36 23.09 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.179 0 CA-C-N 123.581 2.9 . . . . 0.0 112.156 -174.435 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 27.2 mt-30 -49.4 -46.15 47.03 Favored 'General case' 0 CA--C 1.563 1.462 0 C-N-CA 123.77 0.828 . . . . 0.0 112.153 154.507 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . 0.422 3.9 t0 -51.55 -41.65 61.25 Favored 'General case' 0 N--CA 1.488 1.439 0 N-CA-C 118.913 2.931 . . . . 0.0 118.913 158.444 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . 0.275 . . -87.24 -40.73 14.27 Favored 'General case' 0 N--CA 1.479 0.978 0 N-CA-C 115.465 1.654 . . . . 0.0 115.465 -155.494 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 2.1 pp -94.79 -25.4 16.67 Favored 'General case' 0 CA--C 1.565 1.526 0 N-CA-C 117.471 2.397 . . . . 0.0 117.471 160.632 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 16.2 t -106.8 -13.29 15.29 Favored 'General case' 0 N--CA 1.495 1.781 0 CA-C-N 122.754 2.525 . . . . 0.0 116.208 -177.734 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' LYS . . . . . 0.549 ' HB3' ' HE ' ' B' ' 57' ' ' ARG . 42.6 mttt -119.93 61.47 7.35 Favored Pre-proline 0 N--CA 1.489 1.504 0 CA-C-N 120.921 1.691 . . . . 0.0 108.34 163.067 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 64.8 Cg_endo -88.26 100.9 0.42 Allowed 'Trans proline' 0 CA--C 1.572 2.385 0 N-CA-C 120.18 3.108 . . . . 0.0 120.18 75.414 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 58.0 m -107.78 116.56 57.18 Favored Pre-proline 0 CA--C 1.577 2.018 0 CA-C-O 117.662 -1.161 . . . . 0.0 108.292 152.037 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . 0.271 4.7 Cg_exo -17.6 74.23 0.0 OUTLIER 'Trans proline' 0 CA--C 1.573 2.446 1 N-CA-C 126.164 5.409 . . . . 0.0 126.164 -156.977 . . . . . . . . 3 2 . 1 . 009 nuclear build full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . 0.42 29.2 t 76.84 -67.02 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.504 2.262 0 N-CA-C 115.427 1.64 . . . . 0.0 115.427 167.794 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . 0.339 5.5 p 74.85 58.85 0.07 Allowed 'General case' 0 CA--C 1.58 2.101 0 CA-C-O 122.469 1.128 . . . . 0.0 112.172 -172.401 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 79.19 -63.59 3.87 Favored Glycine 0 N--CA 1.498 2.824 0 N-CA-C 119.21 2.444 . . . . 0.0 119.21 -172.874 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -94.09 53.98 1.84 Allowed 'General case' 0 CA--C 1.583 2.239 0 N-CA-C 119.002 2.964 . . . . 0.0 119.002 -156.15 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 81.9 mtt85 50.37 93.13 0.02 OUTLIER 'General case' 0 N--CA 1.509 2.519 0 N-CA-C 118.529 2.789 . . . . 0.0 118.529 160.304 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . 0.308 7.4 p30 -170.15 -92.86 0.01 OUTLIER 'General case' 0 N--CA 1.511 2.588 0 CA-C-O 116.311 -1.805 . . . . 0.0 112.975 -161.541 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 54' ' ' ASP . . . . . 0.405 ' O ' ' HB2' ' A' ' 57' ' ' ARG 1.832 56.3 m-20 65.23 2.14 1.79 Allowed 'General case' 0 N--CA 1.521 3.107 1 N-CA-C 123.205 4.521 . . . . 0.0 123.205 -129.834 . . . . . . . . 4 3 . 1 . 009 nuclear build full ' A' A ' 55' ' ' ALA . . . . . 0.436 ' C ' ' H ' ' A' ' 58' ' ' LEU . . . 25.1 85.55 0.01 OUTLIER 'General case' 0 CA--C 1.502 -0.88 0 CA-C-N 111.333 -2.667 . . . . 0.0 118.198 -134.212 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.433 ' HG2' ' H ' ' B' ' 54' ' ' ASP 1.321 1.8 pt-20 109.47 3.49 0.01 OUTLIER 'General case' 0 CA--C 1.591 2.541 3 N-CA-C 129.523 6.86 . . . . 0.0 129.523 155.826 . . . . . . . . 4 3 . 1 . 009 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.645 ' CB ' ' HB3' ' A' ' 59' ' ' ALA 2.457 0.0 OUTLIER 9.8 73.16 0.01 OUTLIER 'General case' 0 CA--C 1.609 3.218 2 CA-C-N 102.222 -6.808 . . . . 0.0 113.326 -95.579 . . . . . . . . 5 4 . 1 . 009 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.51 HD23 ' H ' ' A' ' 59' ' ' ALA . 0.3 OUTLIER -53.01 -41.24 64.46 Favored 'General case' 0 N--CA 1.536 3.83 1 O-C-N 114.921 -4.862 . . . . 0.0 109.918 172.083 . . . . . . . . 4 4 . 1 . 009 nuclear build full ' A' A ' 59' ' ' ALA . . . . . 0.645 ' HB3' ' CB ' ' A' ' 57' ' ' ARG 0.271 . . -18.75 -77.08 0.01 OUTLIER 'General case' 0 CA--C 1.575 1.935 2 CA-C-N 105.998 -5.092 . . . . 0.0 123.59 132.212 . . . . . . . . 4 3 . 1 . 009 nuclear build full ' A' A ' 60' ' ' ASP . . . . . 0.525 ' H ' ' C ' ' A' ' 57' ' ' ARG . 6.0 m-20 -124.12 -6.32 7.79 Favored 'General case' 0 CA--C 1.559 1.293 0 CA-C-N 121.872 2.124 . . . . 0.0 113.026 -159.46 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . 2.012 36.9 mt-10 -25.85 -83.06 0.01 OUTLIER 'General case' 0 CA--C 1.55 0.967 0 N-CA-C 120.409 3.485 . . . . 0.0 120.409 116.116 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 62' ' ' GLN . . . . . 0.657 ' O ' HG13 ' A' ' 66' ' ' VAL . 9.5 tp60 -88.09 -55.69 3.64 Favored 'General case' 0 C--N 1.36 1.023 0 C-N-CA 119.269 -0.972 . . . . 0.0 110.575 -161.158 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . 0.272 66.0 p -82.04 52.54 2.0 Allowed 'General case' 0 CA--C 1.56 1.343 0 N-CA-C 115.023 1.49 . . . . 0.0 115.023 152.878 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 30.0 tt0 -97.42 -59.43 1.78 Allowed 'General case' 0 CA--C 1.562 1.427 0 O-C-N 118.842 -2.411 . . . . 0.0 111.709 104.91 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . 0.288 2.2 mp -94.22 49.64 1.32 Allowed 'General case' 0 N--CA 1.502 2.142 0 CA-C-O 124.02 1.867 . . . . 0.0 114.974 -162.965 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.657 HG13 ' O ' ' A' ' 62' ' ' GLN . 2.2 m . . . . . 0 N--CA 1.5 2.065 0 CA-C-N 112.737 -2.028 . . . . 0.0 113.203 173.414 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 1.525 0 N-CA-C 117.616 2.45 . . . . 0.0 117.616 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 2' ' ' ARG . . . . . . . . . . . . 0.336 79.3 mtt180 67.8 52.04 0.75 Allowed 'General case' 0 N--CA 1.494 1.744 0 N-CA-C 117.131 2.271 . . . . 0.0 117.131 174.056 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 43.4 m-20 -95.49 63.95 2.55 Favored 'General case' 0 CA--C 1.571 1.768 0 O-C-N 120.787 -1.195 . . . . 0.0 108.177 147.567 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 4' ' ' ASP . . . . . . . . . . . . . 3.6 p-10 -162.6 90.07 1.32 Allowed Pre-proline 0 CA--C 1.57 1.73 0 C-N-CA 124.851 1.26 . . . . 0.0 108.13 -176.522 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 7.2 Cg_exo -91.58 140.43 2.5 Favored 'Trans proline' 0 CA--C 1.552 1.379 0 CA-C-N 123.533 2.298 . . . . 0.0 113.183 -159.981 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 6' ' ' HIS . . . . . . . . . . . . . 67.5 m80 -72.29 128.13 34.69 Favored 'General case' 0 CA--C 1.575 1.923 0 CA-C-N 114.852 -1.067 . . . . 0.0 111.784 173.008 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 7' ' ' PHE . . . . . 0.788 ' CZ ' HD12 ' A' ' 34' ' ' LEU 0.252 2.5 p90 -131.92 149.47 52.43 Favored 'General case' 0 CA--C 1.565 1.529 0 O-C-N 119.882 -1.761 . . . . 0.0 111.036 147.877 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 8' ' ' ASN . . . . . . . . . . . . . 12.9 m120 -71.86 84.69 0.94 Allowed 'General case' 0 N--CA 1.491 1.606 0 O-C-N 120.521 -1.362 . . . . 0.0 112.234 176.727 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 9' ' ' PHE . . . . . 0.673 ' CD2' HD13 ' A' ' 34' ' ' LEU . 9.0 t80 -81.23 149.75 28.9 Favored 'General case' 0 CA--C 1.561 1.374 0 CA-C-O 126.151 2.881 . . . . 0.0 111.306 171.033 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 10' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -172.6 112.5 0.26 Allowed 'General case' 0 C--N 1.307 -1.243 0 CA-C-N 111.5 -2.591 . . . . 0.0 105.54 -129.351 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 11' ' ' MET . . . . . 0.408 ' SD ' ' CD2' ' B' ' 9' ' ' PHE . 0.9 OUTLIER -133.71 117.91 14.31 Favored Pre-proline 0 CA--C 1.564 1.487 0 CA-C-O 117.375 -1.298 . . . . 0.0 110.032 -153.176 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 12' ' ' PRO . . . . . . . . . . . . . 76.1 Cg_exo -42.92 145.59 1.09 Allowed 'Trans proline' 0 C--N 1.374 1.869 0 C-N-CA 123.249 2.633 . . . . 0.0 116.1 163.886 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 13' ' ' MET . . . . . . . . . . . . . 3.5 tpt -51.56 -41.18 60.94 Favored 'General case' 0 N--CA 1.494 1.736 0 N-CA-C 118.551 2.797 . . . . 0.0 118.551 -154.632 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -63.39 -43.29 98.0 Favored 'General case' 0 CA--C 1.563 1.457 0 N-CA-C 116.722 2.119 . . . . 0.0 116.722 166.708 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -57.43 -47.25 85.22 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.39 0 CA-C-N 124.394 3.27 . . . . 0.0 112.951 172.576 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 1.9 ttt180 -75.13 -37.84 61.26 Favored 'General case' 0 N--CA 1.475 0.818 0 CA-C-O 116.6 -1.666 . . . . 0.0 115.236 176.381 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 17' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -61.74 -37.37 83.99 Favored 'General case' 0 CA--C 1.569 1.676 0 CA-C-N 123.12 2.691 . . . . 0.0 114.056 163.405 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . 0.269 43.2 mtmt -66.3 -49.93 65.36 Favored 'General case' 0 CA--C 1.563 1.461 0 CA-C-N 122.018 2.19 . . . . 0.0 115.112 170.416 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 19' ' ' LEU . . . . . 0.53 HD21 HD22 ' B' ' 34' ' ' LEU 0.27 11.8 tp -70.12 -39.22 75.59 Favored 'General case' 0 N--CA 1.487 1.391 0 C-N-CA 124.98 1.312 . . . . 0.0 114.526 176.374 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 20' ' ' LYS . . . . . 0.402 ' HB2' ' SD ' ' B' ' 30' ' ' MET . 13.4 ttpt -84.92 -28.6 25.81 Favored 'General case' 0 CA--C 1.565 1.525 0 CA-C-O 117.423 -1.275 . . . . 0.0 114.271 177.597 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 18.5 m-30 -67.03 -70.72 0.23 Allowed 'General case' 0 N--CA 1.492 1.644 0 CA-C-O 113.093 -3.337 . . . . 0.0 109.945 160.337 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . 0.275 37.2 ttt85 -20.26 -53.78 0.02 OUTLIER 'General case' 0 CA--C 1.587 2.391 1 CA-C-N 126.284 4.129 . . . . 0.0 116.372 165.399 . . . . . . . . 3 2 . 1 . 009 nuclear build full ' B' B ' 23' ' ' ALA . . . . . 0.494 ' HB2' ' CB ' ' B' ' 33' ' ' GLU . . . -54.32 -79.53 0.02 OUTLIER 'General case' 0 CA--C 1.588 2.438 0 N-CA-C 117.288 2.329 . . . . 0.0 117.288 159.023 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 66.7 mm-40 -71.49 -32.58 68.4 Favored 'General case' 0 CA--C 1.575 1.934 0 N-CA-C 119.361 3.097 . . . . 0.0 119.361 -176.41 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 25' ' ' ALA . . . . . . . . . . . . . . . -41.56 -49.99 4.05 Favored 'General case' 0 CA--C 1.58 2.1 0 N-CA-C 116.549 2.055 . . . . 0.0 116.549 153.131 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 26' ' ' ASN . . . . . . . . . . . . 0.264 0.0 OUTLIER -107.6 -42.27 4.81 Favored 'General case' 0 CA--C 1.576 1.972 0 N-CA-C 116.09 1.885 . . . . 0.0 116.09 -163.975 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 27' ' ' GLY . . . . . . . . . . . . . . . 134.27 12.24 1.46 Allowed Glycine 0 N--CA 1.498 2.824 0 N-CA-C 119.232 2.453 . . . . 0.0 119.232 -167.097 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 28' ' ' ARG . . . . . 0.408 ' HE ' ' HG2' ' B' ' 33' ' ' GLU . 72.4 mtm-85 -111.35 165.75 11.69 Favored 'General case' 0 CA--C 1.575 1.922 0 CA-C-N 120.39 2.095 . . . . 0.0 105.424 168.087 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 29' ' ' SER . . . . . . . . . . . . . 8.8 t -133.7 113.62 12.54 Favored 'General case' 0 N--CA 1.506 2.361 0 O-C-N 117.103 -3.498 . . . . 0.0 107.129 -177.247 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 30' ' ' MET . . . . . 0.402 ' SD ' ' HB2' ' B' ' 20' ' ' LYS . 25.6 mtp -44.8 -34.46 2.32 Favored 'General case' 0 N--CA 1.5 2.029 0 N-CA-C 121.338 3.829 . . . . 0.0 121.338 -139.533 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 31' ' ' ASN . . . . . . . . . . . . 0.26 8.8 t-20 -49.75 -49.64 47.42 Favored 'General case' 0 CA--C 1.591 2.543 0 O-C-N 118.572 -2.58 . . . . 0.0 113.882 161.318 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 32' ' ' SER . . . . . . . . . . . . 0.29 27.6 t -49.43 -64.26 0.86 Allowed 'General case' 0 N--CA 1.501 2.115 0 N-CA-C 119.649 3.203 . . . . 0.0 119.649 146.955 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 33' ' ' GLU . . . . . 0.494 ' CB ' ' HB2' ' B' ' 23' ' ' ALA . 0.0 OUTLIER -67.55 -60.47 2.53 Favored 'General case' 0 N--CA 1.516 2.863 0 CA-C-N 123.45 2.841 . . . . 0.0 116.156 -176.449 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 34' ' ' LEU . . . . . 0.53 HD22 HD21 ' B' ' 19' ' ' LEU 0.543 0.1 OUTLIER -49.06 -37.06 19.83 Favored 'General case' 0 CA--C 1.563 1.48 0 CA-C-O 114.184 -2.817 . . . . 0.0 108.207 172.009 . . . . . . . . 4 4 . 1 . 009 nuclear build full ' B' B ' 35' ' ' LEU . . . . . 0.405 ' HA ' HD23 ' B' ' 35' ' ' LEU . 13.9 mt -64.67 -56.73 11.92 Favored 'General case' 0 N--CA 1.491 1.613 1 CA-C-N 126.158 4.072 . . . . 0.0 115.725 167.559 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 36' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -50.64 -40.26 52.78 Favored 'General case' 0 CA--C 1.58 2.101 0 N-CA-C 115.784 1.772 . . . . 0.0 115.784 175.734 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 37' ' ' ILE . . . . . 0.423 ' HA ' ' HB3' ' B' ' 40' ' ' ASP . 0.5 OUTLIER -74.03 -35.62 42.28 Favored 'Isoleucine or valine' 0 CA--C 1.571 1.762 0 N-CA-C 116.164 1.913 . . . . 0.0 116.164 166.47 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 38' ' ' VAL . . . . . 0.518 ' HA ' ' HB3' ' B' ' 41' ' ' ALA . 3.3 t -72.5 -46.76 54.47 Favored 'Isoleucine or valine' 0 CA--C 1.575 1.941 0 O-C-N 119.041 -2.287 . . . . 0.0 110.796 177.699 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 23.7 mt-30 -51.38 -40.85 60.06 Favored 'General case' 0 CA--C 1.562 1.427 0 N-CA-C 114.539 1.311 . . . . 0.0 114.539 155.517 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 40' ' ' ASP . . . . . 0.423 ' HB3' ' HA ' ' B' ' 37' ' ' ILE . 44.8 t0 -53.32 -47.71 69.07 Favored 'General case' 0 N--CA 1.492 1.634 0 N-CA-C 116.518 2.044 . . . . 0.0 116.518 156.102 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 41' ' ' ALA . . . . . 0.518 ' HB3' ' HA ' ' B' ' 38' ' ' VAL 0.263 . . -69.6 -26.86 64.65 Favored 'General case' 0 CA--C 1.564 1.514 0 N-CA-C 117.462 2.393 . . . . 0.0 117.462 -174.618 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -110.31 -34.06 6.46 Favored 'General case' 0 CA--C 1.573 1.856 0 C-N-CA 124.687 1.195 . . . . 0.0 112.993 175.356 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 43' ' ' SER . . . . . . . . . . . . . 7.5 t -84.49 32.93 0.5 Allowed 'General case' 0 N--CA 1.505 2.323 0 N-CA-C 116.783 2.142 . . . . 0.0 116.783 164.134 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 44' ' ' LYS . . . . . . . . . . . . . 30.8 mtpp -41.35 -24.87 0.15 Allowed Pre-proline 0 CA--C 1.599 2.836 1 N-CA-C 127.404 6.076 . . . . 0.0 127.404 145.325 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 0.3 OUTLIER -44.25 169.4 0.03 OUTLIER 'Trans proline' 0 CA--C 1.564 1.994 1 N-CA-C 125.751 5.25 . . . . 0.0 125.751 -162.731 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 46' ' ' SER . . . . . . . . . . . . . 86.4 p -84.94 118.09 70.19 Favored Pre-proline 0 CA--C 1.58 2.101 0 CA-C-O 116.585 -1.674 . . . . 0.0 112.777 162.408 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_endo -103.57 115.24 0.42 Allowed 'Cis proline' 0 CA--C 1.571 2.355 0 CA-C-N 124.766 2.738 . . . . 0.0 116.088 -0.974 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 48' ' ' VAL . . . . . 0.526 HG13 HG22 ' B' ' 49' ' ' THR . 7.7 p -74.81 -37.55 42.44 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.26 0 O-C-N 120.409 -1.432 . . . . 0.0 113.988 143.453 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 49' ' ' THR . . . . . 0.526 HG22 HG13 ' B' ' 48' ' ' VAL . 5.4 t -159.69 -174.97 4.89 Favored 'General case' 0 CA--C 1.572 1.823 0 CA-C-O 124.086 1.898 . . . . 0.0 115.178 -143.649 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 50' ' ' GLY . . . . . . . . . . . . . . . -92.5 -47.48 3.23 Favored Glycine 0 N--CA 1.495 2.632 0 CA-C-N 112.748 -2.024 . . . . 0.0 117.368 163.526 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 51' ' ' TYR . . . . . . . . . . . . 0.3 0.0 OUTLIER -65.7 88.25 0.1 Allowed 'General case' 0 CA--C 1.584 2.265 0 CA-C-N 119.339 1.569 . . . . 0.0 113.768 170.281 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 52' ' ' ARG . . . . . . . . . . . . . 4.0 tpm_? -87.3 94.0 9.55 Favored 'General case' 0 CA--C 1.576 1.945 0 N-CA-C 114.758 1.392 . . . . 0.0 114.758 -166.714 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 53' ' ' ASN . . . . . 0.47 ' HA ' ' H ' ' B' ' 55' ' ' ALA . 0.7 OUTLIER -154.04 -149.22 0.27 Allowed 'General case' 0 CA--C 1.61 3.258 0 N-CA-C 107.238 -1.393 . . . . 0.0 107.238 -158.073 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 54' ' ' ASP . . . . . 0.434 ' HA ' ' HB1' ' A' ' 55' ' ' ALA . 0.5 OUTLIER 53.61 -71.84 0.01 OUTLIER 'General case' 0 N--CA 1.497 1.901 2 O-C-N 111.184 -7.198 . . . . 0.0 113.909 -66.912 . . . . . . . . 4 4 . 1 . 009 nuclear build full ' B' B ' 55' ' ' ALA . . . . . 0.648 ' HA ' ' HB2' ' B' ' 56' ' ' GLU 2.367 . . 111.12 -150.94 0.0 OUTLIER 'General case' 0 N--CA 1.384 -3.726 2 CA-C-O 130.374 4.892 . . . . 0.0 99.549 -156.152 . . . . . . . . 4 3 . 1 . 009 nuclear build full ' B' B ' 56' ' ' GLU . . . . . 0.648 ' HB2' ' HA ' ' B' ' 55' ' ' ALA 0.373 22.4 mt-10 64.54 -53.43 0.29 Allowed 'General case' 0 C--N 1.249 -3.782 1 O-C-N 98.075 -15.391 . . . . 0.0 118.614 24.049 . . . . . . . . 4 3 . 1 . 009 nuclear build full ' B' B ' 57' ' ' ARG . . . . . 0.549 ' HE ' ' HB3' ' A' ' 44' ' ' LYS . 0.0 OUTLIER -103.81 -54.96 2.47 Favored 'General case' 0 N--CA 1.485 1.311 0 CA-C-N 124.159 3.163 . . . . 0.0 118.151 -176.156 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 58' ' ' LEU . . . . . 0.423 ' CB ' ' HB3' ' B' ' 54' ' ' ASP 0.403 0.2 OUTLIER -66.88 -16.96 64.66 Favored 'General case' 0 CA--C 1.577 2.003 0 CA-C-O 115.81 -2.043 . . . . 0.0 113.328 157.526 . . . . . . . . 4 4 . 1 . 009 nuclear build full ' B' B ' 59' ' ' ALA . . . . . . . . . . . . . . . -48.82 -60.56 2.64 Favored 'General case' 0 C--N 1.379 1.861 0 CA-C-N 123.54 2.882 . . . . 0.0 118.104 147.041 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -125.23 -16.97 5.81 Favored 'General case' 0 N--CA 1.486 1.359 0 N-CA-C 114.947 1.462 . . . . 0.0 114.947 -151.943 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 61' ' ' GLU . . . . . . . . . . . . 0.286 0.5 OUTLIER -68.47 -21.3 64.63 Favored 'General case' 0 CA--C 1.559 1.299 0 CA-C-O 112.293 -3.717 . . . . 0.0 113.699 138.143 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 62' ' ' GLN . . . . . 0.662 ' O ' HG13 ' B' ' 66' ' ' VAL 0.271 4.0 tp60 -75.36 -89.16 0.03 OUTLIER 'General case' 0 C--N 1.394 2.519 1 CA-C-N 127.552 4.706 . . . . 0.0 110.445 161.115 . . . . . . . . 4 3 . 1 . 009 nuclear build full ' B' B ' 63' ' ' SER . . . . . . . . . . . . 0.406 35.9 t -88.0 49.18 1.75 Allowed 'General case' 0 CA--C 1.557 1.219 0 N-CA-C 116.591 2.071 . . . . 0.0 116.591 179.412 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 64' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -119.01 -21.33 7.73 Favored 'General case' 0 CA--C 1.575 1.924 0 CA-C-O 114.476 -2.678 . . . . 0.0 115.491 112.442 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 65' ' ' LEU . . . . . . . . . . . . 0.319 3.5 mt -109.49 50.06 0.8 Allowed 'General case' 0 N--CA 1.512 2.673 1 CA-C-N 126.8 4.363 . . . . 0.0 113.522 -178.872 . . . . . . . . 3 2 . 1 . 009 nuclear build full ' B' B ' 66' ' ' VAL . . . . . 0.662 HG13 ' O ' ' B' ' 62' ' ' GLN . 2.4 m . . . . . 0 N--CA 1.495 1.776 0 CA-C-N 111.59 -2.55 . . . . 0.0 112.961 175.359 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.56 1.344 0 N-CA-C 113.627 0.973 . . . . 0.0 113.627 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -79.87 77.73 6.51 Favored 'General case' 0 N--CA 1.496 1.834 0 CA-C-O 122.764 1.268 . . . . 0.0 112.696 178.515 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -92.02 77.67 5.35 Favored 'General case' 0 N--CA 1.49 1.56 0 N-CA-C 107.068 -1.456 . . . . 0.0 107.068 171.053 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 2.1 p30 -159.6 78.97 2.75 Favored Pre-proline 0 CA--C 1.568 1.67 0 CA-C-N 115.371 -0.831 . . . . 0.0 112.1 -172.341 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 3.7 Cg_exo -98.06 148.74 0.75 Allowed 'Trans proline' 0 CA--C 1.551 1.343 0 CA-C-N 122.363 1.88 . . . . 0.0 114.131 -155.246 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 80.8 m80 -84.9 130.42 34.65 Favored 'General case' 0 CA--C 1.566 1.577 0 CA-C-N 113.946 -1.479 . . . . 0.0 112.369 178.476 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' PHE . . . . . 0.482 ' CZ ' HD23 ' B' ' 34' ' ' LEU . 3.2 p90 -132.45 159.56 38.99 Favored 'General case' 0 CA--C 1.567 1.625 0 CA-C-O 122.704 1.24 . . . . 0.0 111.048 153.896 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 70.7 m-80 -66.18 101.73 0.75 Allowed 'General case' 0 CA--C 1.573 1.847 0 O-C-N 120.877 -1.14 . . . . 0.0 112.68 173.999 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' PHE . . . . . 0.457 ' CE1' ' HG ' ' B' ' 35' ' ' LEU . 5.2 t80 -120.18 110.08 16.19 Favored 'General case' 0 CA--C 1.547 0.838 0 N-CA-C 106.372 -1.714 . . . . 0.0 106.372 157.839 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . 0.383 0.0 OUTLIER 98.66 89.05 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.633 1 O-C-N 113.897 -5.502 . . . . 0.0 110.098 -17.654 . . . . . . . . 4 3 . 1 . 010 nuclear build full ' A' A ' 11' ' ' MET . . . . . 0.496 ' SD ' ' HG3' ' A' ' 16' ' ' ARG . 1.6 mpt? -147.74 149.57 33.91 Favored Pre-proline 0 CA--C 1.567 1.632 0 CA-C-O 118.086 -0.959 . . . . 0.0 111.976 -170.237 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_exo -44.85 141.94 5.56 Favored 'Trans proline' 0 CA--C 1.567 2.155 0 C-N-CA 122.436 2.091 . . . . 0.0 115.989 154.783 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' MET . . . . . 0.433 ' SD ' ' HG3' ' A' ' 17' ' ' GLU . 13.7 tpp -56.07 -27.79 54.96 Favored 'General case' 0 N--CA 1.496 1.847 0 N-CA-C 118.934 2.939 . . . . 0.0 118.934 -169.811 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 7.6 pt-20 -65.93 -47.62 74.12 Favored 'General case' 0 CA--C 1.57 1.712 0 N-CA-C 115.957 1.836 . . . . 0.0 115.957 165.304 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -60.37 -49.07 85.72 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.216 0 CA-C-N 122.263 2.301 . . . . 0.0 112.513 174.402 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 16' ' ' ARG . . . . . 0.496 ' HG3' ' SD ' ' A' ' 11' ' ' MET . 5.8 ttt180 -69.8 -33.11 71.91 Favored 'General case' 0 CA--C 1.548 0.894 0 CA-C-O 116.047 -1.93 . . . . 0.0 115.562 173.8 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.433 ' HG3' ' SD ' ' A' ' 13' ' ' MET . 37.1 mt-10 -60.19 -48.1 83.16 Favored 'General case' 0 N--CA 1.491 1.615 0 CA-C-N 123.941 3.064 . . . . 0.0 114.197 160.312 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 18' ' ' LYS . . . . . 0.405 ' HB3' HD13 ' B' ' 42' ' ' LEU . 53.0 mtmt -61.89 -45.66 92.79 Favored 'General case' 0 CA--C 1.562 1.436 0 N-CA-C 116.134 1.902 . . . . 0.0 116.134 174.529 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.589 ' CD2' HD22 ' A' ' 34' ' ' LEU 0.258 14.0 tp -69.0 -40.55 78.65 Favored 'General case' 0 CA--C 1.565 1.544 0 N-CA-C 115.01 1.485 . . . . 0.0 115.01 172.195 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.453 ' HB2' ' SD ' ' A' ' 30' ' ' MET . 16.1 ttpt -85.22 -26.2 26.87 Favored 'General case' 0 CA--C 1.567 1.603 0 N-CA-C 114.259 1.207 . . . . 0.0 114.259 179.757 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 21' ' ' PHE . . . . . 0.42 ' O ' ' HB3' ' A' ' 25' ' ' ALA . 13.1 m-85 -61.94 -69.31 0.26 Allowed 'General case' 0 N--CA 1.49 1.554 0 CA-C-O 114.05 -2.881 . . . . 0.0 110.722 155.224 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . 0.304 1.9 ttt85 -23.22 -49.21 0.02 OUTLIER 'General case' 0 CA--C 1.598 2.8 0 CA-C-N 125.363 3.711 . . . . 0.0 116.53 163.406 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . 0.268 . . -58.13 -77.43 0.03 OUTLIER 'General case' 0 CA--C 1.59 2.502 0 N-CA-C 117.301 2.334 . . . . 0.0 117.301 158.482 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 87.9 mt-10 -61.01 -45.74 93.58 Favored 'General case' 0 N--CA 1.503 2.193 0 N-CA-C 118.774 2.879 . . . . 0.0 118.774 178.606 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.42 ' HB3' ' O ' ' A' ' 21' ' ' PHE . . . -40.87 -50.96 3.22 Favored 'General case' 0 CA--C 1.587 2.377 0 N-CA-C 116.429 2.011 . . . . 0.0 116.429 160.04 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 88.4 m-20 -84.02 -43.44 15.14 Favored 'General case' 0 N--CA 1.5 2.039 0 N-CA-C 116.63 2.085 . . . . 0.0 116.63 177.46 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 108.67 32.44 3.14 Favored Glycine 0 CA--C 1.56 2.864 0 N-CA-C 117.738 1.855 . . . . 0.0 117.738 -153.568 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 12.0 mtt85 -116.66 158.77 23.24 Favored 'General case' 0 CA--C 1.57 1.746 0 N-CA-C 106.03 -1.841 . . . . 0.0 106.03 166.243 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' SER . . . . . 0.491 ' H ' ' HB3' ' A' ' 32' ' ' SER . 41.3 t -119.71 115.14 23.32 Favored 'General case' 0 N--CA 1.503 2.184 0 O-C-N 118.377 -2.702 . . . . 0.0 105.096 -178.948 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 30' ' ' MET . . . . . 0.453 ' SD ' ' HB2' ' A' ' 20' ' ' LYS . 8.3 mtp -43.22 -36.71 1.86 Allowed 'General case' 0 N--CA 1.502 2.145 0 N-CA-C 121.405 3.854 . . . . 0.0 121.405 -148.282 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 31' ' ' ASN . . . . . 0.421 ' O ' ' HB2' ' A' ' 35' ' ' LEU . 11.5 t-20 -48.71 -46.36 40.63 Favored 'General case' 0 CA--C 1.592 2.586 0 O-C-N 118.572 -2.58 . . . . 0.0 114.457 162.0 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 32' ' ' SER . . . . . 0.491 ' HB3' ' H ' ' A' ' 29' ' ' SER 0.287 46.6 t -51.78 -66.41 0.39 Allowed 'General case' 0 N--CA 1.499 2.004 0 N-CA-C 119.908 3.299 . . . . 0.0 119.908 146.918 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 -64.49 -59.92 3.76 Favored 'General case' 0 N--CA 1.515 2.801 0 CA-C-N 123.895 3.043 . . . . 0.0 114.774 -176.042 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.589 HD22 ' CD2' ' A' ' 19' ' ' LEU 0.477 0.3 OUTLIER -51.17 -41.36 60.11 Favored 'General case' 0 CA--C 1.56 1.365 0 CA-C-O 113.55 -3.119 . . . . 0.0 106.692 174.912 . . . . . . . . 4 4 . 1 . 010 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.451 HD23 ' HA ' ' A' ' 35' ' ' LEU . 12.9 mt -62.99 -55.36 26.39 Favored 'General case' 0 N--CA 1.495 1.813 1 CA-C-N 127.281 4.582 . . . . 0.0 115.403 169.59 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . 0.276 1.0 OUTLIER -55.75 -49.81 72.1 Favored 'General case' 0 CA--C 1.566 1.561 0 CA-C-O 116.25 -1.833 . . . . 0.0 113.764 179.559 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 1.6 tt -60.11 -39.48 80.59 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.843 0 CA-C-N 122.619 2.463 . . . . 0.0 115.124 165.421 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.45 ' CG1' HD22 ' B' ' 19' ' ' LEU . 2.4 t -70.1 -49.97 51.36 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.994 0 CA-C-N 123.418 2.826 . . . . 0.0 112.696 -178.015 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 24.8 mt-30 -43.46 -46.7 6.91 Favored 'General case' 0 N--CA 1.489 1.522 0 C-N-CA 124.781 1.233 . . . . 0.0 113.724 152.995 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . 0.372 28.7 m-20 -58.46 -42.59 87.78 Favored 'General case' 0 CA--C 1.558 1.285 0 N-CA-C 117.356 2.354 . . . . 0.0 117.356 163.928 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . 0.265 . . -79.48 -41.76 26.78 Favored 'General case' 0 CA--C 1.553 1.095 0 N-CA-C 115.955 1.835 . . . . 0.0 115.955 -159.589 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.407 HD13 ' HB3' ' B' ' 18' ' ' LYS . 1.4 pp -101.31 -24.71 14.17 Favored 'General case' 0 CA--C 1.567 1.625 0 N-CA-C 117.418 2.377 . . . . 0.0 117.418 160.777 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 1.4 m -95.47 -12.37 25.99 Favored 'General case' 0 N--CA 1.498 1.971 0 CA-C-N 122.699 2.5 . . . . 0.0 116.167 -177.213 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . 0.374 1.3 mmmt 67.33 -168.25 0.01 OUTLIER Pre-proline 0 CA--C 1.588 2.423 0 CA-C-N 123.329 2.786 . . . . 0.0 113.894 169.879 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 22.8 Cg_exo -56.21 172.98 4.81 Favored 'Cis proline' 0 C--N 1.375 1.932 0 CA-C-N 125.854 3.127 . . . . 0.0 116.391 -7.993 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' SER . . . . . 0.438 ' O ' HG13 ' A' ' 48' ' ' VAL . 69.6 m -89.07 108.95 27.21 Favored Pre-proline 0 CA--C 1.568 1.637 0 O-C-N 120.522 -1.361 . . . . 0.0 107.692 133.333 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 5.0 Cg_exo -73.16 98.65 1.03 Allowed 'Trans proline' 0 CA--C 1.566 2.117 0 CA-C-N 124.091 2.497 . . . . 0.0 109.708 172.048 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' VAL . . . . . 0.438 HG13 ' O ' ' A' ' 46' ' ' SER . 19.4 m -83.54 67.79 0.54 Allowed 'Isoleucine or valine' 0 N--CA 1.509 2.496 0 N-CA-C 115.203 1.556 . . . . 0.0 115.203 -150.435 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 24.5 p -101.0 62.52 0.98 Allowed 'General case' 0 N--CA 1.494 1.761 0 O-C-N 120.08 -1.637 . . . . 0.0 111.898 -163.893 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 60.26 41.1 98.18 Favored Glycine 0 N--CA 1.496 2.645 0 N-CA-C 121.082 3.193 . . . . 0.0 121.082 174.138 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -136.48 12.73 3.23 Favored 'General case' 0 N--CA 1.504 2.268 0 N-CA-C 120.421 3.489 . . . . 0.0 120.421 -166.621 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . 0.251 98.9 mtt180 67.95 108.62 0.05 OUTLIER 'General case' 0 CA--C 1.583 2.226 0 N-CA-C 114.815 1.413 . . . . 0.0 114.815 -170.067 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . 0.458 0.9 OUTLIER -134.59 63.15 1.63 Allowed 'General case' 0 N--CA 1.507 2.399 0 C-N-CA 125.45 1.5 . . . . 0.0 111.801 179.236 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 54' ' ' ASP . . . . . 0.488 ' CA ' ' HB2' ' A' ' 57' ' ' ARG . 39.1 m-20 -80.81 65.91 6.13 Favored 'General case' 0 CA--C 1.573 1.852 1 CA-C-O 128.849 4.166 . . . . 0.0 114.507 146.626 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 55' ' ' ALA . . . . . 0.474 ' H ' ' HB2' ' A' ' 56' ' ' GLU 0.437 . . -110.07 -66.98 1.02 Allowed 'General case' 0 CA--C 1.563 1.465 0 CA-C-N 108.984 -3.735 . . . . 0.0 113.891 -166.455 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.474 ' HB2' ' H ' ' A' ' 55' ' ' ALA . 47.1 mt-10 6.49 -25.31 0.0 OUTLIER 'General case' 0 N--CA 1.503 2.176 1 N-CA-C 126.926 5.899 . . . . 0.0 126.926 100.041 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.488 ' HB2' ' CA ' ' A' ' 54' ' ' ASP . 0.1 OUTLIER -110.34 -38.65 5.19 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-O 114.969 -2.444 . . . . 0.0 116.19 171.347 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.493 HD22 ' H ' ' A' ' 59' ' ' ALA 0.588 0.0 OUTLIER -48.83 -47.7 42.3 Favored 'General case' 0 N--CA 1.521 3.092 0 CA-C-N 124.423 3.283 . . . . 0.0 116.352 160.092 . . . . . . . . 4 4 . 1 . 010 nuclear build full ' A' A ' 59' ' ' ALA . . . . . 0.493 ' H ' HD22 ' A' ' 58' ' ' LEU 0.437 . . -17.42 -86.76 0.0 OUTLIER 'General case' 0 CA--C 1.564 1.482 1 N-CA-C 124.187 4.884 . . . . 0.0 124.187 132.634 . . . . . . . . 4 3 . 1 . 010 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 1.7 t70 -55.75 -45.03 78.11 Favored 'General case' 0 N--CA 1.479 0.977 0 N-CA-C 119.627 3.195 . . . . 0.0 119.627 -179.342 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . 0.634 0.1 OUTLIER -77.78 -17.49 57.44 Favored 'General case' 0 N--CA 1.499 2.01 0 CA-C-N 122.471 2.396 . . . . 0.0 113.056 178.593 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . 0.306 1.7 tm0? -73.22 -68.05 0.53 Allowed 'General case' 0 C--N 1.376 1.74 0 CA-C-N 123.774 2.988 . . . . 0.0 104.342 156.751 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . 0.704 3.4 p -65.49 -27.66 68.65 Favored 'General case' 0 N--CA 1.486 1.374 1 N-CA-C 122.472 4.249 . . . . 0.0 122.472 -167.164 . . . . . . . . 3 2 . 1 . 010 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 1.7 tp10 -85.84 0.12 53.86 Favored 'General case' 0 CA--C 1.574 1.872 0 N-CA-C 116.783 2.142 . . . . 0.0 116.783 155.504 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . 0.271 4.8 mp -116.6 44.24 2.06 Favored 'General case' 0 N--CA 1.514 2.746 0 CA-C-N 125.088 3.585 . . . . 0.0 114.362 156.867 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . 0.296 0.9 OUTLIER . . . . . 0 N--CA 1.5 2.047 0 CA-C-N 112.868 -1.969 . . . . 0.0 111.417 -165.776 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.562 1.412 0 N-CA-C 113.496 0.924 . . . . 0.0 113.496 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 2' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -84.49 77.45 10.02 Favored 'General case' 0 N--CA 1.494 1.748 0 CA-C-O 122.699 1.237 . . . . 0.0 113.89 -178.381 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -123.48 42.2 3.28 Favored 'General case' 0 CA--C 1.569 1.696 0 C-N-CA 124.321 1.049 . . . . 0.0 112.103 170.412 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 4' ' ' ASP . . . . . . . . . . . . . 7.1 p-10 -150.91 69.66 8.47 Favored Pre-proline 0 CA--C 1.571 1.763 0 N-CA-C 113.71 1.004 . . . . 0.0 113.71 157.076 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 95.2 Cg_endo -63.12 173.56 3.92 Favored 'Trans proline' 0 CA--C 1.567 2.169 0 C-N-CA 122.787 2.325 . . . . 0.0 116.128 156.473 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 6' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -154.15 148.1 25.59 Favored 'General case' 0 CA--C 1.548 0.873 0 CA-C-N 112.745 -2.025 . . . . 0.0 114.663 -153.175 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 7' ' ' PHE . . . . . 0.552 ' CZ ' HD23 ' A' ' 34' ' ' LEU . 17.3 p90 -122.53 170.36 10.08 Favored 'General case' 0 CA--C 1.561 1.371 0 CA-C-O 122.978 1.371 . . . . 0.0 109.961 153.18 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 8' ' ' ASN . . . . . . . . . . . . . 20.7 m-80 -85.18 92.52 8.42 Favored 'General case' 0 N--CA 1.485 1.291 0 O-C-N 119.894 -1.754 . . . . 0.0 108.06 160.616 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 9' ' ' PHE . . . . . . . . . . . . . 16.0 t80 -69.55 159.04 34.09 Favored 'General case' 0 CA--C 1.561 1.39 0 CA-C-O 125.296 2.474 . . . . 0.0 110.809 162.002 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 10' ' ' ARG . . . . . . . . . . . . . 2.3 tmm_? -176.35 107.76 0.08 Allowed 'General case' 0 C--N 1.304 -1.386 0 N-CA-C 103.399 -2.815 . . . . 0.0 103.399 -122.643 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 11' ' ' MET . . . . . 0.556 ' SD ' HD23 ' B' ' 19' ' ' LEU . 13.4 mtm -134.43 119.59 14.28 Favored Pre-proline 0 N--CA 1.484 1.235 0 CA-C-O 117.218 -1.373 . . . . 0.0 112.216 -161.428 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 12' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_exo -40.61 141.11 0.9 Allowed 'Trans proline' 0 C--N 1.372 1.8 0 C-N-CA 122.962 2.442 . . . . 0.0 116.192 160.991 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 13' ' ' MET . . . . . . . . . . . . . 27.2 tpp -58.98 -26.13 64.21 Favored 'General case' 0 N--CA 1.495 1.822 0 N-CA-C 118.378 2.733 . . . . 0.0 118.378 -157.754 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 14' ' ' GLU . . . . . . . . . . . . 0.252 6.4 pt-20 -64.4 -49.14 72.74 Favored 'General case' 0 CA--C 1.572 1.803 0 N-CA-C 116.213 1.931 . . . . 0.0 116.213 161.477 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -58.22 -47.0 88.56 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.301 0 CA-C-N 122.568 2.44 . . . . 0.0 113.309 173.646 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 2.7 ttt180 -75.06 -32.57 61.54 Favored 'General case' 0 CA--C 1.543 0.684 0 CA-C-O 116.305 -1.807 . . . . 0.0 115.763 175.652 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 17' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -61.39 -44.83 96.47 Favored 'General case' 0 N--CA 1.492 1.647 0 CA-C-N 123.23 2.741 . . . . 0.0 113.242 159.916 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 18' ' ' LYS . . . . . 0.407 ' HB3' HD13 ' A' ' 42' ' ' LEU 0.262 53.2 mtmt -58.74 -52.68 64.65 Favored 'General case' 0 CA--C 1.562 1.421 0 CA-C-N 121.173 1.806 . . . . 0.0 115.345 171.215 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 19' ' ' LEU . . . . . 0.556 HD23 ' SD ' ' B' ' 11' ' ' MET 0.26 12.5 tp -71.12 -36.35 72.1 Favored 'General case' 0 CA--C 1.563 1.444 0 N-CA-C 115.442 1.645 . . . . 0.0 115.442 178.41 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 20' ' ' LYS . . . . . 0.469 ' HB2' ' SD ' ' B' ' 30' ' ' MET . 18.3 ttpt -83.66 -20.81 32.92 Favored 'General case' 0 CA--C 1.584 2.262 0 N-CA-C 114.132 1.16 . . . . 0.0 114.132 172.756 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 21' ' ' PHE . . . . . 0.493 ' O ' ' HB3' ' B' ' 25' ' ' ALA . 9.4 m-30 -73.34 -65.88 0.76 Allowed 'General case' 0 N--CA 1.497 1.875 0 CA-C-N 122.547 2.43 . . . . 0.0 110.847 162.866 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . 0.311 0.2 OUTLIER -17.23 -52.57 0.01 OUTLIER 'General case' 0 CA--C 1.597 2.76 0 CA-C-N 124.79 3.45 . . . . 0.0 114.757 153.614 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 23' ' ' ALA . . . . . 0.479 ' HB2' ' CB ' ' B' ' 33' ' ' GLU . . . -58.27 -77.06 0.03 OUTLIER 'General case' 0 CA--C 1.575 1.905 0 N-CA-C 118.272 2.693 . . . . 0.0 118.272 158.975 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 58.0 mm-40 -75.5 -33.65 60.79 Favored 'General case' 0 CA--C 1.576 1.98 0 N-CA-C 118.303 2.705 . . . . 0.0 118.303 -174.996 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 25' ' ' ALA . . . . . 0.493 ' HB3' ' O ' ' B' ' 21' ' ' PHE . . . -45.61 -51.66 11.79 Favored 'General case' 0 CA--C 1.585 2.293 0 N-CA-C 116.009 1.855 . . . . 0.0 116.009 154.162 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 26' ' ' ASN . . . . . . . . . . . . . 90.8 m-20 -78.68 -53.02 7.59 Favored 'General case' 0 N--CA 1.499 1.989 0 N-CA-C 115.145 1.535 . . . . 0.0 115.145 174.867 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 27' ' ' GLY . . . . . . . . . . . . . . . 120.36 24.69 2.6 Favored Glycine 0 CA--C 1.562 2.99 0 N-CA-C 118.403 2.121 . . . . 0.0 118.403 -154.277 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 28' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -104.88 178.96 4.41 Favored 'General case' 0 CA--C 1.574 1.87 0 CA-C-N 120.211 2.005 . . . . 0.0 107.798 157.546 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 29' ' ' SER . . . . . 0.472 ' H ' ' HB2' ' B' ' 32' ' ' SER . 6.8 t -135.24 115.95 13.88 Favored 'General case' 0 N--CA 1.5 2.052 0 O-C-N 118.73 -2.481 . . . . 0.0 106.92 171.385 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 30' ' ' MET . . . . . 0.469 ' SD ' ' HB2' ' B' ' 20' ' ' LYS 0.355 2.7 ptm -48.84 -17.2 0.16 Allowed 'General case' 0 N--CA 1.506 2.341 1 N-CA-C 123.761 4.726 . . . . 0.0 123.761 -146.323 . . . . . . . . 4 3 . 1 . 010 nuclear build full ' B' B ' 31' ' ' ASN . . . . . . . . . . . . . 15.6 t-20 -56.29 -52.85 62.98 Favored 'General case' 0 CA--C 1.587 2.37 0 O-C-N 117.513 -3.242 . . . . 0.0 113.452 151.498 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 32' ' ' SER . . . . . 0.472 ' HB2' ' H ' ' B' ' 29' ' ' SER 0.299 71.0 m -49.37 -64.74 0.72 Allowed 'General case' 0 N--CA 1.496 1.849 0 N-CA-C 118.09 2.626 . . . . 0.0 118.09 150.329 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 33' ' ' GLU . . . . . 0.479 ' CB ' ' HB2' ' B' ' 23' ' ' ALA 0.27 4.9 tp10 -62.67 -60.15 3.91 Favored 'General case' 0 N--CA 1.513 2.676 0 CA-C-N 124.064 3.12 . . . . 0.0 114.449 -178.195 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 34' ' ' LEU . . . . . 0.541 HD22 HD21 ' B' ' 19' ' ' LEU 0.63 0.1 OUTLIER -53.57 -36.11 61.54 Favored 'General case' 0 CA--C 1.562 1.409 0 CA-C-O 114.607 -2.616 . . . . 0.0 106.548 -177.855 . . . . . . . . 4 4 . 1 . 010 nuclear build full ' B' B ' 35' ' ' LEU . . . . . 0.457 ' HG ' ' CE1' ' A' ' 9' ' ' PHE . 19.6 mt -66.16 -48.95 69.05 Favored 'General case' 0 C--N 1.37 1.484 0 CA-C-N 125.365 3.711 . . . . 0.0 115.926 167.361 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 36' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.14 -45.72 86.87 Favored 'General case' 0 N--CA 1.487 1.382 0 N-CA-C 114.671 1.36 . . . . 0.0 114.671 177.097 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 37' ' ' ILE . . . . . 0.42 ' HA ' ' HB3' ' B' ' 40' ' ' ASP . 3.0 tp -71.09 -28.46 33.06 Favored 'Isoleucine or valine' 0 CA--C 1.579 2.068 0 N-CA-C 116.851 2.167 . . . . 0.0 116.851 164.914 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 38' ' ' VAL . . . . . 0.433 HG21 HD12 ' B' ' 34' ' ' LEU . 2.8 t -83.75 -47.04 18.16 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.312 0 CA-C-N 124.265 3.211 . . . . 0.0 110.708 -177.923 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 26.1 mt-30 -54.53 -40.87 69.07 Favored 'General case' 0 CA--C 1.566 1.572 0 CA-C-O 118.093 -0.956 . . . . 0.0 112.268 158.038 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 40' ' ' ASP . . . . . 0.42 ' HB3' ' HA ' ' B' ' 37' ' ' ILE 0.315 24.9 t0 -46.75 -57.32 4.97 Favored 'General case' 0 N--CA 1.493 1.692 0 N-CA-C 115.881 1.808 . . . . 0.0 115.881 153.06 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 41' ' ' ALA . . . . . . . . . . . . 0.31 . . -78.83 -31.96 45.98 Favored 'General case' 0 N--CA 1.474 0.737 0 N-CA-C 119.12 3.007 . . . . 0.0 119.12 -155.18 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 42' ' ' LEU . . . . . 0.405 HD13 ' HB3' ' A' ' 18' ' ' LYS . 2.1 pp -107.1 -1.6 21.85 Favored 'General case' 0 CA--C 1.563 1.474 0 N-CA-C 117.261 2.319 . . . . 0.0 117.261 159.216 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 43' ' ' SER . . . . . . . . . . . . . 87.0 p -145.75 23.57 1.4 Allowed 'General case' 0 N--CA 1.494 1.755 0 N-CA-C 118.317 2.71 . . . . 0.0 118.317 -178.382 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 44' ' ' LYS . . . . . . . . . . . . . 10.7 tmtt? -64.73 -44.69 74.15 Favored Pre-proline 0 N--CA 1.505 2.281 0 N-CA-C 119.622 3.193 . . . . 0.0 119.622 174.4 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -79.91 68.12 8.4 Favored 'Trans proline' 0 CA--C 1.57 2.287 0 CA-C-N 124.949 2.803 . . . . 0.0 119.113 -161.136 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 46' ' ' SER . . . . . . . . . . . . . 68.7 m -90.27 -54.92 0.29 Allowed Pre-proline 0 CA--C 1.574 1.868 0 CA-C-O 116.54 -1.695 . . . . 0.0 111.241 137.992 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 93.1 Cg_endo -68.11 72.62 0.8 Allowed 'Trans proline' 0 CA--C 1.573 2.472 0 CA-C-N 124.669 2.703 . . . . 0.0 113.678 153.185 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 48' ' ' VAL . . . . . . . . . . . . . 13.1 p -80.48 -56.44 6.57 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.843 0 CA-C-N 114.816 -1.083 . . . . 0.0 113.712 -171.515 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 49' ' ' THR . . . . . . . . . . . . 0.307 17.2 p 66.84 53.75 0.84 Allowed 'General case' 0 N--CA 1.5 2.062 0 CA-C-O 122.667 1.222 . . . . 0.0 113.757 169.522 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 50' ' ' GLY . . . . . . . . . . . . . . . 90.85 -51.97 3.25 Favored Glycine 0 N--CA 1.493 2.496 0 N-CA-C 117.642 1.817 . . . . 0.0 117.642 -163.413 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 51' ' ' TYR . . . . . 0.43 ' CD2' ' HB3' ' A' ' 57' ' ' ARG 0.256 16.9 p90 -84.11 80.87 9.04 Favored 'General case' 0 CA--C 1.568 1.646 0 N-CA-C 117.903 2.557 . . . . 0.0 117.903 -159.055 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 52' ' ' ARG . . . . . . . . . . . . . 9.6 mpt_? -79.38 58.9 2.73 Favored 'General case' 0 N--CA 1.504 2.275 0 O-C-N 119.59 -1.944 . . . . 0.0 112.773 172.833 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 53' ' ' ASN . . . . . 0.452 ' HA ' ' HB2' ' B' ' 55' ' ' ALA . 7.4 m120 -141.88 -135.76 0.1 Allowed 'General case' 0 CA--C 1.601 2.942 0 O-C-N 120.261 -1.524 . . . . 0.0 108.861 -159.059 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 54' ' ' ASP . . . . . 0.499 ' C ' ' H ' ' B' ' 58' ' ' LEU 0.51 3.5 m-20 -6.31 91.02 0.01 OUTLIER 'General case' 0 N--CA 1.52 3.046 1 O-C-N 116.214 -4.053 . . . . 0.0 113.039 -97.5 . . . . . . . . 4 3 . 1 . 010 nuclear build full ' B' B ' 55' ' ' ALA . . . . . 0.789 ' HB3' ' H ' ' B' ' 57' ' ' ARG 0.561 . . -92.37 -131.47 0.12 Allowed 'General case' 0 N--CA 1.412 -2.331 0 CA-C-O 126.659 3.123 . . . . 0.0 109.951 -130.383 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 56' ' ' GLU . . . . . 0.441 ' HB2' ' CB ' ' B' ' 55' ' ' ALA . 0.9 OUTLIER -2.15 -38.95 0.0 OUTLIER 'General case' 0 CA--C 1.596 2.736 1 N-CA-C 123.289 4.552 . . . . 0.0 123.289 92.157 . . . . . . . . 4 4 . 1 . 010 nuclear build full ' B' B ' 57' ' ' ARG . . . . . 0.789 ' H ' ' HB3' ' B' ' 55' ' ' ALA . 3.7 tmt_? -75.36 -54.9 6.29 Favored 'General case' 0 CA--C 1.556 1.209 0 CA-C-O 115.299 -2.286 . . . . 0.0 116.391 161.164 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 58' ' ' LEU . . . . . 0.499 ' H ' ' C ' ' B' ' 54' ' ' ASP 0.307 11.6 mt -71.82 -20.77 61.79 Favored 'General case' 0 N--CA 1.507 2.375 0 CA-C-N 125.12 3.6 . . . . 0.0 115.009 172.135 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 59' ' ' ALA . . . . . . . . . . . . . . . -46.39 -56.5 5.79 Favored 'General case' 0 N--CA 1.477 0.877 0 N-CA-C 117.075 2.25 . . . . 0.0 117.075 142.817 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 60' ' ' ASP . . . . . 0.466 ' C ' ' H ' ' B' ' 64' ' ' GLU . 5.4 t70 -82.03 -3.03 53.67 Favored 'General case' 0 N--CA 1.483 1.211 0 N-CA-C 119.575 3.176 . . . . 0.0 119.575 -179.656 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 61' ' ' GLU . . . . . . . . . . . . 0.262 3.5 mm-40 -95.97 -50.74 4.74 Favored 'General case' 0 C--N 1.31 -1.145 0 CA-C-O 117.856 -1.069 . . . . 0.0 109.747 172.384 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 62' ' ' GLN . . . . . . . . . . . . 0.283 0.6 OUTLIER -61.13 -49.63 76.47 Favored 'General case' 0 CA--C 1.551 1.013 0 CA-C-N 122.355 2.343 . . . . 0.0 111.269 166.587 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 63' ' ' SER . . . . . 0.482 ' HA ' HG22 ' B' ' 66' ' ' VAL 0.354 28.6 t -123.76 34.64 5.03 Favored 'General case' 0 CA--C 1.556 1.185 0 N-CA-C 117.496 2.406 . . . . 0.0 117.496 -175.664 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 64' ' ' GLU . . . . . 0.466 ' H ' ' C ' ' B' ' 60' ' ' ASP 1.968 39.3 mt-10 -41.28 -67.52 0.25 Allowed 'General case' 0 N--CA 1.488 1.473 0 N-CA-C 119.811 3.263 . . . . 0.0 119.811 94.579 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 65' ' ' LEU . . . . . . . . . . . . 0.279 9.4 mp -77.41 -45.6 25.33 Favored 'General case' 0 CA--C 1.548 0.893 0 N-CA-C 117.752 2.501 . . . . 0.0 117.752 -145.315 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 66' ' ' VAL . . . . . 0.482 HG22 ' HA ' ' B' ' 63' ' ' SER . 8.1 m . . . . . 0 N--CA 1.516 2.871 1 N-CA-C 122.406 4.224 . . . . 0.0 122.406 146.539 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.562 1.435 0 N-CA-C 113.449 0.907 . . . . 0.0 113.449 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 29.7 mmt180 -89.02 75.3 7.99 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 120.953 -1.092 . . . . 0.0 113.364 -178.322 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . 0.252 28.7 t70 -152.58 -80.19 0.1 Allowed 'General case' 0 N--CA 1.488 1.426 0 C-N-CA 124.111 0.965 . . . . 0.0 110.492 170.232 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . 0.3 2.5 p30 -138.05 76.39 39.35 Favored Pre-proline 0 CA--C 1.567 1.614 0 O-C-N 121.176 -0.953 . . . . 0.0 113.361 170.243 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 47.8 Cg_endo -81.9 168.26 15.75 Favored 'Trans proline' 0 CA--C 1.567 2.159 0 C-N-CA 123.557 2.838 . . . . 0.0 115.983 176.492 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 65.0 m80 -108.75 144.93 35.91 Favored 'General case' 0 CA--C 1.567 1.607 0 CA-C-N 113.068 -1.878 . . . . 0.0 112.35 -165.438 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' PHE . . . . . 0.809 ' CZ ' HD12 ' B' ' 34' ' ' LEU . 20.2 p90 -138.46 150.08 46.1 Favored 'General case' 0 CA--C 1.564 1.51 0 O-C-N 120.062 -1.649 . . . . 0.0 111.397 142.63 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 11.7 m120 -71.98 83.48 0.96 Allowed 'General case' 0 N--CA 1.491 1.612 0 O-C-N 120.089 -1.632 . . . . 0.0 111.689 170.083 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' PHE . . . . . 0.683 ' CD2' HD13 ' B' ' 34' ' ' LEU . 6.1 t80 -64.09 147.19 52.76 Favored 'General case' 0 CA--C 1.55 0.943 0 CA-C-O 125.313 2.482 . . . . 0.0 112.026 167.717 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 2.7 tmm_? -144.27 110.06 5.31 Favored 'General case' 0 C--N 1.304 -1.379 0 CA-C-N 111.166 -2.743 . . . . 0.0 104.974 -152.369 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 1.2 mpp? -116.12 116.2 40.11 Favored Pre-proline 0 CA--C 1.562 1.437 0 CA-C-O 117.64 -1.172 . . . . 0.0 111.764 -170.536 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_exo -41.55 140.35 1.74 Allowed 'Trans proline' 0 CA--C 1.559 1.768 0 C-N-CA 122.958 2.439 . . . . 0.0 115.575 156.411 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' MET . . . . . 0.497 ' SD ' ' HG2' ' A' ' 17' ' ' GLU . 25.0 tpp -57.85 -29.04 64.66 Favored 'General case' 0 N--CA 1.496 1.858 0 N-CA-C 118.173 2.657 . . . . 0.0 118.173 -158.87 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -57.43 -52.21 66.29 Favored 'General case' 0 CA--C 1.566 1.594 0 N-CA-C 117.696 2.48 . . . . 0.0 117.696 160.343 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -58.79 -49.45 82.82 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.249 0 CA-C-N 122.087 2.221 . . . . 0.0 112.507 172.207 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . 0.262 1.1 ttt180 -72.39 -37.54 68.7 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-O 115.405 -2.236 . . . . 0.0 115.191 176.959 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.497 ' HG2' ' SD ' ' A' ' 13' ' ' MET . 41.8 mm-40 -62.42 -38.56 90.16 Favored 'General case' 0 CA--C 1.559 1.313 0 CA-C-N 124.485 3.311 . . . . 0.0 113.659 164.899 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . 0.576 26.5 pttt -74.72 -36.56 62.67 Favored 'General case' 0 CA--C 1.565 1.543 0 N-CA-C 117.777 2.51 . . . . 0.0 117.777 174.53 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.537 HD21 HD22 ' A' ' 34' ' ' LEU 0.253 11.2 tp -74.41 -34.91 63.38 Favored 'General case' 0 CA--C 1.574 1.891 0 N-CA-C 114.868 1.433 . . . . 0.0 114.868 167.978 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.408 ' HB2' ' SD ' ' A' ' 30' ' ' MET . 2.2 ttpt -91.09 -31.27 16.32 Favored 'General case' 0 CA--C 1.57 1.715 0 O-C-N 120.124 -1.61 . . . . 0.0 113.631 179.908 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 21' ' ' PHE . . . . . 0.44 ' O ' ' HB3' ' A' ' 25' ' ' ALA . 22.7 m-85 -57.41 -68.58 0.22 Allowed 'General case' 0 N--CA 1.496 1.828 0 CA-C-O 113.649 -3.072 . . . . 0.0 110.416 153.977 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.417 ' O ' ' HB3' ' A' ' 26' ' ' ASN 0.287 30.7 ttt85 -29.4 -43.38 0.03 OUTLIER 'General case' 0 CA--C 1.598 2.81 1 CA-C-N 126.017 4.008 . . . . 0.0 117.676 166.169 . . . . . . . . 4 3 . 1 . 011 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.477 ' HB2' ' CB ' ' A' ' 33' ' ' GLU 0.289 . . -60.05 -71.36 0.13 Allowed 'General case' 0 CA--C 1.589 2.476 0 O-C-N 118.484 -2.635 . . . . 0.0 116.93 159.508 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -63.39 -49.46 73.71 Favored 'General case' 0 N--CA 1.502 2.147 0 N-CA-C 118.477 2.769 . . . . 0.0 118.477 177.371 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.44 ' HB3' ' O ' ' A' ' 21' ' ' PHE . . . -40.19 -48.18 2.52 Favored 'General case' 0 CA--C 1.574 1.89 0 N-CA-C 118.409 2.744 . . . . 0.0 118.409 159.916 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 26' ' ' ASN . . . . . 0.417 ' HB3' ' O ' ' A' ' 22' ' ' ARG 0.296 0.8 OUTLIER -125.07 -9.26 7.12 Favored 'General case' 0 CA--C 1.58 2.111 0 N-CA-C 116.646 2.091 . . . . 0.0 116.646 -154.306 . . . . . . . . 4 4 . 1 . 011 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 115.59 29.64 2.41 Favored Glycine 0 N--CA 1.497 2.733 0 N-CA-C 119.21 2.444 . . . . 0.0 119.21 171.903 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.439 ' HE ' ' HG2' ' A' ' 33' ' ' GLU . 1.4 mpp_? -139.32 174.99 9.95 Favored 'General case' 0 CA--C 1.575 1.91 0 CA-C-N 119.201 1.5 . . . . 0.0 108.0 174.376 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 29' ' ' SER . . . . . 0.401 ' H ' ' HB3' ' A' ' 32' ' ' SER . 35.0 t -132.86 112.08 11.62 Favored 'General case' 0 N--CA 1.501 2.104 0 O-C-N 118.602 -2.561 . . . . 0.0 106.921 179.88 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 30' ' ' MET . . . . . 0.408 ' SD ' ' HB2' ' A' ' 20' ' ' LYS . 26.5 mtp -46.12 -31.78 2.56 Favored 'General case' 0 N--CA 1.501 2.105 0 N-CA-C 121.552 3.908 . . . . 0.0 121.552 -138.947 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . 0.275 5.6 t-20 -51.12 -50.91 57.92 Favored 'General case' 0 CA--C 1.59 2.486 0 O-C-N 118.506 -2.622 . . . . 0.0 114.11 160.51 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 32' ' ' SER . . . . . 0.401 ' HB3' ' H ' ' A' ' 29' ' ' SER 0.308 22.8 t -44.44 -68.08 0.23 Allowed 'General case' 0 N--CA 1.503 2.211 0 N-CA-C 117.055 2.243 . . . . 0.0 117.055 143.987 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 33' ' ' GLU . . . . . 0.477 ' CB ' ' HB2' ' A' ' 23' ' ' ALA . 4.9 tm-20 -70.28 -54.79 11.19 Favored 'General case' 0 N--CA 1.505 2.293 0 N-CA-C 118.606 2.817 . . . . 0.0 118.606 -168.157 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.537 HD22 HD21 ' A' ' 19' ' ' LEU 0.589 0.0 OUTLIER -52.2 -34.03 43.55 Favored 'General case' 0 CA--C 1.574 1.87 0 CA-C-O 114.192 -2.813 . . . . 0.0 107.618 168.549 . . . . . . . . 4 4 . 1 . 011 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 21.7 mt -65.7 -46.1 80.27 Favored 'General case' 0 N--CA 1.495 1.787 1 CA-C-N 126.835 4.379 . . . . 0.0 116.257 164.853 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -60.92 -45.1 96.03 Favored 'General case' 0 N--CA 1.488 1.455 0 N-CA-C 114.779 1.4 . . . . 0.0 114.779 178.606 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . 0.27 2.8 tt -60.56 -46.36 95.68 Favored 'Isoleucine or valine' 0 CA--C 1.566 1.573 0 CA-C-O 114.866 -2.492 . . . . 0.0 116.453 156.553 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.433 HG12 ' CG1' ' B' ' 15' ' ' VAL . 3.3 t -71.26 -44.75 72.89 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.215 0 CA-C-N 123.93 3.059 . . . . 0.0 111.676 -169.747 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 23.8 mt-30 -55.7 -45.61 77.83 Favored 'General case' 0 CA--C 1.565 1.551 0 C-N-CA 124.423 1.089 . . . . 0.0 112.776 158.503 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . 0.475 0.9 OUTLIER -49.52 -34.84 18.29 Favored 'General case' 0 N--CA 1.5 2.055 0 N-CA-C 118.648 2.832 . . . . 0.0 118.648 156.74 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -78.36 -70.2 0.51 Allowed 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 123.914 0.886 . . . . 0.0 111.113 -166.509 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 2.6 pp -86.03 17.3 3.61 Favored 'General case' 0 CA--C 1.569 1.69 0 N-CA-C 118.102 2.63 . . . . 0.0 118.102 171.46 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 5.1 t -114.21 -34.58 5.29 Favored 'General case' 0 N--CA 1.495 1.784 0 N-CA-C 117.435 2.383 . . . . 0.0 117.435 155.804 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . 0.283 47.3 tttt -96.21 -28.89 0.26 Allowed Pre-proline 0 N--CA 1.506 2.364 1 N-CA-C 122.667 4.321 . . . . 0.0 122.667 -150.238 . . . . . . . . 3 2 . 1 . 011 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 92.6 Cg_endo -82.55 119.23 2.97 Favored 'Trans proline' 0 CA--C 1.564 1.98 0 CA-C-N 126.878 3.492 . . . . 0.0 118.317 -168.032 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 75.7 m -74.65 153.94 87.41 Favored Pre-proline 0 CA--C 1.584 2.263 0 CA-C-N 114.867 -1.06 . . . . 0.0 112.722 130.624 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 95.0 Cg_endo -69.49 96.54 0.57 Allowed 'Trans proline' 0 CA--C 1.566 2.11 0 C-N-CA 122.497 2.131 . . . . 0.0 113.584 172.766 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 48' ' ' VAL . . . . . 0.531 HG13 HG22 ' A' ' 49' ' ' THR . 7.6 p -105.16 152.68 6.99 Favored 'Isoleucine or valine' 0 CA--C 1.567 1.628 0 CA-C-O 121.917 0.865 . . . . 0.0 111.9 -170.342 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 49' ' ' THR . . . . . 0.531 HG22 HG13 ' A' ' 48' ' ' VAL 0.452 12.3 t 66.48 -163.89 0.23 Allowed 'General case' 0 N--CA 1.499 2.012 0 N-CA-C 116.627 2.084 . . . . 0.0 116.627 151.556 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -81.32 -48.69 5.85 Favored Glycine 0 N--CA 1.494 2.53 0 CA-C-N 113.331 -1.759 . . . . 0.0 117.398 -173.295 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 51' ' ' TYR . . . . . 0.487 ' OH ' ' HB2' ' B' ' 60' ' ' ASP 0.36 0.0 OUTLIER -71.95 30.19 0.05 Allowed 'General case' 0 CA--C 1.59 2.51 0 N-CA-C 118.624 2.824 . . . . 0.0 118.624 171.584 . . . . . . . . 4 4 . 1 . 011 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . 0.628 0.0 OUTLIER 104.66 -102.75 0.0 OUTLIER 'General case' 0 CA--C 1.587 2.372 1 N-CA-C 121.893 4.034 . . . . 0.0 121.893 158.243 . . . . . . . . 4 3 . 1 . 011 nuclear build full ' A' A ' 53' ' ' ASN . . . . . 0.548 ' HB2' ' H ' ' A' ' 56' ' ' GLU . 0.0 OUTLIER -109.67 -172.05 1.96 Allowed 'General case' 0 CA--C 1.582 2.192 2 O-C-N 110.624 -7.548 . . . . 0.0 115.984 33.146 . . . . . . . . 4 4 . 1 . 011 nuclear build full ' A' A ' 54' ' ' ASP . . . . . 0.702 ' H ' ' HA ' ' B' ' 53' ' ' ASN 1.131 1.3 p30 -114.66 19.41 16.04 Favored 'General case' 0 N--CA 1.499 1.98 1 N-CA-C 121.825 4.009 . . . . 0.0 121.825 140.334 . . . . . . . . 4 3 . 1 . 011 nuclear build full ' A' A ' 55' ' ' ALA . . . . . 0.482 ' HB2' ' CB ' ' B' ' 55' ' ' ALA 0.413 . . -94.33 -18.33 21.71 Favored 'General case' 0 CA--C 1.603 2.994 0 N-CA-C 118.111 2.634 . . . . 0.0 118.111 140.253 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.801 ' O ' ' HB3' ' A' ' 59' ' ' ALA . 10.9 tm-20 -51.82 -22.75 3.95 Favored 'General case' 0 CA--C 1.583 2.239 1 O-C-N 115.494 -4.504 . . . . 0.0 114.375 129.806 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.5 ' H ' ' HA ' ' A' ' 54' ' ' ASP 1.711 0.0 OUTLIER -77.42 -9.83 59.1 Favored 'General case' 0 CA--C 1.588 2.408 1 O-C-N 115.053 -4.779 . . . . 0.0 114.739 160.395 . . . . . . . . 5 4 . 1 . 011 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.464 ' H ' ' HA ' ' A' ' 55' ' ' ALA 2.16 1.8 pp -62.19 -24.97 67.52 Favored 'General case' 0 CA--C 1.609 3.232 0 O-C-N 116.871 -3.643 . . . . 0.0 113.039 150.122 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 59' ' ' ALA . . . . . 0.801 ' HB3' ' O ' ' A' ' 56' ' ' GLU . . . -54.65 -19.97 7.2 Favored 'General case' 0 N--CA 1.521 3.102 1 O-C-N 114.763 -4.961 . . . . 0.0 119.662 139.513 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 60' ' ' ASP . . . . . 0.431 ' H ' ' C ' ' A' ' 57' ' ' ARG 0.539 0.0 OUTLIER -75.79 -1.35 24.65 Favored 'General case' 0 N--CA 1.522 3.133 1 N-CA-C 123.614 4.672 . . . . 0.0 123.614 141.834 . . . . . . . . 5 4 . 1 . 011 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . 0.466 0.0 OUTLIER -58.38 -25.18 61.76 Favored 'General case' 0 N--CA 1.519 3.019 0 O-C-N 119.469 -2.019 . . . . 0.0 116.018 129.989 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 62' ' ' GLN . . . . . 0.645 ' O ' HG13 ' A' ' 66' ' ' VAL 0.468 0.6 OUTLIER -69.15 -47.96 63.6 Favored 'General case' 0 N--CA 1.498 1.947 0 CA-C-O 116.42 -1.752 . . . . 0.0 112.866 161.931 . . . . . . . . 4 4 . 1 . 011 nuclear build full ' A' A ' 63' ' ' SER . . . . . . . . . . . . 0.314 50.2 m -28.31 -51.56 0.08 Allowed 'General case' 0 N--CA 1.528 3.437 0 CA-C-N 122.543 2.429 . . . . 0.0 116.015 155.158 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . 0.321 2.4 tm-20 -83.66 -31.96 25.88 Favored 'General case' 0 CA--C 1.579 2.088 0 CA-C-N 112.94 -1.936 . . . . 0.0 115.397 -166.821 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 4.6 pp -58.34 -31.38 67.52 Favored 'General case' 0 N--CA 1.51 2.53 0 N-CA-C 117.57 2.433 . . . . 0.0 117.57 148.731 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.645 HG13 ' O ' ' A' ' 62' ' ' GLN 0.413 1.3 m . . . . . 0 CA--C 1.592 2.593 0 CA-C-N 120.725 1.602 . . . . 0.0 111.175 177.976 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.562 1.437 0 N-CA-C 113.374 0.879 . . . . 0.0 113.374 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 2' ' ' ARG . . . . . . . . . . . . . 84.2 mtt85 -86.88 82.49 7.79 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.232 -0.918 . . . . 0.0 111.64 177.858 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 26.0 m-20 -129.73 81.77 2.03 Favored 'General case' 0 N--CA 1.489 1.51 0 N-CA-C 107.586 -1.265 . . . . 0.0 107.586 -179.587 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 4' ' ' ASP . . . . . . . . . . . . . 3.4 p30 -154.91 92.93 2.81 Favored Pre-proline 0 CA--C 1.566 1.584 0 CA-C-O 117.926 -1.035 . . . . 0.0 111.016 -179.464 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -94.92 140.28 1.12 Allowed 'Trans proline' 0 C--N 1.364 1.369 0 CA-C-N 123.005 2.109 . . . . 0.0 113.991 -163.489 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 6' ' ' HIS . . . . . . . . . . . . . 75.0 m80 -82.04 115.24 21.09 Favored 'General case' 0 CA--C 1.567 1.601 0 CA-C-N 114.137 -1.392 . . . . 0.0 111.109 170.833 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 7' ' ' PHE . . . . . 0.489 ' CZ ' HD23 ' A' ' 34' ' ' LEU . 1.1 p90 -118.51 150.23 39.97 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 120.856 -1.153 . . . . 0.0 109.855 159.959 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 8' ' ' ASN . . . . . . . . . . . . . 18.2 m120 -68.94 91.02 0.45 Allowed 'General case' 0 N--CA 1.489 1.492 0 O-C-N 120.472 -1.392 . . . . 0.0 112.512 171.077 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 9' ' ' PHE . . . . . 0.544 ' HD2' HD11 ' B' ' 34' ' ' LEU . 4.4 t80 -77.8 146.42 35.8 Favored 'General case' 0 CA--C 1.564 1.486 0 CA-C-O 125.836 2.732 . . . . 0.0 109.592 153.725 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 177.78 102.75 0.02 OUTLIER 'General case' 0 N--CA 1.487 1.381 0 CA-C-N 112.59 -2.095 . . . . 0.0 106.699 -130.363 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 11' ' ' MET . . . . . 0.499 ' SD ' ' HG3' ' B' ' 16' ' ' ARG . 0.9 OUTLIER -132.73 136.53 27.96 Favored Pre-proline 0 N--CA 1.491 1.623 0 CA-C-O 117.549 -1.215 . . . . 0.0 113.677 -154.486 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 12' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -59.19 154.25 47.34 Favored 'Trans proline' 0 CA--C 1.565 2.041 0 CA-C-N 122.692 1.997 . . . . 0.0 114.087 168.517 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 13' ' ' MET . . . . . 0.431 ' SD ' ' HG3' ' B' ' 17' ' ' GLU . 4.7 tpp -61.77 -37.45 84.35 Favored 'General case' 0 N--CA 1.487 1.422 0 N-CA-C 118.365 2.728 . . . . 0.0 118.365 -146.66 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 -61.81 -40.92 96.93 Favored 'General case' 0 CA--C 1.566 1.566 0 N-CA-C 116.428 2.01 . . . . 0.0 116.428 167.139 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 15' ' ' VAL . . . . . 0.433 ' CG1' HG12 ' A' ' 38' ' ' VAL . 0.2 OUTLIER -63.09 -49.43 83.4 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.08 0 CA-C-N 123.293 2.769 . . . . 0.0 111.921 171.788 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 16' ' ' ARG . . . . . 0.499 ' HG3' ' SD ' ' B' ' 11' ' ' MET 0.296 6.0 ttt180 -70.45 -37.05 74.28 Favored 'General case' 0 N--CA 1.477 0.908 0 CA-C-N 121.729 2.059 . . . . 0.0 115.997 175.341 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 17' ' ' GLU . . . . . 0.431 ' HG3' ' SD ' ' B' ' 13' ' ' MET . 37.6 mt-10 -63.03 -39.44 94.74 Favored 'General case' 0 N--CA 1.491 1.609 0 CA-C-N 123.548 2.886 . . . . 0.0 114.234 163.473 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . 0.257 53.6 mtmt -65.0 -49.09 71.61 Favored 'General case' 0 CA--C 1.563 1.452 0 CA-C-N 121.921 2.146 . . . . 0.0 115.344 170.352 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 19' ' ' LEU . . . . . 0.505 HD21 ' CD2' ' B' ' 34' ' ' LEU 0.263 11.9 tp -65.75 -39.69 91.33 Favored 'General case' 0 CA--C 1.568 1.668 0 CA-C-N 120.759 1.618 . . . . 0.0 114.336 173.791 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 20' ' ' LYS . . . . . . . . . . . . . 12.1 ttpt -84.84 -31.31 23.88 Favored 'General case' 0 CA--C 1.557 1.238 0 C-N-CA 125.244 1.418 . . . . 0.0 114.36 179.621 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 20.0 m-85 -60.91 -74.1 0.08 Allowed 'General case' 0 N--CA 1.49 1.531 0 CA-C-O 112.282 -3.723 . . . . 0.0 110.583 154.711 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . 0.292 8.7 ttt180 -16.84 -57.96 0.01 OUTLIER 'General case' 0 CA--C 1.586 2.347 1 CA-C-N 126.487 4.221 . . . . 0.0 116.699 168.866 . . . . . . . . 3 2 . 1 . 011 nuclear build full ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -53.41 -72.31 0.06 Allowed 'General case' 0 CA--C 1.583 2.242 1 N-CA-C 122.153 4.131 . . . . 0.0 122.153 156.896 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 49.3 mt-10 -66.92 -38.71 86.72 Favored 'General case' 0 N--CA 1.505 2.305 0 N-CA-C 118.138 2.644 . . . . 0.0 118.138 177.144 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 25' ' ' ALA . . . . . . . . . . . . . . . -38.5 -48.47 1.4 Allowed 'General case' 0 CA--C 1.585 2.325 0 N-CA-C 116.493 2.034 . . . . 0.0 116.493 155.883 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 26' ' ' ASN . . . . . 0.415 HD21 ' HB2' ' B' ' 28' ' ' ARG . 0.0 OUTLIER -101.27 -48.01 4.52 Favored 'General case' 0 CA--C 1.578 2.031 0 N-CA-C 116.626 2.084 . . . . 0.0 116.626 -173.748 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 27' ' ' GLY . . . . . . . . . . . . . . . 117.95 39.41 0.76 Allowed Glycine 0 CA--C 1.558 2.754 0 N-CA-C 117.774 1.87 . . . . 0.0 117.774 -157.75 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 28' ' ' ARG . . . . . 0.415 ' HB2' HD21 ' B' ' 26' ' ' ASN . 3.1 mtt85 -138.14 97.97 3.52 Favored 'General case' 0 N--CA 1.492 1.663 0 CA-C-N 119.936 1.868 . . . . 0.0 106.078 174.852 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 29' ' ' SER . . . . . . . . . . . . . 32.2 t -75.82 127.88 33.96 Favored 'General case' 0 N--CA 1.504 2.26 0 O-C-N 117.758 -3.089 . . . . 0.0 107.92 -162.301 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 30' ' ' MET . . . . . . . . . . . . . 25.4 mtp -44.93 -42.7 8.35 Favored 'General case' 0 N--CA 1.503 2.198 0 N-CA-C 118.663 2.838 . . . . 0.0 118.663 -144.973 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 31' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -46.26 -40.7 11.93 Favored 'General case' 0 CA--C 1.595 2.688 0 CA-C-N 125.245 3.657 . . . . 0.0 115.788 165.899 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 32' ' ' SER . . . . . . . . . . . . 0.28 40.4 t -56.4 -66.36 0.45 Allowed 'General case' 0 N--CA 1.498 1.963 0 N-CA-C 119.361 3.097 . . . . 0.0 119.361 148.133 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 8.1 tp10 -66.22 -56.27 12.12 Favored 'General case' 0 N--CA 1.515 2.807 0 CA-C-N 124.007 3.094 . . . . 0.0 114.739 -177.857 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 34' ' ' LEU . . . . . 0.809 HD12 ' CZ ' ' A' ' 7' ' ' PHE . 0.0 OUTLIER -37.64 -52.61 1.23 Allowed 'General case' 0 CA--C 1.546 0.81 0 CA-C-O 115.614 -2.136 . . . . 0.0 109.379 165.935 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 35' ' ' LEU . . . . . 0.417 HD23 ' HA ' ' B' ' 35' ' ' LEU . 9.5 mt -62.37 -53.13 59.42 Favored 'General case' 0 N--CA 1.485 1.321 0 CA-C-N 123.984 3.084 . . . . 0.0 115.306 175.148 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 36' ' ' GLN . . . . . . . . . . . . 0.271 0.5 OUTLIER -63.89 -33.12 74.99 Favored 'General case' 0 CA--C 1.58 2.109 0 N-CA-C 115.963 1.838 . . . . 0.0 115.963 179.644 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 37' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -71.71 -31.05 40.41 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.703 0 CA-C-N 121.058 1.754 . . . . 0.0 115.183 160.905 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 38' ' ' VAL . . . . . 0.429 ' CG1' HD22 ' A' ' 19' ' ' LEU . 2.4 t -80.15 -49.02 19.58 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.262 0 CA-C-N 122.682 2.492 . . . . 0.0 112.328 -179.033 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 32.4 mt-30 -47.01 -41.41 16.39 Favored 'General case' 0 CA--C 1.563 1.448 0 CA-C-O 116.72 -1.61 . . . . 0.0 113.856 149.447 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 40' ' ' ASP . . . . . . . . . . . . 0.447 8.1 t70 -51.32 -55.07 20.33 Favored 'General case' 0 N--CA 1.497 1.899 0 CA-C-N 121.766 2.075 . . . . 0.0 115.936 155.212 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -73.63 -33.31 64.49 Favored 'General case' 0 CA--C 1.552 1.023 0 N-CA-C 116.431 2.012 . . . . 0.0 116.431 -153.467 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -104.82 -10.01 17.66 Favored 'General case' 0 N--CA 1.488 1.444 0 N-CA-C 118.691 2.849 . . . . 0.0 118.691 156.273 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 43' ' ' SER . . . . . . . . . . . . . 60.0 p -140.32 6.34 2.12 Favored 'General case' 0 N--CA 1.496 1.873 0 N-CA-C 120.675 3.583 . . . . 0.0 120.675 -173.979 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 44' ' ' LYS . . . . . . . . . . . . 0.4 1.6 mtmt -65.36 139.87 97.54 Favored Pre-proline 0 N--CA 1.53 3.542 1 CA-C-N 126.103 4.047 . . . . 0.0 114.807 -174.377 . . . . . . . . 3 2 . 1 . 011 nuclear build full ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 42.8 Cg_exo -48.31 131.09 22.18 Favored 'Trans proline' 0 C--N 1.379 2.14 0 N-CA-C 120.432 3.205 . . . . 0.0 120.432 -155.46 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 46' ' ' SER . . . . . 0.431 ' HA ' ' HA ' ' B' ' 47' ' ' PRO . 91.0 p -139.97 100.09 7.31 Favored Pre-proline 0 CA--C 1.57 1.745 0 CA-C-O 117.735 -1.126 . . . . 0.0 113.379 -159.801 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 47' ' ' PRO . . . . . 0.431 ' HA ' ' HA ' ' B' ' 46' ' ' SER . 81.7 Cg_endo -81.5 143.83 59.88 Favored 'Cis proline' 0 CA--C 1.571 2.328 0 CA-C-N 122.787 2.031 . . . . 0.0 116.101 -3.121 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 48' ' ' VAL . . . . . . . . . . . . . 96.1 t -75.51 -38.03 38.45 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.423 0 O-C-N 120.46 -1.4 . . . . 0.0 112.053 141.607 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 49' ' ' THR . . . . . 0.569 HG23 ' H ' ' B' ' 50' ' ' GLY 0.284 4.2 t -168.26 -75.86 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.714 0 CA-C-O 123.585 1.659 . . . . 0.0 108.681 -155.838 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 50' ' ' GLY . . . . . 0.569 ' H ' HG23 ' B' ' 49' ' ' THR . . . 166.29 87.13 0.06 OUTLIER Glycine 0 CA--C 1.549 2.214 0 CA-C-N 112.094 -2.321 . . . . 0.0 115.066 156.195 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 51' ' ' TYR . . . . . . . . . . . . 0.313 1.4 m-30 62.65 66.17 0.78 Allowed 'General case' 0 CA--C 1.577 2.0 2 O-C-N 113.646 -5.62 . . . . 0.0 117.268 -16.186 . . . . . . . . 3 2 . 1 . 011 nuclear build full ' B' B ' 52' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -154.64 112.4 3.45 Favored 'General case' 0 N--CA 1.5 2.05 0 C-N-CA 124.307 1.043 . . . . 0.0 108.8 174.238 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 53' ' ' ASN . . . . . 0.702 ' HA ' ' H ' ' A' ' 54' ' ' ASP 0.762 0.2 OUTLIER -70.49 119.23 14.35 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 118.669 -2.52 . . . . 0.0 111.595 -171.886 . . . . . . . . 4 4 . 1 . 011 nuclear build full ' B' B ' 54' ' ' ASP . . . . . 0.671 ' C ' ' H ' ' B' ' 57' ' ' ARG 2.402 0.0 OUTLIER 59.94 5.11 0.69 Allowed 'General case' 0 N--CA 1.521 3.091 1 O-C-N 115.315 -4.616 . . . . 0.0 115.807 12.37 . . . . . . . . 5 4 . 1 . 011 nuclear build full ' B' B ' 55' ' ' ALA . . . . . 0.616 ' N ' ' H ' ' B' ' 57' ' ' ARG 1.849 . . -124.57 -43.25 2.04 Favored 'General case' 0 CA--C 1.57 1.713 0 O-C-N 118.216 -2.803 . . . . 0.0 112.725 -179.907 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 56' ' ' GLU . . . . . 0.844 ' O ' ' HB3' ' B' ' 59' ' ' ALA 0.279 6.7 tp10 -2.96 -36.8 0.0 OUTLIER 'General case' 0 CA--C 1.618 3.562 1 N-CA-C 124.172 4.879 . . . . 0.0 124.172 94.517 . . . . . . . . 4 3 . 1 . 011 nuclear build full ' B' B ' 57' ' ' ARG . . . . . 0.671 ' H ' ' C ' ' B' ' 54' ' ' ASP 0.289 45.6 ttt-85 -65.05 -48.72 72.8 Favored 'General case' 0 N--CA 1.501 2.123 1 O-C-N 116.174 -4.078 . . . . 0.0 111.562 152.274 . . . . . . . . 4 3 . 1 . 011 nuclear build full ' B' B ' 58' ' ' LEU . . . . . . . . . . . . 0.264 5.2 mt -58.36 -24.83 61.03 Favored 'General case' 0 N--CA 1.507 2.419 0 N-CA-C 114.146 1.165 . . . . 0.0 114.146 170.828 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 59' ' ' ALA . . . . . 0.844 ' HB3' ' O ' ' B' ' 56' ' ' GLU . . . -44.22 -88.31 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.564 0 CA-C-O 116.021 -1.943 . . . . 0.0 114.721 137.1 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 60' ' ' ASP . . . . . 0.487 ' HB2' ' OH ' ' A' ' 51' ' ' TYR . 4.1 m-20 -69.32 -6.41 29.48 Favored 'General case' 0 N--CA 1.497 1.876 0 N-CA-C 119.72 3.23 . . . . 0.0 119.72 -161.499 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 13.2 mm-40 -83.2 -51.54 7.39 Favored 'General case' 0 N--CA 1.483 1.199 0 CA-C-O 117.245 -1.36 . . . . 0.0 114.201 157.663 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -77.43 -69.6 0.52 Allowed 'General case' 0 C--N 1.358 0.953 0 CA-C-N 123.107 2.685 . . . . 0.0 108.674 175.358 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 63' ' ' SER . . . . . 0.792 ' HA ' HG11 ' B' ' 66' ' ' VAL 0.322 4.0 t -67.01 43.39 0.03 OUTLIER 'General case' 0 CA--C 1.577 1.994 0 N-CA-C 119.158 3.021 . . . . 0.0 119.158 159.293 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 64' ' ' GLU . . . . . . . . . . . . . 5.8 tt0 -142.42 16.49 2.03 Favored 'General case' 0 CA--C 1.582 2.21 0 O-C-N 119.258 -2.151 . . . . 0.0 116.754 121.479 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 45.6 mt -106.33 -35.86 7.02 Favored 'General case' 0 N--CA 1.512 2.637 0 CA-C-N 122.048 2.203 . . . . 0.0 114.767 165.844 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 66' ' ' VAL . . . . . 0.792 HG11 ' HA ' ' B' ' 63' ' ' SER . 7.6 p . . . . . 0 N--CA 1.499 2.014 1 N-CA-C 124.06 4.837 . . . . 0.0 124.06 143.68 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.563 1.457 0 N-CA-C 113.477 0.917 . . . . 0.0 113.477 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 -81.51 74.09 8.52 Favored 'General case' 0 N--CA 1.498 1.95 0 O-C-N 121.021 -1.049 . . . . 0.0 112.763 -178.876 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -123.44 76.31 1.39 Allowed 'General case' 0 N--CA 1.491 1.608 0 N-CA-C 107.559 -1.274 . . . . 0.0 107.559 -179.812 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 12.1 p-10 -154.66 81.56 4.34 Favored Pre-proline 0 CA--C 1.57 1.714 0 O-C-N 121.499 -0.751 . . . . 0.0 110.485 177.48 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_exo -98.21 145.95 0.64 Allowed 'Trans proline' 0 C--N 1.364 1.39 0 CA-C-N 123.059 2.128 . . . . 0.0 114.537 -153.793 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 81.0 m80 -75.46 132.85 41.1 Favored 'General case' 0 CA--C 1.563 1.475 0 CA-C-N 113.999 -1.455 . . . . 0.0 112.603 174.569 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' PHE . . . . . 0.645 ' CZ ' HD23 ' B' ' 34' ' ' LEU . 5.1 p90 -133.28 154.21 50.89 Favored 'General case' 0 CA--C 1.563 1.444 0 O-C-N 120.815 -1.178 . . . . 0.0 110.412 146.843 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 4.2 p-10 -59.77 86.44 0.01 OUTLIER 'General case' 0 CA--C 1.566 1.568 0 N-CA-C 115.744 1.757 . . . . 0.0 115.744 168.193 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' PHE . . . . . 0.424 ' HD2' HD21 ' A' ' 34' ' ' LEU 0.26 2.6 t80 -82.26 141.51 32.88 Favored 'General case' 0 CA--C 1.564 1.511 0 CA-C-O 126.375 2.988 . . . . 0.0 110.273 162.019 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 23.2 ttt85 -166.56 121.43 1.13 Allowed 'General case' 0 C--N 1.309 -1.174 0 CA-C-N 111.466 -2.607 . . . . 0.0 107.911 -146.482 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 2.3 mpt? -133.63 119.49 15.09 Favored Pre-proline 0 CA--C 1.56 1.336 0 CA-C-O 117.73 -1.129 . . . . 0.0 111.314 -148.498 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_exo -46.59 146.27 5.47 Favored 'Trans proline' 0 CA--C 1.561 1.841 0 C-N-CA 122.68 2.253 . . . . 0.0 114.931 161.61 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.4 tpp -64.83 -27.99 69.25 Favored 'General case' 0 CA--C 1.568 1.672 0 N-CA-C 118.386 2.736 . . . . 0.0 118.386 -151.188 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . 0.25 8.2 pt-20 -64.63 -43.71 92.83 Favored 'General case' 0 CA--C 1.566 1.593 0 N-CA-C 116.654 2.094 . . . . 0.0 116.654 160.609 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -59.7 -48.2 88.38 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.275 0 CA-C-N 123.269 2.759 . . . . 0.0 112.603 173.231 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 2.0 ttt180 -71.36 -40.28 70.76 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-O 116.265 -1.826 . . . . 0.0 115.611 174.486 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -60.85 -38.71 86.45 Favored 'General case' 0 CA--C 1.567 1.62 0 CA-C-N 123.349 2.795 . . . . 0.0 114.007 166.036 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 52.2 mtmt -66.9 -51.1 59.46 Favored 'General case' 0 CA--C 1.562 1.42 0 CA-C-N 121.362 1.892 . . . . 0.0 115.363 170.791 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.626 HD21 HD22 ' A' ' 34' ' ' LEU 0.281 14.1 tp -65.44 -39.76 92.46 Favored 'General case' 0 CA--C 1.566 1.564 0 N-CA-C 115.542 1.682 . . . . 0.0 115.542 173.863 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 18.9 ttpt -88.2 -25.97 22.63 Favored 'General case' 0 CA--C 1.567 1.629 0 C-N-CA 124.923 1.289 . . . . 0.0 113.922 -179.754 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' PHE . . . . . 0.456 ' O ' ' HB3' ' A' ' 25' ' ' ALA . 19.5 m-30 -67.47 -66.72 0.53 Allowed 'General case' 0 N--CA 1.493 1.693 0 CA-C-O 113.929 -2.938 . . . . 0.0 110.812 158.545 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . 0.336 1.6 tmt_? -27.04 -45.99 0.03 OUTLIER 'General case' 0 CA--C 1.602 2.944 0 CA-C-N 125.699 3.863 . . . . 0.0 114.614 164.528 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.498 ' HB2' ' HB3' ' A' ' 33' ' ' GLU . . . -59.73 -74.87 0.06 Allowed 'General case' 0 CA--C 1.585 2.29 0 N-CA-C 117.298 2.333 . . . . 0.0 117.298 159.314 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -68.97 -39.52 79.41 Favored 'General case' 0 N--CA 1.502 2.141 0 N-CA-C 118.72 2.859 . . . . 0.0 118.72 -179.023 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.456 ' HB3' ' O ' ' A' ' 21' ' ' PHE . . . -41.83 -51.38 4.27 Favored 'General case' 0 CA--C 1.587 2.397 0 N-CA-C 115.929 1.826 . . . . 0.0 115.929 157.084 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 84.8 m-20 -83.13 -48.21 10.8 Favored 'General case' 0 N--CA 1.5 2.041 0 N-CA-C 116.126 1.899 . . . . 0.0 116.126 177.22 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 119.45 26.87 2.3 Favored Glycine 0 CA--C 1.56 2.886 0 N-CA-C 118.651 2.22 . . . . 0.0 118.651 -157.775 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 24.5 mtm-85 -115.7 158.89 22.11 Favored 'General case' 0 N--CA 1.491 1.594 0 CA-C-N 119.696 1.748 . . . . 0.0 107.161 167.066 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 43.1 t -114.6 113.73 24.77 Favored 'General case' 0 N--CA 1.496 1.845 0 N-CA-C 104.35 -2.463 . . . . 0.0 104.35 -178.082 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 6.2 mtp -38.03 -40.32 0.47 Allowed 'General case' 0 N--CA 1.501 2.084 0 N-CA-C 121.01 3.708 . . . . 0.0 121.01 -152.111 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . 0.253 0.1 OUTLIER -47.87 -46.79 31.71 Favored 'General case' 0 CA--C 1.592 2.56 0 O-C-N 118.575 -2.578 . . . . 0.0 115.446 163.93 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . 0.354 38.4 t -47.4 -76.14 0.02 OUTLIER 'General case' 0 N--CA 1.5 2.064 0 N-CA-C 118.151 2.649 . . . . 0.0 118.151 142.444 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 33' ' ' GLU . . . . . 0.498 ' HB3' ' HB2' ' A' ' 23' ' ' ALA . 8.5 tp10 -62.87 -56.76 14.42 Favored 'General case' 0 N--CA 1.507 2.39 0 CA-C-N 123.185 2.72 . . . . 0.0 117.261 -170.057 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.734 HD23 ' CZ ' ' B' ' 7' ' ' PHE 0.458 0.4 OUTLIER -47.04 -42.01 17.74 Favored 'General case' 0 CA--C 1.563 1.445 0 CA-C-O 113.274 -3.251 . . . . 0.0 107.313 168.863 . . . . . . . . 4 4 . 1 . 012 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 12.8 mt -61.09 -48.09 83.32 Favored 'General case' 0 N--CA 1.499 1.996 1 CA-C-N 127.11 4.504 . . . . 0.0 116.529 166.201 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.28 -43.32 99.07 Favored 'General case' 0 N--CA 1.487 1.41 0 N-CA-C 115.544 1.683 . . . . 0.0 115.544 -179.145 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 5.4 tt -67.57 -35.44 73.09 Favored 'Isoleucine or valine' 0 C--O 1.199 -1.597 0 CA-C-O 114.29 -2.767 . . . . 0.0 115.781 160.508 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.417 HG21 HD12 ' A' ' 34' ' ' LEU . 2.1 t -75.04 -47.67 35.51 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.143 0 CA-C-N 124.398 3.272 . . . . 0.0 112.619 -174.527 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 32.9 mt-30 -50.52 -46.71 57.41 Favored 'General case' 0 N--CA 1.486 1.341 0 N-CA-C 113.116 0.784 . . . . 0.0 113.116 156.026 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . 0.807 0.0 OUTLIER -55.83 -34.24 65.2 Favored 'General case' 0 CA--C 1.576 1.972 0 N-CA-C 119.555 3.169 . . . . 0.0 119.555 159.971 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -77.46 -49.62 14.4 Favored 'General case' 0 N--CA 1.481 1.105 0 N-CA-C 115.142 1.534 . . . . 0.0 115.142 -166.307 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 2.5 pp -90.51 1.07 57.04 Favored 'General case' 0 CA--C 1.57 1.734 0 N-CA-C 117.746 2.499 . . . . 0.0 117.746 164.437 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 60.0 m -137.58 45.36 2.18 Favored 'General case' 0 N--CA 1.498 1.97 0 CA-C-N 122.443 2.383 . . . . 0.0 115.806 166.855 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . 0.286 6.9 tmtt? -64.73 -66.49 1.42 Allowed Pre-proline 0 N--CA 1.504 2.272 0 N-CA-C 119.076 2.991 . . . . 0.0 119.076 173.554 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -85.65 98.84 0.62 Allowed 'Trans proline' 0 CA--C 1.559 1.755 0 CA-C-N 124.025 2.473 . . . . 0.0 117.96 -139.392 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 74.4 m -109.68 -57.08 0.05 OUTLIER Pre-proline 0 CA--C 1.571 1.773 0 CA-C-O 115.862 -2.018 . . . . 0.0 113.121 128.935 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -86.6 57.88 3.82 Favored 'Trans proline' 0 C--N 1.375 1.958 0 CA-C-N 125.789 3.103 . . . . 0.0 117.01 -170.517 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 65.5 t -79.95 -59.5 2.89 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.516 0 O-C-N 121.764 -0.585 . . . . 0.0 112.535 179.281 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . 0.331 11.5 t 37.28 54.66 1.33 Allowed 'General case' 0 N--CA 1.509 2.481 0 N-CA-C 120.982 3.697 . . . . 0.0 120.982 158.566 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 132.07 -44.72 1.18 Allowed Glycine 0 N--CA 1.496 2.675 0 N-CA-C 116.194 1.238 . . . . 0.0 116.194 -165.315 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 51' ' ' TYR . . . . . 0.446 ' CG ' ' HB2' ' B' ' 57' ' ' ARG . 45.7 m-85 -69.33 101.42 1.52 Allowed 'General case' 0 CA--C 1.566 1.586 0 CA-C-N 118.591 1.195 . . . . 0.0 113.252 178.033 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 99.9 mtt180 -68.74 35.2 0.03 OUTLIER 'General case' 0 CA--C 1.592 2.593 0 N-CA-C 117.125 2.269 . . . . 0.0 117.125 165.642 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 53' ' ' ASN . . . . . 0.596 ' HA ' ' HB2' ' A' ' 55' ' ' ALA . 3.2 m-80 -157.97 166.88 31.46 Favored 'General case' 0 CA--C 1.578 2.043 0 C-N-CA 126.842 2.057 . . . . 0.0 110.747 167.067 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -78.05 92.85 4.41 Favored 'General case' 0 CA--C 1.555 1.163 2 O-C-N 112.534 -6.354 . . . . 0.0 109.823 3.658 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 55' ' ' ALA . . . . . 0.596 ' HB2' ' HA ' ' A' ' 53' ' ' ASN . . . -94.17 -95.1 0.16 Allowed 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 111.97 -2.377 . . . . 0.0 108.678 -158.943 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.546 ' O ' ' HB3' ' A' ' 59' ' ' ALA . 62.9 mm-40 -2.33 -61.3 0.0 OUTLIER 'General case' 0 CA--C 1.564 1.488 1 N-CA-C 124.388 4.958 . . . . 0.0 124.388 107.246 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.422 ' HD3' ' OD1' ' A' ' 53' ' ' ASN 0.364 2.0 mpt_? -71.35 -37.07 71.7 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 118.146 -2.846 . . . . 0.0 114.995 178.306 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.533 ' HA ' ' H ' ' A' ' 61' ' ' GLU 0.645 58.0 mt -93.55 2.71 56.31 Favored 'General case' 0 CA--C 1.599 2.859 0 O-C-N 119.491 -2.006 . . . . 0.0 114.138 165.429 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 59' ' ' ALA . . . . . 0.546 ' HB3' ' O ' ' A' ' 56' ' ' GLU . . . -63.17 -30.53 71.66 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 117.358 -3.339 . . . . 0.0 116.856 138.607 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -66.39 -29.62 69.82 Favored 'General case' 0 N--CA 1.487 1.383 0 O-C-N 120.135 -1.603 . . . . 0.0 115.2 155.811 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.533 ' H ' ' HA ' ' A' ' 58' ' ' LEU . 2.1 tt0 -50.97 -48.54 61.14 Favored 'General case' 0 N--CA 1.503 2.187 0 CA-C-O 117.491 -1.242 . . . . 0.0 112.19 157.708 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -52.51 -54.33 34.07 Favored 'General case' 0 CA--C 1.558 1.288 0 CA-C-O 114.616 -2.611 . . . . 0.0 112.125 165.164 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 63' ' ' SER . . . . . 0.581 ' HA ' HG11 ' A' ' 66' ' ' VAL 0.314 4.9 m -40.91 -30.31 0.13 Allowed 'General case' 0 N--CA 1.515 2.801 0 N-CA-C 120.815 3.635 . . . . 0.0 120.815 161.981 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . 0.337 0.7 OUTLIER -91.6 -4.21 55.54 Favored 'General case' 0 CA--C 1.597 2.784 0 N-CA-C 116.049 1.87 . . . . 0.0 116.049 170.795 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -142.14 44.97 1.67 Allowed 'General case' 0 CA--C 1.599 2.862 0 C-N-CA 127.705 2.402 . . . . 0.0 112.886 173.911 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.581 HG11 ' HA ' ' A' ' 63' ' ' SER 0.259 2.7 p . . . . . 0 N--CA 1.513 2.722 0 C-N-CA 126.538 1.935 . . . . 0.0 112.919 -168.252 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.565 1.556 0 N-CA-C 115.502 1.667 . . . . 0.0 115.502 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 2' ' ' ARG . . . . . . . . . . . . 0.294 53.6 ptt85 37.15 46.27 0.55 Allowed 'General case' 0 N--CA 1.505 2.307 0 N-CA-C 121.62 3.933 . . . . 0.0 121.62 174.349 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -138.19 75.45 1.52 Allowed 'General case' 0 CA--C 1.564 1.487 0 CA-C-O 122.328 1.061 . . . . 0.0 111.19 -176.153 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 4' ' ' ASP . . . . . . . . . . . . . 1.4 p30 -130.64 73.01 81.6 Favored Pre-proline 0 CA--C 1.565 1.53 0 N-CA-C 113.089 0.774 . . . . 0.0 113.089 153.437 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 62.7 Cg_endo -62.11 173.69 3.03 Favored 'Trans proline' 0 CA--C 1.566 2.107 0 C-N-CA 122.632 2.221 . . . . 0.0 116.127 153.485 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 6' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -153.68 159.95 42.2 Favored 'General case' 0 CA--C 1.552 1.028 0 CA-C-N 113.797 -1.547 . . . . 0.0 114.88 -149.802 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 7' ' ' PHE . . . . . 0.734 ' CZ ' HD23 ' A' ' 34' ' ' LEU . 36.9 p90 -142.29 156.58 45.28 Favored 'General case' 0 CA--C 1.56 1.328 0 CA-C-O 122.499 1.142 . . . . 0.0 109.145 161.01 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 8' ' ' ASN . . . . . . . . . . . . . 91.6 m-20 -76.0 87.27 2.93 Favored 'General case' 0 CA--C 1.566 1.581 0 O-C-N 119.922 -1.736 . . . . 0.0 110.716 172.128 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 9' ' ' PHE . . . . . . . . . . . . . 4.8 t80 -62.7 142.3 58.18 Favored 'General case' 0 CA--C 1.56 1.35 0 CA-C-O 125.323 2.487 . . . . 0.0 111.245 171.001 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -148.05 96.78 2.69 Favored 'General case' 0 N--CA 1.486 1.358 0 CA-C-N 111.657 -2.52 . . . . 0.0 107.986 -147.015 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 11' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -114.23 118.26 42.26 Favored Pre-proline 0 CA--C 1.567 1.607 0 CA-C-O 117.135 -1.412 . . . . 0.0 112.012 -156.053 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 12' ' ' PRO . . . . . . . . . . . . . 80.3 Cg_exo -42.57 140.57 2.67 Favored 'Trans proline' 0 C--N 1.373 1.848 0 C-N-CA 123.389 2.726 . . . . 0.0 116.252 164.544 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 13' ' ' MET . . . . . . . . . . . . . 25.9 tpp -58.71 -26.53 64.0 Favored 'General case' 0 N--CA 1.498 1.931 0 N-CA-C 119.003 2.964 . . . . 0.0 119.003 -157.818 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 14' ' ' GLU . . . . . . . . . . . . 0.297 7.0 pt-20 -61.28 -50.96 70.92 Favored 'General case' 0 CA--C 1.566 1.588 0 N-CA-C 115.905 1.817 . . . . 0.0 115.905 160.161 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -58.8 -52.88 54.87 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.794 0 CA-C-N 122.092 2.224 . . . . 0.0 112.109 174.013 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 16' ' ' ARG . . . . . . . . . . . . 0.261 1.8 ttt180 -69.01 -33.21 73.27 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-N 122.255 2.298 . . . . 0.0 115.857 177.889 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 17' ' ' GLU . . . . . . . . . . . . . 5.4 pt-20 -65.3 -44.73 86.98 Favored 'General case' 0 N--CA 1.487 1.385 0 CA-C-N 123.326 2.784 . . . . 0.0 113.948 164.988 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . 0.296 52.5 mtmt -53.12 -55.86 20.8 Favored 'General case' 0 N--CA 1.487 1.412 0 N-CA-C 115.765 1.765 . . . . 0.0 115.765 166.006 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 19' ' ' LEU . . . . . 0.702 HD13 HD22 ' B' ' 34' ' ' LEU . 0.3 OUTLIER -71.87 -32.91 67.94 Favored 'General case' 0 CA--C 1.566 1.558 0 N-CA-C 116.321 1.971 . . . . 0.0 116.321 -179.984 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 20' ' ' LYS . . . . . 0.409 ' HA ' ' HB3' ' B' ' 23' ' ' ALA . 7.6 ttpt -87.29 -21.62 25.65 Favored 'General case' 0 CA--C 1.57 1.72 0 C-N-CA 124.78 1.232 . . . . 0.0 113.78 173.413 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 21' ' ' PHE . . . . . 0.444 ' O ' ' HB3' ' B' ' 25' ' ' ALA . 10.5 m-85 -66.25 -66.7 0.52 Allowed 'General case' 0 N--CA 1.49 1.53 0 CA-C-N 122.132 2.242 . . . . 0.0 110.635 155.195 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 22' ' ' ARG . . . . . 0.571 ' HE ' HG13 ' B' ' 37' ' ' ILE 0.274 1.8 tpt180 -21.48 -53.27 0.02 OUTLIER 'General case' 0 CA--C 1.596 2.742 0 CA-C-N 124.459 3.299 . . . . 0.0 115.259 160.052 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 23' ' ' ALA . . . . . 0.41 ' HB2' ' HB3' ' B' ' 33' ' ' GLU 0.318 . . -54.18 -77.0 0.03 OUTLIER 'General case' 0 CA--C 1.577 2.0 0 N-CA-C 120.546 3.536 . . . . 0.0 120.546 154.066 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 50.6 mm-40 -74.19 -34.38 63.73 Favored 'General case' 0 CA--C 1.576 1.968 0 N-CA-C 118.766 2.876 . . . . 0.0 118.766 -175.836 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 25' ' ' ALA . . . . . 0.444 ' HB3' ' O ' ' B' ' 21' ' ' PHE . . . -46.2 -52.41 12.45 Favored 'General case' 0 CA--C 1.579 2.083 0 N-CA-C 116.015 1.857 . . . . 0.0 116.015 154.562 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 26' ' ' ASN . . . . . . . . . . . . . 9.6 m120 -82.5 -56.8 3.66 Favored 'General case' 0 CA--C 1.575 1.935 0 N-CA-C 114.536 1.31 . . . . 0.0 114.536 179.236 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 27' ' ' GLY . . . . . . . . . . . . . . . 128.17 28.28 0.86 Allowed Glycine 0 CA--C 1.561 2.952 0 N-CA-C 119.037 2.375 . . . . 0.0 119.037 -166.703 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 28' ' ' ARG . . . . . . . . . . . . 0.254 8.3 mtm-85 -118.13 166.13 12.94 Favored 'General case' 0 N--CA 1.497 1.92 0 N-CA-C 105.682 -1.97 . . . . 0.0 105.682 159.929 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 29' ' ' SER . . . . . 0.465 ' H ' ' HB3' ' B' ' 32' ' ' SER . 87.4 p -115.85 113.24 23.09 Favored 'General case' 0 N--CA 1.498 1.935 0 O-C-N 118.836 -2.415 . . . . 0.0 105.244 -173.098 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 30' ' ' MET . . . . . 0.475 ' CE ' ' HB3' ' B' ' 19' ' ' LEU . 13.3 mtp -36.76 -39.5 0.22 Allowed 'General case' 0 N--CA 1.502 2.174 0 N-CA-C 121.397 3.851 . . . . 0.0 121.397 -147.87 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 31' ' ' ASN . . . . . . . . . . . . 0.3 0.5 OUTLIER -48.56 -50.47 32.06 Favored 'General case' 0 CA--C 1.587 2.368 0 O-C-N 118.857 -2.402 . . . . 0.0 114.662 162.945 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 32' ' ' SER . . . . . 0.465 ' HB3' ' H ' ' B' ' 29' ' ' SER 0.361 35.4 t -47.6 -69.95 0.11 Allowed 'General case' 0 N--CA 1.497 1.923 0 N-CA-C 118.392 2.738 . . . . 0.0 118.392 144.449 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 33' ' ' GLU . . . . . 0.41 ' HB3' ' HB2' ' B' ' 23' ' ' ALA . 6.6 tm-20 -76.15 -50.06 15.61 Favored 'General case' 0 N--CA 1.51 2.569 0 CA-C-N 123.978 3.081 . . . . 0.0 119.022 -169.496 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 34' ' ' LEU . . . . . 0.702 HD22 HD13 ' B' ' 19' ' ' LEU 0.47 0.3 OUTLIER -47.06 -39.12 12.34 Favored 'General case' 0 CA--C 1.579 2.09 0 CA-C-O 113.679 -3.057 . . . . 0.0 107.226 161.82 . . . . . . . . 4 4 . 1 . 012 nuclear build full ' B' B ' 35' ' ' LEU . . . . . 0.414 ' HG ' ' CE1' ' A' ' 9' ' ' PHE . 16.1 mt -65.19 -53.15 49.19 Favored 'General case' 0 N--CA 1.499 1.975 1 CA-C-N 127.692 4.769 . . . . 0.0 114.795 166.341 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 36' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -60.96 -33.79 73.76 Favored 'General case' 0 N--CA 1.493 1.688 0 N-CA-C 115.911 1.819 . . . . 0.0 115.911 -178.034 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 37' ' ' ILE . . . . . 0.571 HG13 ' HE ' ' B' ' 22' ' ' ARG . 0.4 OUTLIER -72.35 -42.2 65.25 Favored 'Isoleucine or valine' 0 C--O 1.2 -1.516 0 CA-C-O 115.115 -2.374 . . . . 0.0 115.383 159.409 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 38' ' ' VAL . . . . . 0.406 ' CG1' HD22 ' A' ' 19' ' ' LEU . 3.0 t -71.79 -48.71 49.9 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.408 0 CA-C-N 124.532 3.333 . . . . 0.0 113.111 -177.18 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 24.3 mt-30 -47.72 -51.1 23.27 Favored 'General case' 0 N--CA 1.476 0.856 0 CA-C-O 115.518 -2.182 . . . . 0.0 111.336 155.216 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 40' ' ' ASP . . . . . . . . . . . . 0.69 0.0 OUTLIER -44.1 -51.99 7.55 Favored 'General case' 0 N--CA 1.493 1.71 0 N-CA-C 117.274 2.324 . . . . 0.0 117.274 161.873 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 41' ' ' ALA . . . . . . . . . . . . 0.305 . . -80.18 -27.68 38.87 Favored 'General case' 0 CA--C 1.562 1.426 0 N-CA-C 116.507 2.04 . . . . 0.0 116.507 -159.812 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 1.1 pp -122.73 30.69 6.35 Favored 'General case' 0 N--CA 1.489 1.523 0 N-CA-C 118.217 2.673 . . . . 0.0 118.217 158.112 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 43' ' ' SER . . . . . . . . . . . . . 20.2 m 152.68 65.15 0.0 OUTLIER 'General case' 0 N--CA 1.505 2.276 0 O-C-N 119.279 -2.138 . . . . 0.0 110.861 107.56 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 44' ' ' LYS . . . . . . . . . . . . 0.367 7.1 ttpm? -90.72 118.88 68.97 Favored Pre-proline 0 N--CA 1.531 3.578 0 N-CA-C 116.23 1.937 . . . . 0.0 116.23 -169.288 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 84.6 Cg_endo -77.85 131.09 10.92 Favored 'Trans proline' 0 CA--C 1.567 2.162 0 C-N-CA 122.728 2.286 . . . . 0.0 115.508 161.08 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 46' ' ' SER . . . . . . . . . . . . 0.319 69.4 m -106.64 -110.58 0.0 OUTLIER Pre-proline 0 CA--C 1.581 2.15 0 CA-C-O 114.241 -2.79 . . . . 0.0 110.708 171.927 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 25.3 Cg_endo -88.22 58.45 2.8 Favored 'Trans proline' 0 CA--C 1.567 2.153 1 CA-C-N 128.779 4.171 . . . . 0.0 116.137 -179.54 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 48' ' ' VAL . . . . . . . . . . . . . 20.5 t -37.13 118.0 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.508 2.466 0 N-CA-C 116.742 2.127 . . . . 0.0 116.742 -173.333 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 49' ' ' THR . . . . . . . . . . . . 0.671 0.5 OUTLIER 75.94 15.5 2.47 Favored 'General case' 0 N--CA 1.508 2.431 3 O-C-N 112.226 -6.546 . . . . 0.0 123.121 -13.352 . . . . . . . . 4 3 . 1 . 012 nuclear build full ' B' B ' 50' ' ' GLY . . . . . . . . . . . . . . . 72.81 31.71 62.05 Favored Glycine 0 N--CA 1.502 3.044 0 N-CA-C 121.475 3.35 . . . . 0.0 121.475 165.645 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 51' ' ' TYR . . . . . . . . . . . . . 20.4 m-85 -77.02 89.43 3.56 Favored 'General case' 0 CA--C 1.576 1.968 0 CA-C-N 118.974 1.387 . . . . 0.0 113.668 -178.277 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 52' ' ' ARG . . . . . . . . . . . . . 69.1 ttt-85 -153.9 68.86 0.77 Allowed 'General case' 0 N--CA 1.5 2.062 0 N-CA-C 114.648 1.351 . . . . 0.0 114.648 176.42 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 53' ' ' ASN . . . . . 0.49 ' HB3' ' HB2' ' A' ' 53' ' ' ASN . 0.8 OUTLIER -171.96 166.74 6.27 Favored 'General case' 0 N--CA 1.503 2.223 0 N-CA-C 116.411 2.004 . . . . 0.0 116.411 167.025 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 54' ' ' ASP . . . . . 0.422 ' O ' ' HB3' ' B' ' 57' ' ' ARG 1.036 0.0 OUTLIER 47.91 13.5 0.04 OUTLIER 'General case' 0 N--CA 1.522 3.133 1 N-CA-C 125.738 5.459 . . . . 0.0 125.738 148.145 . . . . . . . . 5 4 . 1 . 012 nuclear build full ' B' B ' 55' ' ' ALA . . . . . . . . . . . . 0.34 . . 0.16 -79.02 0.0 OUTLIER 'General case' 0 CA--C 1.595 2.676 2 O-C-N 114.344 -5.222 . . . . 0.0 122.481 83.467 . . . . . . . . 3 2 . 1 . 012 nuclear build full ' B' B ' 56' ' ' GLU . . . . . 0.431 ' C ' ' HB3' ' B' ' 59' ' ' ALA . 23.9 mp0 -39.46 -4.76 0.0 OUTLIER 'General case' 0 CA--C 1.592 2.591 1 N-CA-C 122.599 4.296 . . . . 0.0 122.599 148.522 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 57' ' ' ARG . . . . . 0.446 ' HB2' ' CG ' ' A' ' 51' ' ' TYR . 0.2 OUTLIER -103.35 -35.17 8.5 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 119.751 -1.843 . . . . 0.0 114.286 167.264 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 93.9 mt -62.73 -45.61 91.93 Favored 'General case' 0 N--CA 1.501 2.094 0 CA-C-N 120.61 1.55 . . . . 0.0 113.931 164.814 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 59' ' ' ALA . . . . . 0.431 ' HB3' ' C ' ' B' ' 56' ' ' GLU . . . -24.25 -76.36 0.02 OUTLIER 'General case' 0 N--CA 1.486 1.369 0 N-CA-C 119.825 3.268 . . . . 0.0 119.825 141.243 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -86.32 3.64 42.55 Favored 'General case' 0 CA--C 1.551 1.007 0 N-CA-C 115.726 1.75 . . . . 0.0 115.726 -168.36 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 61' ' ' GLU . . . . . . . . . . . . 0.257 19.7 tt0 -65.7 -62.97 1.21 Allowed 'General case' 0 N--CA 1.482 1.17 0 CA-C-O 115.427 -2.225 . . . . 0.0 112.439 145.501 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 62' ' ' GLN . . . . . 0.699 ' O ' HG13 ' B' ' 66' ' ' VAL 0.506 1.0 OUTLIER -74.02 -66.69 0.68 Allowed 'General case' 0 C--N 1.367 1.348 0 CA-C-N 123.148 2.704 . . . . 0.0 112.42 -176.322 . . . . . . . . 4 4 . 1 . 012 nuclear build full ' B' B ' 63' ' ' SER . . . . . . . . . . . . 0.321 46.2 t -72.96 46.44 0.17 Allowed 'General case' 0 CA--C 1.575 1.931 0 N-CA-C 118.082 2.623 . . . . 0.0 118.082 164.078 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 64' ' ' GLU . . . . . . . . . . . . . 11.5 tt0 -125.28 -32.24 2.97 Favored 'General case' 0 CA--C 1.573 1.856 0 O-C-N 120.083 -1.636 . . . . 0.0 114.21 125.794 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 39.9 mt -78.03 -22.32 49.39 Favored 'General case' 0 N--CA 1.505 2.318 0 CA-C-N 122.021 2.191 . . . . 0.0 116.477 -179.32 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 66' ' ' VAL . . . . . 0.699 HG13 ' O ' ' B' ' 62' ' ' GLN . 19.4 m . . . . . 0 N--CA 1.507 2.386 0 N-CA-C 119.576 3.176 . . . . 0.0 119.576 170.707 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.567 1.633 0 N-CA-C 117.244 2.313 . . . . 0.0 117.244 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . 0.367 55.1 ptt85 45.7 51.24 10.33 Favored 'General case' 0 N--CA 1.501 2.106 0 N-CA-C 119.053 2.983 . . . . 0.0 119.053 -174.493 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -164.49 -44.09 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.495 0 O-C-N 120.783 -1.198 . . . . 0.0 113.008 169.438 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 47.8 t0 -145.55 90.2 6.05 Favored Pre-proline 0 CA--C 1.571 1.757 0 N-CA-C 108.549 -0.908 . . . . 0.0 108.549 157.388 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 2.8 Cg_endo -106.07 149.68 0.12 Allowed 'Trans proline' 0 C--N 1.371 1.722 0 C-N-CA 122.461 2.107 . . . . 0.0 114.643 -164.723 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 74.5 m80 -89.89 138.52 31.42 Favored 'General case' 0 N--CA 1.489 1.485 0 N-CA-C 113.605 0.965 . . . . 0.0 113.605 -178.744 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' PHE . . . . . 0.781 ' CZ ' HD12 ' B' ' 34' ' ' LEU . 15.8 p90 -128.26 157.35 41.15 Favored 'General case' 0 CA--C 1.566 1.583 0 O-C-N 120.193 -1.567 . . . . 0.0 110.726 144.654 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 85.5 m-20 -71.4 88.02 0.88 Allowed 'General case' 0 N--CA 1.491 1.598 0 O-C-N 119.938 -1.726 . . . . 0.0 111.666 169.956 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' PHE . . . . . 0.604 ' CD2' HD13 ' B' ' 34' ' ' LEU . 2.2 t80 -66.45 151.33 47.42 Favored 'General case' 0 CA--C 1.556 1.185 0 CA-C-O 125.319 2.485 . . . . 0.0 111.014 157.728 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -166.97 99.87 0.54 Allowed 'General case' 0 N--CA 1.488 1.428 0 CA-C-N 111.666 -2.516 . . . . 0.0 108.074 -142.545 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 1.3 mpt? -125.43 117.4 25.0 Favored Pre-proline 0 CA--C 1.561 1.392 0 CA-C-O 116.727 -1.606 . . . . 0.0 112.831 -151.213 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 82.7 Cg_exo -42.66 145.98 0.9 Allowed 'Trans proline' 0 CA--C 1.561 1.869 0 C-N-CA 123.062 2.508 . . . . 0.0 116.679 166.13 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -52.61 -38.45 60.2 Favored 'General case' 0 N--CA 1.498 1.932 0 N-CA-C 117.43 2.382 . . . . 0.0 117.43 -160.713 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . 0.26 9.9 pt-20 -64.59 -42.54 95.52 Favored 'General case' 0 CA--C 1.563 1.476 0 N-CA-C 116.719 2.118 . . . . 0.0 116.719 167.239 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -60.55 -50.31 80.89 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.191 0 CA-C-N 123.977 3.08 . . . . 0.0 113.005 173.795 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 1.2 ttt180 -68.65 -40.95 80.01 Favored 'General case' 0 C--O 1.215 -0.722 0 CA-C-O 115.983 -1.961 . . . . 0.0 115.467 173.191 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -58.5 -41.41 85.3 Favored 'General case' 0 CA--C 1.565 1.521 0 CA-C-N 123.858 3.026 . . . . 0.0 114.427 164.033 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . 0.277 48.8 mtmt -63.07 -54.67 34.4 Favored 'General case' 0 CA--C 1.562 1.418 0 CA-C-N 121.337 1.88 . . . . 0.0 115.046 169.94 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.728 HD13 HD22 ' A' ' 34' ' ' LEU . 9.0 mt -62.53 -38.16 88.88 Favored 'General case' 0 CA--C 1.57 1.747 0 N-CA-C 116.532 2.049 . . . . 0.0 116.532 172.832 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 14.3 ttpt -89.32 -24.94 21.88 Favored 'General case' 0 CA--C 1.57 1.718 0 C-N-CA 125.202 1.401 . . . . 0.0 113.19 -177.733 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' PHE . . . . . 0.471 ' O ' ' HB3' ' A' ' 25' ' ' ALA . 13.3 m-30 -65.23 -65.29 0.69 Allowed 'General case' 0 N--CA 1.49 1.571 0 CA-C-O 115.374 -2.25 . . . . 0.0 111.051 154.363 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . 0.273 7.3 ttm180 -20.71 -54.59 0.02 OUTLIER 'General case' 0 CA--C 1.587 2.401 0 CA-C-N 124.416 3.28 . . . . 0.0 115.922 158.146 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.437 ' HB2' ' HB3' ' A' ' 33' ' ' GLU 0.287 . . -57.87 -74.33 0.06 Allowed 'General case' 0 CA--C 1.585 2.319 0 N-CA-C 118.512 2.782 . . . . 0.0 118.512 158.919 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 15.6 mm-40 -74.13 -36.84 64.21 Favored 'General case' 0 N--CA 1.499 1.976 0 N-CA-C 118.814 2.894 . . . . 0.0 118.814 -175.621 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.471 ' HB3' ' O ' ' A' ' 21' ' ' PHE . . . -46.34 -50.07 16.85 Favored 'General case' 0 CA--C 1.584 2.282 0 N-CA-C 116.091 1.886 . . . . 0.0 116.091 155.187 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 52.2 m-20 -88.44 -43.97 11.08 Favored 'General case' 0 N--CA 1.497 1.916 0 N-CA-C 116.475 2.028 . . . . 0.0 116.475 -175.835 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 116.43 24.37 3.8 Favored Glycine 0 CA--C 1.561 2.908 0 N-CA-C 119.266 2.467 . . . . 0.0 119.266 -163.68 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.502 HH11 ' HG3' ' A' ' 28' ' ' ARG 0.305 2.7 mtm-85 -116.79 167.41 11.13 Favored 'General case' 0 CA--C 1.576 1.958 0 N-CA-C 105.541 -2.022 . . . . 0.0 105.541 163.466 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 29' ' ' SER . . . . . 0.4 ' H ' ' HB3' ' A' ' 32' ' ' SER . 28.4 t -126.69 112.7 15.75 Favored 'General case' 0 N--CA 1.506 2.346 0 O-C-N 117.359 -3.338 . . . . 0.0 106.59 -173.793 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 30' ' ' MET . . . . . 0.498 ' CE ' ' HB3' ' A' ' 19' ' ' LEU . 14.2 mtp -38.2 -39.03 0.38 Allowed 'General case' 0 N--CA 1.501 2.096 1 N-CA-C 121.854 4.02 . . . . 0.0 121.854 -144.676 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 31' ' ' ASN . . . . . 0.425 ' O ' ' HB2' ' A' ' 35' ' ' LEU . 11.6 t-20 -47.15 -53.38 13.14 Favored 'General case' 0 CA--C 1.588 2.413 0 O-C-N 118.713 -2.492 . . . . 0.0 114.186 159.985 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 32' ' ' SER . . . . . 0.4 ' HB3' ' H ' ' A' ' 29' ' ' SER 0.308 30.2 t -49.17 -61.43 2.08 Favored 'General case' 0 N--CA 1.501 2.076 0 N-CA-C 120.219 3.415 . . . . 0.0 120.219 148.41 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 33' ' ' GLU . . . . . 0.437 ' HB3' ' HB2' ' A' ' 23' ' ' ALA . 0.0 OUTLIER -84.14 -47.83 10.48 Favored 'General case' 0 N--CA 1.517 2.918 0 CA-C-N 124.0 3.091 . . . . 0.0 117.829 -174.036 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.728 HD22 HD13 ' A' ' 19' ' ' LEU 0.489 0.3 OUTLIER -50.12 -39.27 42.49 Favored 'General case' 0 CA--C 1.584 2.288 0 CA-C-O 113.744 -3.027 . . . . 0.0 106.326 163.0 . . . . . . . . 4 4 . 1 . 013 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.425 ' HB2' ' O ' ' A' ' 31' ' ' ASN . 13.8 mt -66.26 -57.15 8.16 Favored 'General case' 0 N--CA 1.499 2.014 1 CA-C-N 127.437 4.653 . . . . 0.0 115.014 169.272 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -56.36 -40.52 74.65 Favored 'General case' 0 CA--C 1.557 1.25 0 CA-C-O 115.54 -2.172 . . . . 0.0 113.719 -179.813 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -70.49 -31.04 45.2 Favored 'Isoleucine or valine' 0 C--O 1.201 -1.481 0 CA-C-N 123.156 2.707 . . . . 0.0 116.254 165.144 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.473 HG11 HD11 ' B' ' 19' ' ' LEU . 2.4 t -75.94 -49.83 24.78 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.136 0 CA-C-N 124.084 3.129 . . . . 0.0 112.077 177.076 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 27.1 mt-30 -46.25 -47.21 18.11 Favored 'General case' 0 N--CA 1.486 1.33 0 CA-C-O 116.662 -1.637 . . . . 0.0 113.214 154.09 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . 0.417 24.7 m-20 -47.33 -67.18 0.3 Allowed 'General case' 0 N--CA 1.491 1.593 0 CA-C-N 120.82 1.646 . . . . 0.0 110.509 158.307 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . 0.348 . . -66.06 -33.56 76.07 Favored 'General case' 0 CA--C 1.558 1.252 0 N-CA-C 116.975 2.213 . . . . 0.0 116.975 -152.693 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 2.4 pp -105.43 6.06 32.18 Favored 'General case' 0 N--CA 1.492 1.662 0 N-CA-C 120.818 3.636 . . . . 0.0 120.818 159.754 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 74.2 m -143.14 -42.11 0.3 Allowed 'General case' 0 N--CA 1.5 2.06 0 N-CA-C 120.355 3.465 . . . . 0.0 120.355 174.17 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . 0.446 1.1 tmtp? -60.44 -61.42 7.98 Favored Pre-proline 0 N--CA 1.528 3.451 0 N-CA-C 121.432 3.864 . . . . 0.0 121.432 -121.889 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_exo -67.26 102.96 0.72 Allowed 'Trans proline' 0 CA--C 1.57 2.292 0 CA-C-N 125.016 2.827 . . . . 0.0 117.568 -168.025 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 26.3 t -59.51 -49.71 90.83 Favored Pre-proline 0 CA--C 1.575 1.931 0 N-CA-C 119.897 3.295 . . . . 0.0 119.897 -171.753 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 97.2 Cg_endo -72.7 -9.77 24.28 Favored 'Trans proline' 0 N--CA 1.502 1.985 0 N-CA-C 120.947 3.403 . . . . 0.0 120.947 176.617 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . 0.387 84.8 t 70.65 -73.85 0.1 Allowed 'Isoleucine or valine' 0 N--CA 1.5 2.07 0 C-N-CA 125.978 1.711 . . . . 0.0 113.48 165.824 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . 0.362 8.0 t 50.49 53.99 11.95 Favored 'General case' 0 N--CA 1.501 2.097 0 N-CA-C 118.546 2.795 . . . . 0.0 118.546 162.128 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 117.47 -56.32 0.55 Allowed Glycine 0 N--CA 1.496 2.636 0 N-CA-C 118.986 2.354 . . . . 0.0 118.986 175.813 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 51' ' ' TYR . . . . . 0.535 ' CE1' ' HG2' ' B' ' 56' ' ' GLU 0.499 0.0 OUTLIER -79.48 69.82 5.81 Favored 'General case' 0 CA--C 1.611 3.292 0 N-CA-C 118.376 2.732 . . . . 0.0 118.376 -156.389 . . . . . . . . 4 4 . 1 . 013 nuclear build full ' A' A ' 52' ' ' ARG . . . . . 0.507 ' O ' ' HA ' ' B' ' 53' ' ' ASN 0.386 3.5 tpm_? 41.22 166.84 0.0 OUTLIER 'General case' 1 N--CA 1.547 4.395 1 N-CA-C 123.506 4.632 . . . . 0.0 123.506 158.331 . . . . . . . . 5 3 . 1 . 013 nuclear build full ' A' A ' 53' ' ' ASN . . . . . 0.466 ' C ' ' HB2' ' B' ' 53' ' ' ASN 2.109 0.1 OUTLIER -114.26 13.61 17.93 Favored 'General case' 2 CA--C 1.664 5.343 2 N-CA-C 134.661 8.763 . . . . 0.0 134.661 -151.491 . . . . . . . . 6 4 . 1 . 013 nuclear build full ' A' A ' 54' ' ' ASP . . . . . 0.688 ' HA ' ' HB2' ' B' ' 53' ' ' ASN 1.66 0.0 OUTLIER 57.18 -57.09 0.03 OUTLIER 'General case' 1 N--CA 1.566 5.327 2 O-C-N 108.027 -9.171 . . . . 0.0 121.389 115.108 . . . . . . . . 6 4 . 1 . 013 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . 0.344 . . -62.97 -48.28 79.53 Favored 'General case' 0 C--N 1.286 -2.162 0 N-CA-C 115.728 1.751 . . . . 0.0 115.728 166.081 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -56.7 -10.46 1.02 Allowed 'General case' 0 CA--C 1.584 2.272 0 N-CA-C 118.831 2.9 . . . . 0.0 118.831 150.411 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.476 ' HB3' ' HB2' ' A' ' 54' ' ' ASP . 37.5 ttt85 -96.47 -38.59 9.95 Favored 'General case' 0 N--CA 1.503 2.218 0 N-CA-C 116.623 2.083 . . . . 0.0 116.623 173.967 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.627 ' O ' ' HB3' ' A' ' 61' ' ' GLU 0.304 22.2 mt -64.61 -19.09 65.47 Favored 'General case' 0 CA--C 1.573 1.856 0 CA-C-O 113.492 -3.147 . . . . 0.0 115.092 160.08 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 59' ' ' ALA . . . . . 0.587 ' HA ' ' HB3' ' A' ' 61' ' ' GLU . . . -65.52 -36.38 83.65 Favored 'General case' 0 N--CA 1.516 2.837 0 N-CA-C 120.791 3.626 . . . . 0.0 120.791 148.05 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -68.82 17.43 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.597 0 O-C-N 118.319 -2.738 . . . . 0.0 116.803 144.149 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.671 ' HA ' ' H ' ' A' ' 63' ' ' SER 2.142 0.0 OUTLIER 89.85 151.21 0.04 OUTLIER 'General case' 0 CA--C 1.557 1.224 0 N-CA-C 103.729 -2.693 . . . . 0.0 103.729 91.193 . . . . . . . . 4 4 . 1 . 013 nuclear build full ' A' A ' 62' ' ' GLN . . . . . 0.51 ' HB3' ' HG3' ' A' ' 61' ' ' GLU . 0.1 OUTLIER -28.95 -50.35 0.08 Allowed 'General case' 0 CA--C 1.581 2.141 1 CA-C-N 101.422 -7.172 . . . . 0.0 118.401 102.32 . . . . . . . . 4 4 . 1 . 013 nuclear build full ' A' A ' 63' ' ' SER . . . . . 0.671 ' H ' ' HA ' ' A' ' 61' ' ' GLU 0.41 36.4 t -109.87 43.52 1.33 Allowed 'General case' 0 CA--C 1.56 1.36 0 N-CA-C 116.418 2.007 . . . . 0.0 116.418 -172.319 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 37.3 tt0 -96.26 -25.73 15.68 Favored 'General case' 0 CA--C 1.57 1.723 0 N-CA-C 116.23 1.937 . . . . 0.0 116.23 106.021 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -68.54 -78.79 0.06 Allowed 'General case' 0 CA--C 1.585 2.314 0 CA-C-N 124.442 3.292 . . . . 0.0 113.26 -177.094 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.407 HG13 ' O ' ' A' ' 62' ' ' GLN 0.501 2.7 m . . . . . 0 N--CA 1.518 2.936 1 N-CA-C 122.431 4.234 . . . . 0.0 122.431 157.625 . . . . . . . . 3 2 . 1 . 013 nuclear build full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.564 1.488 0 N-CA-C 113.802 1.038 . . . . 0.0 113.802 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 2' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -83.0 76.02 9.86 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.013 -1.054 . . . . 0.0 112.609 177.365 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -119.53 70.36 0.85 Allowed 'General case' 0 N--CA 1.49 1.53 0 N-CA-C 108.05 -1.092 . . . . 0.0 108.05 173.601 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 4' ' ' ASP . . . . . . . . . . . . . 8.6 p-10 -152.63 87.39 4.12 Favored Pre-proline 0 CA--C 1.571 1.767 0 O-C-N 121.439 -0.788 . . . . 0.0 110.552 -178.037 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 7.7 Cg_exo -94.45 144.93 1.7 Allowed 'Trans proline' 0 C--N 1.367 1.523 0 CA-C-N 122.937 2.085 . . . . 0.0 114.75 -156.633 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 6' ' ' HIS . . . . . . . . . . . . . 74.2 m80 -79.44 126.74 31.23 Favored 'General case' 0 CA--C 1.565 1.522 0 CA-C-N 113.931 -1.486 . . . . 0.0 111.612 177.107 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 7' ' ' PHE . . . . . 0.52 ' CZ ' HD23 ' A' ' 34' ' ' LEU 0.255 2.3 p90 -131.8 153.44 50.13 Favored 'General case' 0 CA--C 1.561 1.372 0 O-C-N 120.239 -1.538 . . . . 0.0 110.419 146.81 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 8' ' ' ASN . . . . . . . . . . . . . 43.4 p-10 -70.48 77.12 0.57 Allowed 'General case' 0 CA--C 1.569 1.683 0 O-C-N 120.989 -1.069 . . . . 0.0 113.842 172.238 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 9' ' ' PHE . . . . . 0.474 ' HD2' HD11 ' B' ' 34' ' ' LEU . 12.2 t80 -73.52 145.7 45.4 Favored 'General case' 0 CA--C 1.558 1.268 0 CA-C-O 126.666 3.126 . . . . 0.0 110.207 168.262 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 10' ' ' ARG . . . . . . . . . . . . . 1.6 ttp180 -173.74 127.77 0.4 Allowed 'General case' 0 C--N 1.298 -1.652 0 CA-C-N 111.235 -2.711 . . . . 0.0 104.818 -135.847 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 11' ' ' MET . . . . . 0.428 ' HB3' ' HB ' ' B' ' 15' ' ' VAL . 1.3 mpt? -143.04 129.71 10.61 Favored Pre-proline 0 CA--C 1.559 1.307 0 CA-C-O 117.271 -1.347 . . . . 0.0 113.836 -159.896 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 12' ' ' PRO . . . . . . . . . . . . . 85.0 Cg_exo -43.06 146.27 0.98 Allowed 'Trans proline' 0 C--N 1.376 1.987 0 C-N-CA 123.201 2.601 . . . . 0.0 116.005 164.167 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 13' ' ' MET . . . . . . . . . . . . . 1.7 tpt -51.34 -36.41 42.83 Favored 'General case' 0 CA--C 1.57 1.749 0 N-CA-C 117.177 2.288 . . . . 0.0 117.177 -159.868 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 14' ' ' GLU . . . . . . . . . . . . 0.252 7.5 pt-20 -64.04 -51.02 66.13 Favored 'General case' 0 CA--C 1.572 1.799 0 N-CA-C 116.36 1.985 . . . . 0.0 116.36 170.407 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 15' ' ' VAL . . . . . 0.428 ' HB ' ' HB3' ' B' ' 11' ' ' MET . 0.0 OUTLIER -56.03 -49.9 72.87 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.393 0 CA-C-N 123.364 2.802 . . . . 0.0 111.972 171.797 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.4 -24.89 63.02 Favored 'General case' 0 N--CA 1.474 0.758 0 N-CA-C 117.304 2.335 . . . . 0.0 117.304 174.484 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 17' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -68.96 -40.41 78.9 Favored 'General case' 0 N--CA 1.492 1.655 0 CA-C-N 123.273 2.76 . . . . 0.0 113.986 154.632 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . 0.263 53.8 mtmt -71.85 -47.79 50.57 Favored 'General case' 0 CA--C 1.563 1.46 0 CA-C-N 121.534 1.97 . . . . 0.0 115.732 179.157 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 19' ' ' LEU . . . . . 0.547 ' HB3' ' CE ' ' B' ' 30' ' ' MET . 12.6 mt -56.02 -54.55 43.49 Favored 'General case' 0 CA--C 1.566 1.593 0 CA-C-N 120.225 1.375 . . . . 0.0 114.238 158.989 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 20' ' ' LYS . . . . . . . . . . . . . 15.1 ttpt -78.67 -20.84 49.31 Favored 'General case' 0 CA--C 1.572 1.809 0 O-C-N 119.453 -2.029 . . . . 0.0 114.371 -173.191 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 21' ' ' PHE . . . . . 0.465 ' O ' ' HB3' ' B' ' 25' ' ' ALA . 14.2 m-85 -68.62 -68.74 0.37 Allowed 'General case' 0 N--CA 1.489 1.516 0 CA-C-O 113.696 -3.05 . . . . 0.0 111.194 156.218 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . 0.276 13.5 tpp180 -22.97 -49.71 0.02 OUTLIER 'General case' 0 CA--C 1.599 2.86 1 CA-C-N 126.231 4.105 . . . . 0.0 115.554 162.7 . . . . . . . . 3 2 . 1 . 013 nuclear build full ' B' B ' 23' ' ' ALA . . . . . 0.433 ' HB2' ' CB ' ' B' ' 33' ' ' GLU 0.265 . . -60.09 -76.08 0.05 Allowed 'General case' 0 CA--C 1.582 2.176 0 N-CA-C 116.815 2.154 . . . . 0.0 116.815 160.884 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 57.7 mm-40 -71.43 -35.03 70.82 Favored 'General case' 0 N--CA 1.5 2.057 0 N-CA-C 118.921 2.934 . . . . 0.0 118.921 -177.516 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 25' ' ' ALA . . . . . 0.465 ' HB3' ' O ' ' B' ' 21' ' ' PHE . . . -44.69 -50.27 10.02 Favored 'General case' 0 CA--C 1.585 2.32 0 N-CA-C 115.89 1.811 . . . . 0.0 115.89 155.705 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 26' ' ' ASN . . . . . . . . . . . . . 12.2 m120 -82.74 -43.37 16.88 Favored 'General case' 0 N--CA 1.501 2.124 0 N-CA-C 116.823 2.157 . . . . 0.0 116.823 176.3 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 27' ' ' GLY . . . . . . . . . . . . . . . 106.51 30.29 4.42 Favored Glycine 0 CA--C 1.561 2.936 0 N-CA-C 118.001 1.96 . . . . 0.0 118.001 -152.875 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 28' ' ' ARG . . . . . 0.566 HH22 HD13 ' B' ' 37' ' ' ILE . 48.4 mtm180 -114.62 145.39 42.06 Favored 'General case' 0 CA--C 1.57 1.742 0 N-CA-C 104.179 -2.526 . . . . 0.0 104.179 171.852 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 29' ' ' SER . . . . . . . . . . . . . 81.0 p -113.05 115.15 27.91 Favored 'General case' 0 N--CA 1.507 2.419 0 O-C-N 117.964 -2.96 . . . . 0.0 105.896 -170.271 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 30' ' ' MET . . . . . 0.547 ' CE ' ' HB3' ' B' ' 19' ' ' LEU . 32.6 mtp -46.62 -42.18 15.8 Favored 'General case' 0 N--CA 1.498 1.943 0 N-CA-C 118.833 2.901 . . . . 0.0 118.833 -141.566 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 31' ' ' ASN . . . . . . . . . . . . . 6.0 t-20 -45.1 -45.52 11.2 Favored 'General case' 0 CA--C 1.594 2.652 0 CA-C-N 125.974 3.988 . . . . 0.0 115.835 163.225 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 32' ' ' SER . . . . . . . . . . . . 0.274 51.7 m -55.34 -62.73 1.48 Allowed 'General case' 0 N--CA 1.502 2.156 0 N-CA-C 120.47 3.507 . . . . 0.0 120.47 151.963 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 33' ' ' GLU . . . . . 0.433 ' CB ' ' HB2' ' B' ' 23' ' ' ALA . 6.2 tm-20 -58.54 -62.58 1.75 Allowed 'General case' 0 N--CA 1.507 2.42 0 CA-C-N 123.076 2.671 . . . . 0.0 115.675 175.343 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 34' ' ' LEU . . . . . 0.781 HD12 ' CZ ' ' A' ' 7' ' ' PHE . 0.0 OUTLIER -44.23 -52.07 7.74 Favored 'General case' 0 C--O 1.212 -0.894 0 CA-C-O 115.653 -2.118 . . . . 0.0 105.948 178.254 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 35' ' ' LEU . . . . . 0.41 ' HG ' ' CE1' ' A' ' 9' ' ' PHE . 8.3 mt -63.17 -56.12 19.39 Favored 'General case' 0 C--N 1.364 1.237 0 CA-C-N 123.319 2.782 . . . . 0.0 116.839 179.98 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 36' ' ' GLN . . . . . . . . . . . . 0.287 0.7 OUTLIER -59.11 -35.85 74.14 Favored 'General case' 0 CA--C 1.568 1.663 0 CA-C-O 117.599 -1.191 . . . . 0.0 113.875 176.122 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 37' ' ' ILE . . . . . 0.566 HD13 HH22 ' B' ' 28' ' ' ARG . 1.3 tp -73.54 -26.08 21.65 Favored 'Isoleucine or valine' 0 CA--C 1.568 1.672 0 N-CA-C 117.831 2.53 . . . . 0.0 117.831 164.015 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 38' ' ' VAL . . . . . 0.496 ' HA ' ' HB3' ' B' ' 41' ' ' ALA . 2.4 t -80.97 -46.26 20.82 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.091 0 C-N-CA 127.887 2.475 . . . . 0.0 112.285 179.807 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 33.5 mt-30 -46.26 -46.92 18.12 Favored 'General case' 0 CA--C 1.576 1.968 0 C-N-CA 124.094 0.958 . . . . 0.0 113.53 150.023 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 40' ' ' ASP . . . . . . . . . . . . 0.289 1.2 t70 -58.56 -32.36 68.84 Favored 'General case' 0 CA--C 1.575 1.918 0 N-CA-C 118.151 2.648 . . . . 0.0 118.151 159.534 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 41' ' ' ALA . . . . . 0.496 ' HB3' ' HA ' ' B' ' 38' ' ' VAL . . . -78.34 -50.92 10.9 Favored 'General case' 0 N--CA 1.48 1.072 0 N-CA-C 115.811 1.782 . . . . 0.0 115.811 -167.715 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 2.6 pp -89.01 -21.33 23.54 Favored 'General case' 0 CA--C 1.566 1.564 0 N-CA-C 117.281 2.326 . . . . 0.0 117.281 164.812 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 43' ' ' SER . . . . . . . . . . . . . 41.8 t -126.39 45.91 2.56 Favored 'General case' 0 CA--C 1.568 1.654 0 CA-C-N 121.568 1.985 . . . . 0.0 114.294 177.322 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 44' ' ' LYS . . . . . . . . . . . . . 2.4 tmtm? -47.4 -61.84 2.57 Favored Pre-proline 0 CA--C 1.588 2.412 0 N-CA-C 121.281 3.808 . . . . 0.0 121.281 172.03 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 61.9 Cg_endo -86.65 139.53 5.73 Favored 'Trans proline' 0 CA--C 1.562 1.884 0 N-CA-C 119.614 2.89 . . . . 0.0 119.614 -141.126 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 46' ' ' SER . . . . . . . . . . . . 0.27 44.0 m -140.39 -88.88 0.0 OUTLIER Pre-proline 0 CA--C 1.574 1.892 0 CA-C-O 115.01 -2.424 . . . . 0.0 109.952 141.713 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_endo -82.04 71.81 6.49 Favored 'Trans proline' 0 CA--C 1.567 2.129 0 CA-C-N 127.022 3.543 . . . . 0.0 113.883 174.568 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 48' ' ' VAL . . . . . . . . . . . . . 13.0 p -157.07 115.96 0.26 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.927 0 CA-C-O 123.082 1.42 . . . . 0.0 111.216 -173.656 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 49' ' ' THR . . . . . . . . . . . . . 4.0 t -163.66 57.18 0.17 Allowed 'General case' 0 N--CA 1.5 2.057 0 O-C-N 120.617 -1.302 . . . . 0.0 113.87 -132.136 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 50' ' ' GLY . . . . . . . . . . . . . . . 73.7 81.94 0.39 Allowed Glycine 0 N--CA 1.496 2.656 0 O-C-N 121.057 -1.027 . . . . 0.0 113.752 -170.52 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 51' ' ' TYR . . . . . . . . . . . . . 2.8 p90 -55.86 134.66 52.05 Favored 'General case' 0 CA--C 1.576 1.972 2 O-C-N 114.585 -5.067 . . . . 0.0 120.75 22.028 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 52' ' ' ARG . . . . . . . . . . . . . 53.9 ttp85 -156.5 94.52 1.49 Allowed 'General case' 0 CA--C 1.566 1.569 0 N-CA-C 107.037 -1.468 . . . . 0.0 107.037 168.609 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 53' ' ' ASN . . . . . 0.688 ' HB2' ' HA ' ' A' ' 54' ' ' ASP 0.321 4.5 t-20 -87.62 -4.31 58.95 Favored 'General case' 0 N--CA 1.506 2.34 0 C-N-CA 129.781 3.232 . . . . 0.0 110.341 169.899 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 54' ' ' ASP . . . . . 0.477 ' HA ' ' HB2' ' B' ' 57' ' ' ARG 0.535 1.1 p30 -72.01 57.03 0.32 Allowed 'General case' 0 CA--C 1.573 1.831 0 CA-C-N 123.986 3.085 . . . . 0.0 112.513 167.895 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 55' ' ' ALA . . . . . 0.554 ' H ' ' N ' ' B' ' 57' ' ' ARG . . . -156.0 -76.21 0.1 Allowed 'General case' 0 C--N 1.316 -0.877 0 N-CA-C 103.282 -2.858 . . . . 0.0 103.282 -127.329 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 56' ' ' GLU . . . . . 0.535 ' HG2' ' CE1' ' A' ' 51' ' ' TYR . 39.2 mt-10 -42.94 -57.15 2.96 Favored 'General case' 0 N--CA 1.48 1.036 0 N-CA-C 118.789 2.885 . . . . 0.0 118.789 123.32 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 57' ' ' ARG . . . . . 0.554 ' N ' ' H ' ' B' ' 55' ' ' ALA . 1.4 mpt_? -75.41 -37.62 60.35 Favored 'General case' 0 C--N 1.319 -0.717 0 N-CA-C 114.759 1.392 . . . . 0.0 114.759 -163.119 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 58' ' ' LEU . . . . . 0.468 ' H ' ' C ' ' B' ' 54' ' ' ASP 0.488 31.0 mt -109.19 2.33 20.89 Favored 'General case' 0 CA--C 1.588 2.41 0 CA-C-N 120.312 1.414 . . . . 0.0 113.097 171.263 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 59' ' ' ALA . . . . . 0.553 ' HB2' ' O ' ' B' ' 55' ' ' ALA . . . -52.62 -29.93 28.66 Favored 'General case' 0 N--CA 1.498 1.946 0 O-C-N 118.034 -2.916 . . . . 0.0 117.461 127.321 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . 0.332 19.8 t0 -100.68 -8.75 22.53 Favored 'General case' 0 CA--C 1.56 1.345 0 N-CA-C 115.907 1.817 . . . . 0.0 115.907 -175.321 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -51.31 -59.56 4.09 Favored 'General case' 0 CA--C 1.564 1.513 0 CA-C-O 116.459 -1.734 . . . . 0.0 112.548 129.483 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 62' ' ' GLN . . . . . 0.74 ' O ' HG13 ' B' ' 66' ' ' VAL 0.331 0.1 OUTLIER -47.83 -54.34 12.76 Favored 'General case' 0 CA--C 1.566 1.596 0 CA-C-N 123.303 2.774 . . . . 0.0 116.269 171.292 . . . . . . . . 4 4 . 1 . 013 nuclear build full ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 61.1 m -30.41 -49.28 0.11 Allowed 'General case' 0 N--CA 1.516 2.858 0 N-CA-C 118.913 2.931 . . . . 0.0 118.913 164.579 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 64' ' ' GLU . . . . . . . . . . . . 0.548 0.4 OUTLIER -99.83 -8.28 24.32 Favored 'General case' 0 CA--C 1.597 2.776 0 CA-C-N 112.875 -1.966 . . . . 0.0 111.188 -167.51 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 65' ' ' LEU . . . . . . . . . . . . 0.297 0.3 OUTLIER -77.51 -47.02 20.63 Favored 'General case' 0 CA--C 1.583 2.221 0 O-C-N 118.571 -2.581 . . . . 0.0 116.64 147.623 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 66' ' ' VAL . . . . . 0.74 HG13 ' O ' ' B' ' 62' ' ' GLN . 31.5 m . . . . . 0 N--CA 1.515 2.788 0 N-CA-C 119.257 3.058 . . . . 0.0 119.257 -160.628 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.56 1.362 0 N-CA-C 113.592 0.96 . . . . 0.0 113.592 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 57.9 mtp180 -86.14 88.76 7.65 Favored 'General case' 0 CA--C 1.568 1.671 0 CA-C-O 121.962 0.887 . . . . 0.0 111.752 173.753 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 4.3 p-10 -82.68 55.39 2.98 Favored 'General case' 0 CA--C 1.571 1.786 0 O-C-N 120.884 -1.135 . . . . 0.0 112.47 163.411 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 8.8 p-10 -149.38 69.53 9.61 Favored Pre-proline 0 CA--C 1.567 1.617 0 O-C-N 120.835 -1.166 . . . . 0.0 112.049 -175.352 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 64.1 Cg_endo -64.37 148.39 90.86 Favored 'Trans proline' 0 CA--C 1.559 1.752 0 C-N-CA 123.698 2.932 . . . . 0.0 116.486 175.847 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 73.2 m80 -92.44 133.01 36.31 Favored 'General case' 0 CA--C 1.566 1.57 0 CA-C-N 113.301 -1.772 . . . . 0.0 110.956 178.977 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' PHE . . . . . 0.564 ' CZ ' HD23 ' B' ' 34' ' ' LEU . 2.8 p90 -125.82 151.23 47.07 Favored 'General case' 0 CA--C 1.563 1.479 0 O-C-N 120.423 -1.423 . . . . 0.0 110.28 154.285 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 14.3 m120 -69.25 90.67 0.5 Allowed 'General case' 0 N--CA 1.488 1.445 0 O-C-N 120.434 -1.416 . . . . 0.0 111.465 167.517 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' PHE . . . . . 0.53 ' HD2' HD11 ' A' ' 34' ' ' LEU . 4.5 t80 -72.57 159.7 33.48 Favored 'General case' 0 CA--C 1.565 1.54 0 CA-C-O 125.207 2.432 . . . . 0.0 109.824 153.723 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 3.1 tmm_? -176.5 114.93 0.11 Allowed 'General case' 0 C--N 1.308 -1.232 0 N-CA-C 104.499 -2.408 . . . . 0.0 104.499 -141.493 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' MET . . . . . 0.489 ' SD ' ' CD2' ' A' ' 9' ' ' PHE . 0.1 OUTLIER -127.18 116.28 21.74 Favored Pre-proline 0 CA--C 1.559 1.311 0 CA-C-O 116.957 -1.497 . . . . 0.0 110.934 -162.488 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 81.5 Cg_exo -40.04 138.13 1.18 Allowed 'Trans proline' 0 CA--C 1.562 1.914 0 CA-C-N 123.798 2.392 . . . . 0.0 116.074 160.488 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' MET . . . . . 0.442 ' SD ' ' HG3' ' A' ' 17' ' ' GLU . 15.5 tpp -54.84 -25.83 31.18 Favored 'General case' 0 N--CA 1.496 1.836 0 N-CA-C 119.496 3.147 . . . . 0.0 119.496 -160.323 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -58.31 -57.55 12.41 Favored 'General case' 0 CA--C 1.568 1.655 0 N-CA-C 117.353 2.353 . . . . 0.0 117.353 156.976 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -55.42 -45.88 78.38 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.433 0 CA-C-N 121.887 2.13 . . . . 0.0 113.454 173.731 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -77.42 -27.89 52.42 Favored 'General case' 0 N--CA 1.474 0.75 0 CA-C-O 115.792 -2.052 . . . . 0.0 116.137 175.176 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.442 ' HG3' ' SD ' ' A' ' 13' ' ' MET . 38.4 mt-10 -65.0 -41.27 95.53 Favored 'General case' 0 N--CA 1.485 1.29 0 CA-C-N 124.252 3.205 . . . . 0.0 113.345 158.684 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . 0.542 32.5 pttt -77.44 -39.41 46.88 Favored 'General case' 0 CA--C 1.563 1.449 0 N-CA-C 116.989 2.218 . . . . 0.0 116.989 179.768 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.566 HD21 ' HG ' ' A' ' 34' ' ' LEU . 12.9 tp -66.27 -36.99 84.41 Favored 'General case' 0 CA--C 1.569 1.674 0 CA-C-N 120.595 1.543 . . . . 0.0 114.885 163.632 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.412 ' HA ' ' HB3' ' A' ' 23' ' ' ALA . 13.3 ttpt -90.26 -25.22 20.67 Favored 'General case' 0 CA--C 1.574 1.873 0 N-CA-C 114.821 1.415 . . . . 0.0 114.821 -179.825 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 21' ' ' PHE . . . . . 0.437 ' O ' ' HB3' ' A' ' 25' ' ' ALA . 24.1 m-85 -64.98 -69.58 0.28 Allowed 'General case' 0 N--CA 1.494 1.751 0 CA-C-O 113.581 -3.104 . . . . 0.0 110.501 155.974 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . 0.35 2.5 tmt_? -28.84 -44.0 0.03 OUTLIER 'General case' 0 CA--C 1.605 3.074 0 CA-C-N 125.747 3.885 . . . . 0.0 115.272 166.58 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.507 ' HB2' ' CB ' ' A' ' 33' ' ' GLU . . . -57.85 -76.28 0.04 OUTLIER 'General case' 0 CA--C 1.582 2.203 0 N-CA-C 117.445 2.387 . . . . 0.0 117.445 157.727 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 37.6 mt-10 -58.99 -46.61 87.7 Favored 'General case' 0 N--CA 1.505 2.276 0 N-CA-C 118.092 2.627 . . . . 0.0 118.092 178.026 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.437 ' HB3' ' O ' ' A' ' 21' ' ' PHE . . . -41.03 -46.52 2.9 Favored 'General case' 0 CA--C 1.585 2.323 0 N-CA-C 116.606 2.076 . . . . 0.0 116.606 160.866 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 81.5 m-20 -78.68 -42.66 27.94 Favored 'General case' 0 N--CA 1.501 2.105 0 N-CA-C 117.554 2.428 . . . . 0.0 117.554 167.711 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 100.38 25.62 8.68 Favored Glycine 0 CA--C 1.559 2.832 0 N-CA-C 118.312 2.085 . . . . 0.0 118.312 -151.422 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 44.4 mtt85 -102.86 155.06 18.6 Favored 'General case' 0 CA--C 1.568 1.654 0 CA-C-N 119.39 1.595 . . . . 0.0 106.762 164.129 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 39.2 t -114.14 118.96 35.5 Favored 'General case' 0 N--CA 1.5 2.064 0 N-CA-C 105.194 -2.15 . . . . 0.0 105.194 -178.893 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 15.1 mtp -47.61 -36.95 11.62 Favored 'General case' 0 N--CA 1.5 2.061 0 N-CA-C 119.25 3.056 . . . . 0.0 119.25 -146.599 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 50.3 t30 -45.53 -45.65 13.49 Favored 'General case' 0 CA--C 1.598 2.827 0 CA-C-N 125.622 3.828 . . . . 0.0 115.715 161.881 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . 0.35 12.8 t -49.12 -73.73 0.04 OUTLIER 'General case' 0 N--CA 1.499 1.982 0 N-CA-C 117.877 2.547 . . . . 0.0 117.877 145.574 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 33' ' ' GLU . . . . . 0.507 ' CB ' ' HB2' ' A' ' 23' ' ' ALA . 10.1 tp10 -57.92 -57.35 13.18 Favored 'General case' 0 N--CA 1.516 2.834 0 CA-C-N 124.017 3.099 . . . . 0.0 116.523 -174.656 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.834 HD12 ' CZ ' ' B' ' 7' ' ' PHE . 0.1 OUTLIER -42.56 -53.2 4.49 Favored 'General case' 0 CA--C 1.555 1.145 0 CA-C-O 115.476 -2.202 . . . . 0.0 107.183 171.164 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.414 ' HG ' ' CE1' ' B' ' 9' ' ' PHE . 16.0 mt -62.24 -43.85 97.9 Favored 'General case' 0 C--N 1.368 1.388 0 CA-C-N 124.077 3.126 . . . . 0.0 115.954 174.036 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.76 -44.23 93.95 Favored 'General case' 0 N--CA 1.49 1.553 0 N-CA-C 115.37 1.619 . . . . 0.0 115.37 175.106 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 37' ' ' ILE . . . . . 0.414 ' O ' ' HB2' ' A' ' 41' ' ' ALA . 3.4 tt -75.07 -20.79 16.46 Favored 'Isoleucine or valine' 0 CA--C 1.564 1.493 0 CA-C-O 114.667 -2.587 . . . . 0.0 116.056 165.537 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.518 HG21 HD22 ' A' ' 34' ' ' LEU . 4.1 t -89.91 -48.53 14.33 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.001 0 CA-C-N 123.222 2.737 . . . . 0.0 109.927 -174.915 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 26.6 mt-30 -55.32 -43.67 75.13 Favored 'General case' 0 CA--C 1.565 1.527 0 O-C-N 121.276 -0.89 . . . . 0.0 112.31 156.953 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . 0.672 0.4 OUTLIER -61.02 -28.02 68.75 Favored 'General case' 0 CA--C 1.571 1.78 0 N-CA-C 118.531 2.789 . . . . 0.0 118.531 157.572 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 41' ' ' ALA . . . . . 0.417 ' HB3' ' HA ' ' A' ' 38' ' ' VAL . . . -74.68 -47.52 31.29 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 119.431 -2.043 . . . . 0.0 114.238 -179.766 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.422 HD11 ' HB2' ' B' ' 19' ' ' LEU . 0.8 OUTLIER -77.48 -34.54 54.23 Favored 'General case' 0 CA--C 1.572 1.795 0 N-CA-C 114.059 1.133 . . . . 0.0 114.059 175.507 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 88.3 p -130.7 68.31 1.48 Allowed 'General case' 0 CA--C 1.571 1.765 0 N-CA-C 113.167 0.803 . . . . 0.0 113.167 173.069 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . 0.44 0.1 OUTLIER -54.91 -85.61 0.01 OUTLIER Pre-proline 0 CA--C 1.583 2.224 1 N-CA-C 122.787 4.366 . . . . 0.0 122.787 172.878 . . . . . . . . 4 3 . 1 . 014 nuclear build full ' A' A ' 45' ' ' PRO . . . . . 0.649 ' HA ' ' HE ' ' B' ' 57' ' ' ARG . 31.3 Cg_exo -81.93 148.12 15.31 Favored 'Trans proline' 0 CA--C 1.558 1.711 0 N-CA-C 119.585 2.879 . . . . 0.0 119.585 -122.733 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 74.3 m -85.85 95.99 0.44 Allowed Pre-proline 0 CA--C 1.58 2.119 0 CA-C-N 115.004 -0.998 . . . . 0.0 109.395 127.088 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -88.61 69.39 2.71 Favored 'Trans proline' 0 C--N 1.372 1.796 0 CA-C-N 123.188 2.174 . . . . 0.0 114.424 -166.832 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . 0.273 12.3 p -137.56 -62.41 0.37 Allowed 'Isoleucine or valine' 0 N--CA 1.505 2.295 0 N-CA-C 115.567 1.692 . . . . 0.0 115.567 -160.586 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . 0.251 5.6 t -94.98 80.97 3.68 Favored 'General case' 0 N--CA 1.493 1.682 0 CA-C-O 122.845 1.307 . . . . 0.0 112.614 -149.764 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 73.25 19.82 79.75 Favored Glycine 0 N--CA 1.497 2.725 0 N-CA-C 119.054 2.381 . . . . 0.0 119.054 -166.908 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 18.3 m-30 -101.55 76.75 1.7 Allowed 'General case' 0 CA--C 1.572 1.817 0 CA-C-N 118.924 1.362 . . . . 0.0 112.318 -164.089 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 78.4 ttt180 -93.04 94.53 8.93 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.109 -0.994 . . . . 0.0 110.825 172.786 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 53' ' ' ASN . . . . . 0.552 HD22 ' N ' ' A' ' 54' ' ' ASP 0.276 0.4 OUTLIER -161.0 -78.82 0.05 OUTLIER 'General case' 0 CA--C 1.592 2.583 0 N-CA-C 114.388 1.255 . . . . 0.0 114.388 -152.944 . . . . . . . . 4 4 . 1 . 014 nuclear build full ' A' A ' 54' ' ' ASP . . . . . 0.552 ' N ' HD22 ' A' ' 53' ' ' ASN 1.802 1.1 m-20 119.54 -40.21 0.01 OUTLIER 'General case' 0 N--CA 1.516 2.869 0 N-CA-C 121.194 3.776 . . . . 0.0 121.194 -133.635 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 55' ' ' ALA . . . . . 0.698 ' O ' ' HB2' ' A' ' 57' ' ' ARG 0.292 . . 40.66 112.5 0.0 OUTLIER 'General case' 0 C--O 1.187 -2.221 2 CA-C-O 102.999 -8.143 . . . . 0.0 123.135 -75.926 . . . . . . . . 4 3 . 1 . 014 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . 0.79 14.2 tt0 -39.28 55.69 0.0 OUTLIER 'General case' 0 N--CA 1.519 2.979 3 CA-C-N 134.192 7.724 . . . . 0.0 129.45 -166.886 . . . . . . . . 3 2 . 1 . 014 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 1.032 ' CA ' ' H ' ' A' ' 59' ' ' ALA 0.484 0.0 OUTLIER 165.15 -137.52 0.0 OUTLIER 'General case' 1 CA--C 1.646 4.659 2 O-C-N 114.204 -5.31 . . . . 0.0 99.378 -105.183 . . . . . . . . 6 4 . 1 . 014 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.489 HD11 HD11 ' B' ' 37' ' ' ILE 0.691 0.6 OUTLIER -25.32 53.69 0.0 OUTLIER 'General case' 0 CA--C 1.587 2.387 1 O-C-N 115.488 -4.507 . . . . 0.0 120.437 -58.173 . . . . . . . . 5 4 . 1 . 014 nuclear build full ' A' A ' 59' ' ' ALA . . . . . 1.032 ' H ' ' CA ' ' A' ' 57' ' ' ARG 2.674 . . 110.91 54.19 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.603 1 N-CA-C 123.176 4.51 . . . . 0.0 123.176 174.829 . . . . . . . . 4 3 . 1 . 014 nuclear build full ' A' A ' 60' ' ' ASP . . . . . 0.435 ' HA ' ' OG ' ' A' ' 63' ' ' SER 2.253 7.0 t70 47.5 21.95 0.27 Allowed 'General case' 0 N--CA 1.488 1.427 0 CA-C-N 124.692 3.406 . . . . 0.0 116.55 -140.47 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 1.017 ' HA ' ' H ' ' A' ' 63' ' ' SER 2.214 2.5 mt-10 91.7 164.98 0.03 OUTLIER 'General case' 1 CA--C 1.64 4.437 1 CA-C-O 130.905 5.145 . . . . 0.0 114.587 -138.813 . . . . . . . . 5 3 . 1 . 014 nuclear build full ' A' A ' 62' ' ' GLN . . . . . 0.584 ' O ' HG13 ' A' ' 66' ' ' VAL . 0.0 OUTLIER 4.03 -26.27 0.0 OUTLIER 'General case' 0 C--N 1.279 -2.47 1 O-C-N 106.065 -10.397 . . . . 0.0 120.439 86.303 . . . . . . . . 4 4 . 1 . 014 nuclear build full ' A' A ' 63' ' ' SER . . . . . 1.017 ' H ' ' HA ' ' A' ' 61' ' ' GLU 2.052 0.5 OUTLIER 117.81 174.84 0.0 OUTLIER 'General case' 0 N--CA 1.396 -3.17 0 N-CA-C 120.609 3.559 . . . . 0.0 120.609 152.439 . . . . . . . . 4 4 . 1 . 014 nuclear build full ' A' A ' 64' ' ' GLU . . . . . 0.513 ' C ' ' HB3' ' A' ' 63' ' ' SER 0.33 0.1 OUTLIER -3.42 -27.18 0.0 OUTLIER 'General case' 2 CA--C 1.699 6.679 1 N-CA-C 132.817 8.08 . . . . 0.0 132.817 44.05 . . . . . . . . 6 4 . 1 . 014 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.646 ' N ' ' HB3' ' A' ' 63' ' ' SER . 0.5 OUTLIER -64.24 -51.26 64.53 Favored 'General case' 0 C--N 1.424 3.837 2 CA-C-N 131.168 6.349 . . . . 0.0 112.394 165.206 . . . . . . . . 4 4 . 1 . 014 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.584 HG13 ' O ' ' A' ' 62' ' ' GLN 0.428 27.8 m . . . . . 0 N--CA 1.497 1.907 1 N-CA-C 122.052 4.093 . . . . 0.0 122.052 156.836 . . . . . . . . 3 2 . 1 . 014 nuclear build full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.561 1.376 0 N-CA-C 113.43 0.9 . . . . 0.0 113.43 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 2' ' ' ARG . . . . . . . . . . . . . 16.4 mmm180 -81.28 79.19 7.97 Favored 'General case' 0 N--CA 1.494 1.732 0 CA-C-O 122.715 1.245 . . . . 0.0 113.467 -179.837 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . 0.252 5.8 p-10 -162.97 -49.44 0.04 OUTLIER 'General case' 0 N--CA 1.493 1.713 0 C-N-CA 124.666 1.186 . . . . 0.0 112.95 179.787 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 4' ' ' ASP . . . . . . . . . . . . . 6.6 p30 -144.91 85.72 8.14 Favored Pre-proline 0 CA--C 1.566 1.588 0 CA-C-O 118.331 -0.843 . . . . 0.0 111.357 157.766 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 3.3 Cg_exo -89.93 140.93 3.56 Favored 'Trans proline' 0 CA--C 1.552 1.408 0 CA-C-N 122.521 1.936 . . . . 0.0 113.683 -160.507 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 6' ' ' HIS . . . . . . . . . . . . . 78.5 m80 -83.22 128.95 34.94 Favored 'General case' 0 CA--C 1.562 1.44 0 CA-C-N 114.155 -1.384 . . . . 0.0 111.974 -178.171 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 7' ' ' PHE . . . . . 0.834 ' CZ ' HD12 ' A' ' 34' ' ' LEU . 4.2 p90 -129.45 146.53 51.28 Favored 'General case' 0 CA--C 1.562 1.406 0 O-C-N 120.599 -1.313 . . . . 0.0 110.754 154.577 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 8' ' ' ASN . . . . . . . . . . . . . 12.6 m120 -70.26 86.42 0.58 Allowed 'General case' 0 N--CA 1.489 1.509 0 O-C-N 120.552 -1.343 . . . . 0.0 111.261 170.369 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 9' ' ' PHE . . . . . 0.678 ' CD2' HD13 ' A' ' 34' ' ' LEU . 5.9 t80 -70.48 153.12 43.27 Favored 'General case' 0 CA--C 1.551 1.006 0 CA-C-O 124.91 2.29 . . . . 0.0 110.745 161.907 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -162.65 126.15 2.93 Favored 'General case' 0 N--CA 1.481 1.114 0 CA-C-N 112.433 -2.167 . . . . 0.0 108.504 -160.752 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 11' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -127.02 115.44 21.96 Favored Pre-proline 0 CA--C 1.562 1.435 0 CA-C-O 117.253 -1.356 . . . . 0.0 110.605 -156.689 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 12' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_exo -41.96 142.99 1.31 Allowed 'Trans proline' 0 C--N 1.374 1.883 0 C-N-CA 122.99 2.46 . . . . 0.0 115.69 160.371 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 13' ' ' MET . . . . . . . . . . . . . 20.2 tpp -61.74 -35.56 78.46 Favored 'General case' 0 N--CA 1.493 1.69 0 N-CA-C 117.403 2.371 . . . . 0.0 117.403 -149.14 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 8.0 pt-20 -59.07 -41.44 88.0 Favored 'General case' 0 CA--C 1.568 1.645 0 N-CA-C 116.649 2.092 . . . . 0.0 116.649 163.564 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 15' ' ' VAL . . . . . 0.414 ' CG1' HG12 ' A' ' 38' ' ' VAL . 0.4 OUTLIER -59.65 -48.85 85.93 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.146 0 CA-C-N 122.885 2.584 . . . . 0.0 112.594 171.101 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 16' ' ' ARG . . . . . . . . . . . . 0.259 2.8 ttt180 -72.15 -41.23 67.33 Favored 'General case' 0 C--O 1.216 -0.704 0 CA-C-N 120.69 1.586 . . . . 0.0 114.855 176.986 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 17' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -61.52 -34.82 76.18 Favored 'General case' 0 CA--C 1.571 1.781 0 CA-C-N 122.779 2.536 . . . . 0.0 115.043 166.41 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 55.7 mtmt -66.55 -55.61 14.63 Favored 'General case' 0 CA--C 1.563 1.452 0 CA-C-N 121.34 1.882 . . . . 0.0 114.666 165.31 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 19' ' ' LEU . . . . . 0.599 HD21 HD22 ' B' ' 34' ' ' LEU . 11.3 tp -64.71 -37.06 86.31 Favored 'General case' 0 CA--C 1.566 1.572 0 N-CA-C 116.353 1.982 . . . . 0.0 116.353 176.965 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 20' ' ' LYS . . . . . . . . . . . . . 3.8 ttpt -87.22 -25.02 24.21 Favored 'General case' 0 CA--C 1.568 1.655 0 CA-C-O 116.917 -1.516 . . . . 0.0 113.598 176.331 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 13.6 m-30 -65.27 -71.06 0.2 Allowed 'General case' 0 N--CA 1.496 1.85 0 CA-C-O 113.551 -3.118 . . . . 0.0 110.667 158.218 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . 0.273 1.5 tpp180 -13.69 -56.68 0.0 OUTLIER 'General case' 0 CA--C 1.595 2.707 0 CA-C-N 125.263 3.665 . . . . 0.0 115.988 158.273 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 23' ' ' ALA . . . . . 0.551 ' HB2' ' HB3' ' B' ' 33' ' ' GLU 0.261 . . -57.91 -77.65 0.03 OUTLIER 'General case' 0 CA--C 1.589 2.47 0 N-CA-C 117.653 2.464 . . . . 0.0 117.653 160.664 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 54.5 mt-10 -61.13 -42.83 99.26 Favored 'General case' 0 N--CA 1.503 2.216 0 N-CA-C 118.874 2.916 . . . . 0.0 118.874 179.251 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 25' ' ' ALA . . . . . . . . . . . . . . . -39.63 -50.26 2.25 Favored 'General case' 0 CA--C 1.585 2.322 0 N-CA-C 115.882 1.808 . . . . 0.0 115.882 158.45 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 26' ' ' ASN . . . . . . . . . . . . . 71.2 m-20 -82.11 -49.15 10.5 Favored 'General case' 0 N--CA 1.498 1.952 0 N-CA-C 116.293 1.96 . . . . 0.0 116.293 174.79 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 27' ' ' GLY . . . . . . . . . . . . . . . 109.49 15.06 12.86 Favored Glycine 0 CA--C 1.561 2.964 0 N-CA-C 118.756 2.262 . . . . 0.0 118.756 -148.25 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 28' ' ' ARG . . . . . . . . . . . . . 1.7 mtt85 -98.66 156.04 17.02 Favored 'General case' 0 CA--C 1.573 1.829 0 CA-C-N 120.358 2.079 . . . . 0.0 105.59 162.737 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 29' ' ' SER . . . . . 0.536 ' H ' ' HB3' ' B' ' 32' ' ' SER . 38.9 t -122.14 112.22 17.94 Favored 'General case' 0 N--CA 1.503 2.21 0 O-C-N 117.928 -2.983 . . . . 0.0 105.774 -172.228 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 30' ' ' MET . . . . . . . . . . . . . 20.4 mtp -42.88 -32.12 0.58 Allowed 'General case' 0 N--CA 1.505 2.305 0 N-CA-C 121.46 3.874 . . . . 0.0 121.46 -146.133 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 31' ' ' ASN . . . . . . . . . . . . 0.269 12.5 t-20 -50.46 -52.12 40.86 Favored 'General case' 0 CA--C 1.594 2.659 0 O-C-N 118.34 -2.725 . . . . 0.0 114.414 159.002 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 32' ' ' SER . . . . . 0.536 ' HB3' ' H ' ' B' ' 29' ' ' SER 0.321 30.5 t -45.2 -77.54 0.02 OUTLIER 'General case' 0 N--CA 1.501 2.088 0 N-CA-C 116.793 2.145 . . . . 0.0 116.793 145.223 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 33' ' ' GLU . . . . . 0.551 ' HB3' ' HB2' ' B' ' 23' ' ' ALA . 3.3 tp10 -67.83 -52.52 35.91 Favored 'General case' 0 N--CA 1.505 2.282 0 CA-C-N 123.728 2.967 . . . . 0.0 116.198 -168.095 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 34' ' ' LEU . . . . . 0.599 HD22 HD21 ' B' ' 19' ' ' LEU 0.595 0.1 OUTLIER -49.56 -36.76 24.83 Favored 'General case' 0 CA--C 1.569 1.683 0 CA-C-O 114.061 -2.876 . . . . 0.0 107.882 170.833 . . . . . . . . 4 4 . 1 . 014 nuclear build full ' B' B ' 35' ' ' LEU . . . . . 0.413 ' HG ' ' CE1' ' A' ' 9' ' ' PHE . 19.2 mt -65.56 -51.23 61.36 Favored 'General case' 0 N--CA 1.494 1.757 1 CA-C-N 126.493 4.224 . . . . 0.0 115.317 165.829 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 36' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -62.7 -39.12 93.0 Favored 'General case' 0 N--CA 1.477 0.905 0 CA-C-O 116.569 -1.682 . . . . 0.0 114.892 -177.325 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 37' ' ' ILE . . . . . 0.489 HD11 HD11 ' A' ' 58' ' ' LEU . 0.9 OUTLIER -69.36 -33.16 56.3 Favored 'Isoleucine or valine' 0 CA--C 1.572 1.802 0 CA-C-O 114.064 -2.874 . . . . 0.0 116.935 158.231 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 38' ' ' VAL . . . . . 0.407 ' CG1' HD22 ' A' ' 19' ' ' LEU . 2.2 t -77.24 -50.68 20.08 Favored 'Isoleucine or valine' 0 N--CA 1.513 2.706 0 CA-C-N 125.453 3.751 . . . . 0.0 112.259 -178.09 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 23.6 mt-30 -47.38 -44.76 24.53 Favored 'General case' 0 CA--C 1.557 1.226 0 CA-C-O 116.935 -1.507 . . . . 0.0 112.072 153.534 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 40' ' ' ASP . . . . . 0.431 ' HA ' ' HB2' ' B' ' 44' ' ' LYS 0.671 0.0 OUTLIER -48.0 -57.31 5.93 Favored 'General case' 0 N--CA 1.494 1.73 0 N-CA-C 117.051 2.241 . . . . 0.0 117.051 156.03 . . . . . . . . 4 4 . 1 . 014 nuclear build full ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -71.01 -44.64 65.48 Favored 'General case' 0 CA--C 1.543 0.684 0 N-CA-C 115.076 1.51 . . . . 0.0 115.076 -151.153 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . 0.312 0.7 OUTLIER -86.1 -27.09 24.89 Favored 'General case' 0 N--CA 1.49 1.56 0 N-CA-C 118.394 2.738 . . . . 0.0 118.394 157.372 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 43' ' ' SER . . . . . . . . . . . . . 30.5 t -142.9 38.06 1.45 Allowed 'General case' 0 N--CA 1.492 1.657 0 N-CA-C 117.866 2.543 . . . . 0.0 117.866 -166.744 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 44' ' ' LYS . . . . . 0.431 ' HB2' ' HA ' ' B' ' 40' ' ' ASP 0.345 50.5 mttp -104.42 84.81 0.98 Allowed Pre-proline 0 N--CA 1.522 3.153 0 CA-C-N 122.762 2.528 . . . . 0.0 117.416 163.326 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 38.7 Cg_exo -58.42 96.33 0.08 OUTLIER 'Trans proline' 0 CA--C 1.573 2.453 0 C-N-CA 123.541 2.827 . . . . 0.0 115.342 137.762 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 46' ' ' SER . . . . . . . . . . . . . 97.8 p -146.1 99.17 4.3 Favored Pre-proline 0 CA--C 1.577 1.99 0 CA-C-O 117.262 -1.352 . . . . 0.0 113.251 -165.392 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 34.0 Cg_endo -93.04 62.94 0.33 Allowed 'Cis proline' 0 CA--C 1.572 2.396 0 CA-C-N 124.112 2.504 . . . . 0.0 116.67 -7.996 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 48' ' ' VAL . . . . . . . . . . . . 0.279 2.8 t 61.09 47.68 0.26 Allowed 'Isoleucine or valine' 0 N--CA 1.511 2.597 0 N-CA-C 114.954 1.465 . . . . 0.0 114.954 174.389 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 49' ' ' THR . . . . . . . . . . . . . 29.2 p -100.85 59.73 0.94 Allowed 'General case' 0 N--CA 1.498 1.935 0 O-C-N 120.333 -1.48 . . . . 0.0 113.328 -166.383 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 50' ' ' GLY . . . . . . . . . . . . . . . 146.86 -88.69 0.15 Allowed Glycine 0 N--CA 1.491 2.325 0 CA-C-O 119.221 -0.766 . . . . 0.0 114.476 -175.589 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 51' ' ' TYR . . . . . . . . . . . . . 35.2 t80 -142.24 67.05 1.33 Allowed 'General case' 0 CA--C 1.58 2.101 2 O-C-N 114.871 -4.899 . . . . 0.0 109.479 0.076 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 52' ' ' ARG . . . . . . . . . . . . . 15.8 tpp85 -54.66 136.58 45.45 Favored 'General case' 0 N--CA 1.506 2.344 0 C-N-CA 124.737 1.215 . . . . 0.0 113.464 174.837 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 53' ' ' ASN . . . . . 0.512 ' HB2' ' HB3' ' B' ' 55' ' ' ALA 0.579 52.4 p30 -137.01 170.35 16.26 Favored 'General case' 0 N--CA 1.493 1.679 1 N-CA-C 122.957 4.429 . . . . 0.0 122.957 -155.745 . . . . . . . . 4 3 . 1 . 014 nuclear build full ' B' B ' 54' ' ' ASP . . . . . 0.741 ' N ' ' HB3' ' B' ' 55' ' ' ALA 0.984 0.0 OUTLIER -134.06 10.21 3.86 Favored 'General case' 0 N--CA 1.499 1.999 1 N-CA-C 125.339 5.311 . . . . 0.0 125.339 -177.681 . . . . . . . . 5 4 . 1 . 014 nuclear build full ' B' B ' 55' ' ' ALA . . . . . 0.741 ' HB3' ' N ' ' B' ' 54' ' ' ASP 0.277 . . 28.05 -85.1 0.0 OUTLIER 'General case' 0 CA--C 1.579 2.073 2 N-CA-C 123.13 4.492 . . . . 0.0 123.13 62.462 . . . . . . . . 4 3 . 1 . 014 nuclear build full ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 10.3 tt0 -84.98 -7.0 59.33 Favored 'General case' 0 CA--C 1.589 2.464 0 N-CA-C 120.051 3.352 . . . . 0.0 120.051 165.727 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 57' ' ' ARG . . . . . 0.829 ' HA ' ' HB2' ' B' ' 59' ' ' ALA . 0.2 OUTLIER -67.76 -128.86 0.0 OUTLIER 'General case' 0 CA--C 1.553 1.074 0 O-C-N 117.066 -3.521 . . . . 0.0 106.507 111.811 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 58' ' ' LEU . . . . . . . . . . . . 2.386 0.2 OUTLIER 45.67 -55.18 0.0 OUTLIER 'General case' 0 N--CA 1.513 2.688 1 CA-C-N 129.763 5.71 . . . . 0.0 116.493 -143.838 . . . . . . . . 4 3 . 1 . 014 nuclear build full ' B' B ' 59' ' ' ALA . . . . . 0.829 ' HB2' ' HA ' ' B' ' 57' ' ' ARG 1.993 . . 168.11 71.4 0.0 OUTLIER 'General case' 0 N--CA 1.501 2.115 0 O-C-N 118.771 -2.456 . . . . 0.0 111.121 123.815 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . 2.54 0.0 OUTLIER 93.38 -13.07 0.15 Allowed 'General case' 0 CA--C 1.593 2.606 0 N-CA-C 115.953 1.834 . . . . 0.0 115.953 -143.593 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 61' ' ' GLU . . . . . 0.45 ' O ' ' N ' ' B' ' 63' ' ' SER 0.389 48.9 mm-40 62.78 125.65 0.01 OUTLIER 'General case' 0 N--CA 1.5 2.032 0 O-C-N 117.356 -3.34 . . . . 0.0 110.461 -102.674 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 62' ' ' GLN . . . . . 0.531 ' O ' HG13 ' B' ' 66' ' ' VAL 0.496 0.0 OUTLIER -50.8 28.59 0.0 OUTLIER 'General case' 0 N--CA 1.504 2.261 2 CA-C-N 127.403 4.638 . . . . 0.0 123.421 -166.622 . . . . . . . . 5 4 . 1 . 014 nuclear build full ' B' B ' 63' ' ' SER . . . . . 0.778 ' H ' ' H ' ' B' ' 65' ' ' LEU 0.485 3.6 t 161.86 -33.37 0.0 OUTLIER 'General case' 0 N--CA 1.508 2.443 1 N-CA-C 121.828 4.01 . . . . 0.0 121.828 -86.692 . . . . . . . . 4 3 . 1 . 014 nuclear build full ' B' B ' 64' ' ' GLU . . . . . . . . . . . . . 15.4 tt0 -83.64 8.86 13.04 Favored 'General case' 0 CA--C 1.581 2.156 0 O-C-N 117.575 -3.203 . . . . 0.0 116.556 119.02 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 65' ' ' LEU . . . . . 0.778 ' H ' ' H ' ' B' ' 63' ' ' SER . 84.3 mt -92.2 -87.03 0.22 Allowed 'General case' 0 N--CA 1.5 2.053 0 O-C-N 119.459 -2.026 . . . . 0.0 114.427 146.695 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 66' ' ' VAL . . . . . 0.531 HG13 ' O ' ' B' ' 62' ' ' GLN 0.448 33.4 m . . . . . 0 N--CA 1.516 2.841 0 N-CA-C 119.965 3.32 . . . . 0.0 119.965 -172.507 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.558 1.288 0 N-CA-C 113.435 0.902 . . . . 0.0 113.435 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 56.8 mtt180 -79.33 87.39 5.0 Favored 'General case' 0 CA--C 1.571 1.785 0 O-C-N 121.153 -0.967 . . . . 0.0 112.118 175.347 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -159.41 -45.83 0.05 Allowed 'General case' 0 N--CA 1.493 1.706 0 O-C-N 120.821 -1.175 . . . . 0.0 113.705 170.532 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 52.8 p-10 -145.5 84.75 8.26 Favored Pre-proline 0 CA--C 1.57 1.714 0 O-C-N 120.878 -1.139 . . . . 0.0 110.685 158.677 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 5.9 Cg_exo -101.12 144.98 0.29 Allowed 'Trans proline' 0 CA--C 1.559 1.733 0 CA-C-N 122.293 1.855 . . . . 0.0 114.619 -156.717 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 75.2 m80 -85.78 129.73 34.75 Favored 'General case' 0 CA--C 1.577 1.985 0 CA-C-N 115.011 -0.995 . . . . 0.0 112.144 179.754 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' PHE . . . . . 0.791 ' CZ ' HD12 ' B' ' 34' ' ' LEU . 8.3 p90 -129.42 152.95 48.41 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 119.329 -2.107 . . . . 0.0 111.115 147.871 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 14.2 m120 -71.17 87.05 0.78 Allowed 'General case' 0 N--CA 1.491 1.602 0 O-C-N 120.059 -1.651 . . . . 0.0 112.614 172.49 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' PHE . . . . . 0.625 ' CD2' HD13 ' B' ' 34' ' ' LEU . 2.8 t80 -74.19 138.0 43.48 Favored 'General case' 0 CA--C 1.556 1.18 0 CA-C-O 125.573 2.606 . . . . 0.0 110.271 163.075 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -163.29 120.37 1.85 Allowed 'General case' 0 N--CA 1.487 1.422 0 CA-C-N 112.003 -2.362 . . . . 0.0 107.955 -153.002 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 2.5 mpt? -131.27 119.32 17.57 Favored Pre-proline 0 N--CA 1.485 1.278 0 CA-C-O 116.845 -1.55 . . . . 0.0 113.199 -142.162 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 75.5 Cg_exo -42.73 142.78 1.91 Allowed 'Trans proline' 0 C--N 1.372 1.807 0 C-N-CA 123.082 2.521 . . . . 0.0 115.529 165.003 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -57.19 -36.41 70.78 Favored 'General case' 0 N--CA 1.493 1.691 0 N-CA-C 117.227 2.306 . . . . 0.0 117.227 -152.405 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -62.28 -43.58 98.5 Favored 'General case' 0 CA--C 1.565 1.521 0 N-CA-C 116.969 2.211 . . . . 0.0 116.969 165.03 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.407 ' CG1' HG12 ' B' ' 38' ' ' VAL . 0.4 OUTLIER -58.76 -50.64 78.58 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.355 0 CA-C-N 124.087 3.131 . . . . 0.0 113.158 174.584 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -67.37 -41.99 84.14 Favored 'General case' 0 C--O 1.214 -0.767 0 CA-C-O 116.041 -1.933 . . . . 0.0 115.789 171.284 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 51.0 mt-10 -59.04 -36.06 74.36 Favored 'General case' 0 CA--C 1.573 1.831 0 CA-C-N 123.935 3.061 . . . . 0.0 114.132 165.889 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . 0.276 42.3 mtmt -69.86 -54.71 12.25 Favored 'General case' 0 CA--C 1.564 1.492 0 CA-C-N 121.705 2.048 . . . . 0.0 115.138 171.909 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.636 HD13 HD22 ' A' ' 34' ' ' LEU . 10.8 mt -57.99 -45.63 86.51 Favored 'General case' 0 CA--C 1.57 1.723 0 N-CA-C 117.248 2.314 . . . . 0.0 117.248 167.565 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.43 ' HA ' ' HB3' ' A' ' 23' ' ' ALA . 17.1 ttpt -85.91 -24.46 26.61 Favored 'General case' 0 CA--C 1.569 1.681 0 C-N-CA 124.941 1.296 . . . . 0.0 113.486 -176.281 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 21' ' ' PHE . . . . . 0.471 ' O ' ' HB3' ' A' ' 25' ' ' ALA . 16.9 m-30 -67.44 -64.35 0.87 Allowed 'General case' 0 N--CA 1.492 1.662 0 CA-C-O 114.54 -2.647 . . . . 0.0 110.739 159.138 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.411 ' O ' ' HB3' ' A' ' 26' ' ' ASN 0.305 12.1 tpp180 -25.22 -45.41 0.02 OUTLIER 'General case' 0 CA--C 1.614 3.406 0 CA-C-N 125.294 3.679 . . . . 0.0 116.089 159.086 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.496 ' HB2' ' CB ' ' A' ' 33' ' ' GLU 0.281 . . -64.45 -69.03 0.31 Allowed 'General case' 0 CA--C 1.59 2.492 0 O-C-N 117.618 -3.177 . . . . 0.0 116.265 163.442 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 39.8 mt-10 -75.49 -42.92 51.66 Favored 'General case' 0 N--CA 1.501 2.075 0 N-CA-C 118.458 2.762 . . . . 0.0 118.458 -179.427 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.471 ' HB3' ' O ' ' A' ' 21' ' ' PHE . . . -42.21 -48.99 4.97 Favored 'General case' 0 CA--C 1.579 2.064 0 N-CA-C 116.638 2.088 . . . . 0.0 116.638 157.869 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 26' ' ' ASN . . . . . 0.411 ' HB3' ' O ' ' A' ' 22' ' ' ARG 0.314 0.6 OUTLIER -121.97 -41.99 2.42 Favored 'General case' 0 CA--C 1.573 1.834 0 N-CA-C 114.676 1.361 . . . . 0.0 114.676 -150.659 . . . . . . . . 4 4 . 1 . 015 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 149.02 47.57 0.02 OUTLIER Glycine 0 N--CA 1.499 2.849 0 N-CA-C 118.128 2.011 . . . . 0.0 118.128 167.421 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' ARG . . . . . 0.417 ' HE ' ' HG3' ' B' ' 62' ' ' GLN . 0.1 OUTLIER -150.27 172.39 15.43 Favored 'General case' 0 CA--C 1.573 1.837 0 CA-C-O 122.622 1.201 . . . . 0.0 108.608 -179.789 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 29' ' ' SER . . . . . 0.408 ' H ' ' HB3' ' A' ' 32' ' ' SER . 37.5 t -125.61 116.88 22.42 Favored 'General case' 0 N--CA 1.499 2.018 0 O-C-N 119.413 -2.054 . . . . 0.0 105.91 173.174 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 30' ' ' MET . . . . . 0.484 ' CE ' ' HB3' ' A' ' 19' ' ' LEU . 15.2 mtp -46.3 -30.7 2.16 Favored 'General case' 0 N--CA 1.501 2.109 0 N-CA-C 121.705 3.965 . . . . 0.0 121.705 -146.1 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . 0.251 4.0 t-20 -51.3 -49.68 60.83 Favored 'General case' 0 CA--C 1.584 2.281 0 O-C-N 118.512 -2.618 . . . . 0.0 114.164 160.538 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 32' ' ' SER . . . . . 0.408 ' HB3' ' H ' ' A' ' 29' ' ' SER 0.328 29.6 t -45.63 -71.42 0.08 Allowed 'General case' 0 N--CA 1.499 1.985 0 N-CA-C 117.335 2.346 . . . . 0.0 117.335 145.405 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 33' ' ' GLU . . . . . 0.496 ' CB ' ' HB2' ' A' ' 23' ' ' ALA . 0.0 OUTLIER -66.3 -60.24 2.96 Favored 'General case' 0 N--CA 1.503 2.217 0 CA-C-N 122.977 2.626 . . . . 0.0 114.547 -168.541 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.636 HD22 HD13 ' A' ' 19' ' ' LEU 0.573 0.1 OUTLIER -50.46 -34.25 24.17 Favored 'General case' 0 CA--C 1.575 1.907 0 CA-C-O 113.67 -3.062 . . . . 0.0 106.33 175.059 . . . . . . . . 4 4 . 1 . 015 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 17.7 mt -66.4 -49.93 65.16 Favored 'General case' 0 C--N 1.378 1.812 1 CA-C-N 127.288 4.585 . . . . 0.0 116.8 164.227 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -58.43 -41.36 84.85 Favored 'General case' 0 N--CA 1.492 1.627 0 N-CA-C 114.983 1.475 . . . . 0.0 114.983 178.393 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 37' ' ' ILE . . . . . 0.544 HG12 HD22 ' B' ' 58' ' ' LEU . 2.6 tt -71.8 -31.07 40.03 Favored 'Isoleucine or valine' 0 CA--C 1.567 1.622 0 CA-C-O 114.066 -2.873 . . . . 0.0 116.972 161.398 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.458 ' HA ' ' HB3' ' A' ' 41' ' ' ALA . 3.3 t -77.9 -45.72 27.48 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.291 0 CA-C-N 124.717 3.417 . . . . 0.0 112.156 -179.979 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 23.8 mt-30 -52.74 -43.25 65.6 Favored 'General case' 0 CA--C 1.565 1.54 0 C-N-CA 124.362 1.065 . . . . 0.0 113.14 155.272 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' ASP . . . . . 0.445 ' HB2' ' HA ' ' A' ' 37' ' ' ILE 0.494 2.8 m-20 -57.65 -32.65 67.5 Favored 'General case' 0 N--CA 1.5 2.055 0 N-CA-C 118.938 2.94 . . . . 0.0 118.938 155.089 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 41' ' ' ALA . . . . . 0.458 ' HB3' ' HA ' ' A' ' 38' ' ' VAL . . . -76.87 -52.7 8.99 Favored 'General case' 0 CA--C 1.551 1.001 0 O-C-N 119.635 -1.916 . . . . 0.0 112.803 -167.372 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . 0.26 3.2 pp -87.53 -8.08 56.8 Favored 'General case' 0 N--CA 1.496 1.853 0 N-CA-C 118.772 2.879 . . . . 0.0 118.772 163.48 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 34.3 t -146.15 43.88 1.23 Allowed 'General case' 0 CA--C 1.576 1.976 0 CA-C-N 121.972 2.169 . . . . 0.0 116.224 177.332 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . 0.292 8.1 ptmt -50.74 -47.96 84.31 Favored Pre-proline 0 N--CA 1.507 2.398 1 N-CA-C 124.369 4.951 . . . . 0.0 124.369 172.024 . . . . . . . . 3 2 . 1 . 015 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 14.0 Cg_exo -80.16 120.69 4.19 Favored 'Trans proline' 0 CA--C 1.562 1.917 0 CA-C-N 125.88 3.136 . . . . 0.0 118.014 -148.76 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 22.2 t -75.33 143.86 77.19 Favored Pre-proline 0 CA--C 1.585 2.308 0 CA-C-O 117.886 -1.055 . . . . 0.0 111.096 134.204 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 79.9 Cg_endo -72.54 82.62 1.4 Allowed 'Trans proline' 0 CA--C 1.57 2.32 0 C-N-CA 122.664 2.242 . . . . 0.0 115.152 -175.984 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 9.9 p -141.23 -18.49 0.31 Allowed 'Isoleucine or valine' 0 N--CA 1.51 2.575 0 N-CA-C 116.385 1.994 . . . . 0.0 116.385 -171.113 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . 0.286 1.3 t -107.92 99.87 9.28 Favored 'General case' 0 CA--C 1.571 1.759 0 O-C-N 119.664 -1.897 . . . . 0.0 113.645 -127.487 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -152.48 95.71 0.16 Allowed Glycine 0 N--CA 1.491 2.308 0 CA-C-O 117.668 -1.629 . . . . 0.0 113.348 178.372 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 51' ' ' TYR . . . . . 0.443 ' CD2' ' HB3' ' B' ' 56' ' ' GLU 0.322 0.0 OUTLIER -0.66 122.87 0.0 OUTLIER 'General case' 0 CA--C 1.586 2.339 3 CA-C-N 129.859 6.829 . . . . 0.0 123.776 -1.688 . . . . . . . . 5 4 . 1 . 015 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . 0.275 25.8 tpt180 -129.52 107.8 9.75 Favored 'General case' 0 N--CA 1.512 2.669 0 CA-C-N 122.159 2.254 . . . . 0.0 115.789 -175.332 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 53' ' ' ASN . . . . . 0.485 ' HB2' ' CA ' ' B' ' 54' ' ' ASP . 0.0 OUTLIER -131.32 172.95 11.56 Favored 'General case' 0 CA--C 1.608 3.203 0 C-N-CA 128.436 2.694 . . . . 0.0 107.063 156.674 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . 0.338 0.0 OUTLIER -82.56 84.91 7.08 Favored 'General case' 0 CA--C 1.553 1.071 2 O-C-N 111.419 -7.05 . . . . 0.0 108.259 -2.087 . . . . . . . . 4 3 . 1 . 015 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -97.96 -89.8 0.29 Allowed 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 113.802 -1.545 . . . . 0.0 110.528 -156.644 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.429 ' HG2' ' HD2' ' A' ' 57' ' ' ARG . 29.0 tt0 -14.55 -55.25 0.0 OUTLIER 'General case' 0 CA--C 1.574 1.879 1 N-CA-C 122.013 4.079 . . . . 0.0 122.013 121.186 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.5 ' C ' ' H ' ' A' ' 60' ' ' ASP 1.317 0.6 OUTLIER -41.45 -58.01 2.02 Favored 'General case' 0 CA--C 1.551 0.987 1 N-CA-C 124.82 5.118 . . . . 0.0 124.82 166.283 . . . . . . . . 5 4 . 1 . 015 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.631 ' HA ' ' H ' ' A' ' 61' ' ' GLU 0.561 96.0 mt -110.98 -2.08 16.1 Favored 'General case' 0 CA--C 1.588 2.408 0 O-C-N 120.524 -1.36 . . . . 0.0 113.195 177.155 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -54.23 -6.43 0.1 Allowed 'General case' 0 N--CA 1.488 1.439 0 O-C-N 116.36 -3.962 . . . . 0.0 120.08 117.48 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 60' ' ' ASP . . . . . 0.539 ' CA ' ' H ' ' A' ' 63' ' ' SER 1.364 11.0 t70 -98.15 -12.98 21.17 Favored 'General case' 0 CA--C 1.586 2.363 0 CA-C-O 127.303 3.43 . . . . 0.0 116.943 163.358 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.631 ' H ' ' HA ' ' A' ' 58' ' ' LEU . 3.7 tt0 -56.86 -24.49 51.91 Favored 'General case' 0 CA--C 1.59 2.489 0 CA-C-N 112.151 -2.295 . . . . 0.0 114.846 133.717 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 62' ' ' GLN . . . . . 0.552 ' O ' HG13 ' A' ' 66' ' ' VAL 0.529 0.0 OUTLIER -71.99 -19.51 61.86 Favored 'General case' 0 CA--C 1.58 2.105 0 CA-C-O 113.458 -3.163 . . . . 0.0 118.198 145.312 . . . . . . . . 4 4 . 1 . 015 nuclear build full ' A' A ' 63' ' ' SER . . . . . 0.539 ' H ' ' CA ' ' A' ' 60' ' ' ASP 0.399 0.5 OUTLIER -42.47 -69.59 0.13 Allowed 'General case' 0 N--CA 1.537 3.893 1 CA-C-N 127.314 4.597 . . . . 0.0 113.208 157.025 . . . . . . . . 5 4 . 1 . 015 nuclear build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . 0.387 9.4 tp10 -24.74 -21.11 0.0 OUTLIER 'General case' 0 CA--C 1.583 2.216 1 N-CA-C 123.878 4.77 . . . . 0.0 123.878 143.5 . . . . . . . . 3 2 . 1 . 015 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.418 ' HG ' ' HA ' ' A' ' 62' ' ' GLN . 0.9 OUTLIER -129.36 32.66 4.64 Favored 'General case' 0 CA--C 1.603 2.998 0 N-CA-C 118.301 2.704 . . . . 0.0 118.301 148.375 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.552 HG13 ' O ' ' A' ' 62' ' ' GLN . 33.4 m . . . . . 0 N--CA 1.516 2.842 0 O-C-N 118.356 -2.715 . . . . 0.0 113.098 178.032 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.563 1.456 0 N-CA-C 113.476 0.917 . . . . 0.0 113.476 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 2' ' ' ARG . . . . . . . . . . . . . 34.3 mmt180 -76.01 81.99 2.88 Favored 'General case' 0 N--CA 1.495 1.806 0 CA-C-O 123.166 1.46 . . . . 0.0 113.772 -178.325 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -92.67 0.34 57.41 Favored 'General case' 0 CA--C 1.563 1.448 0 N-CA-C 116.39 1.996 . . . . 0.0 116.39 -178.701 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 4' ' ' ASP . . . . . . . . . . . . 0.32 14.6 p-10 -131.0 72.69 81.71 Favored Pre-proline 0 N--CA 1.492 1.669 0 CA-C-N 121.572 1.987 . . . . 0.0 115.833 178.527 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -60.97 158.81 32.19 Favored 'Trans proline' 0 CA--C 1.569 2.23 0 C-N-CA 123.071 2.514 . . . . 0.0 117.207 163.595 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 6' ' ' HIS . . . . . . . . . . . . . 70.5 m80 -106.6 143.52 34.59 Favored 'General case' 0 CA--C 1.56 1.341 0 CA-C-N 113.555 -1.657 . . . . 0.0 112.402 -167.004 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 7' ' ' PHE . . . . . 0.497 ' CZ ' HD23 ' A' ' 34' ' ' LEU . 8.9 p90 -140.63 155.71 46.46 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 120.411 -1.43 . . . . 0.0 111.1 149.166 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 8' ' ' ASN . . . . . . . . . . . . . 14.7 m120 -71.04 90.04 0.83 Allowed 'General case' 0 N--CA 1.489 1.494 0 O-C-N 120.218 -1.551 . . . . 0.0 111.659 168.537 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 9' ' ' PHE . . . . . . . . . . . . . 6.8 t80 -73.31 149.24 42.81 Favored 'General case' 0 CA--C 1.561 1.397 0 CA-C-O 125.121 2.391 . . . . 0.0 110.428 156.822 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 10' ' ' ARG . . . . . . . . . . . . . 34.0 tpt85 -179.78 93.3 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.651 0 O-C-N 119.718 -1.863 . . . . 0.0 107.869 -123.991 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 11' ' ' MET . . . . . 0.444 ' SD ' ' HG3' ' B' ' 16' ' ' ARG . 1.2 mpt? -130.09 129.88 23.01 Favored Pre-proline 0 CA--C 1.567 1.625 0 CA-C-O 117.302 -1.332 . . . . 0.0 112.805 -153.68 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 12' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_exo -44.89 146.14 2.57 Favored 'Trans proline' 0 CA--C 1.564 2.012 0 C-N-CA 123.082 2.521 . . . . 0.0 116.976 166.867 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 13' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -48.87 -37.53 19.87 Favored 'General case' 0 N--CA 1.496 1.827 0 N-CA-C 118.348 2.721 . . . . 0.0 118.348 -165.554 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 14' ' ' GLU . . . . . . . . . . . . 0.262 8.6 pt-20 -64.29 -48.08 77.05 Favored 'General case' 0 CA--C 1.566 1.572 0 N-CA-C 115.64 1.719 . . . . 0.0 115.64 170.028 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -59.6 -46.97 92.65 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.067 0 CA-C-N 123.408 2.822 . . . . 0.0 112.385 172.052 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 16' ' ' ARG . . . . . 0.444 ' HG3' ' SD ' ' B' ' 11' ' ' MET . 0.0 OUTLIER -74.25 -33.86 63.45 Favored 'General case' 0 N--CA 1.475 0.781 0 N-CA-C 116.455 2.02 . . . . 0.0 116.455 177.184 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 17' ' ' GLU . . . . . . . . . . . . . 74.5 mm-40 -65.32 -41.89 93.54 Favored 'General case' 0 N--CA 1.491 1.623 0 CA-C-N 123.611 2.914 . . . . 0.0 113.896 159.742 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . 0.289 50.9 mtmt -62.56 -45.79 91.3 Favored 'General case' 0 CA--C 1.566 1.561 0 CA-C-N 121.912 2.142 . . . . 0.0 115.361 172.241 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 19' ' ' LEU . . . . . 0.511 HD21 ' CD2' ' B' ' 34' ' ' LEU . 13.9 tp -72.65 -34.94 67.61 Favored 'General case' 0 CA--C 1.569 1.696 0 CA-C-N 120.739 1.608 . . . . 0.0 114.399 176.585 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 20' ' ' LYS . . . . . 0.447 ' HB2' ' SD ' ' B' ' 30' ' ' MET . 8.5 ttpt -88.21 -30.3 19.83 Favored 'General case' 0 CA--C 1.564 1.488 0 C-N-CA 125.635 1.574 . . . . 0.0 114.388 178.468 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 15.1 m-85 -56.82 -73.59 0.06 Allowed 'General case' 0 N--CA 1.491 1.599 0 CA-C-O 113.581 -3.104 . . . . 0.0 110.46 148.915 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . 0.406 4.9 tmm_? -31.34 -41.68 0.04 OUTLIER 'General case' 0 CA--C 1.594 2.655 0 CA-C-N 125.829 3.922 . . . . 0.0 116.869 173.66 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -57.46 -74.48 0.06 Allowed 'General case' 0 CA--C 1.585 2.316 0 N-CA-C 118.856 2.91 . . . . 0.0 118.856 154.357 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -59.92 -45.82 91.37 Favored 'General case' 0 N--CA 1.504 2.274 0 N-CA-C 118.826 2.899 . . . . 0.0 118.826 175.363 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 25' ' ' ALA . . . . . . . . . . . . . . . -38.98 -51.92 1.79 Allowed 'General case' 0 CA--C 1.587 2.378 0 N-CA-C 116.824 2.157 . . . . 0.0 116.824 159.42 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 26' ' ' ASN . . . . . . . . . . . . . 34.8 m-20 -87.53 -51.75 5.74 Favored 'General case' 0 CA--C 1.575 1.936 0 N-CA-C 115.236 1.569 . . . . 0.0 115.236 179.67 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 27' ' ' GLY . . . . . . . . . . . . . . . 128.61 19.76 1.62 Allowed Glycine 0 CA--C 1.56 2.875 0 N-CA-C 119.275 2.47 . . . . 0.0 119.275 -161.054 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 28' ' ' ARG . . . . . . . . . . . . . 80.0 mtt-85 -116.22 166.49 11.97 Favored 'General case' 0 N--CA 1.495 1.778 0 CA-C-N 121.049 2.425 . . . . 0.0 106.957 167.535 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 29' ' ' SER . . . . . . . . . . . . . 91.1 p -121.14 112.55 18.82 Favored 'General case' 0 N--CA 1.5 2.049 0 O-C-N 118.742 -2.474 . . . . 0.0 105.491 -173.115 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 30' ' ' MET . . . . . 0.447 ' SD ' ' HB2' ' B' ' 20' ' ' LYS . 38.3 mtp -41.88 -46.14 3.91 Favored 'General case' 0 N--CA 1.499 2.002 0 N-CA-C 119.438 3.125 . . . . 0.0 119.438 -141.436 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 31' ' ' ASN . . . . . . . . . . . . . 25.2 t-20 -43.43 -44.52 5.83 Favored 'General case' 0 CA--C 1.598 2.796 0 CA-C-N 125.245 3.657 . . . . 0.0 115.712 164.179 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 32' ' ' SER . . . . . . . . . . . . 0.282 62.9 m -58.01 -58.23 9.33 Favored 'General case' 0 N--CA 1.498 1.96 0 N-CA-C 120.914 3.672 . . . . 0.0 120.914 149.688 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -64.9 -61.99 1.83 Allowed 'General case' 0 N--CA 1.515 2.795 0 CA-C-N 123.76 2.982 . . . . 0.0 114.835 177.637 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 34' ' ' LEU . . . . . 0.791 HD12 ' CZ ' ' A' ' 7' ' ' PHE . 0.0 OUTLIER -38.8 -53.96 1.64 Allowed 'General case' 0 CA--C 1.549 0.915 0 CA-C-O 115.004 -2.426 . . . . 0.0 107.934 170.726 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 35' ' ' LEU . . . . . 0.506 ' HG ' ' CE1' ' A' ' 9' ' ' PHE . 11.1 mt -65.09 -60.31 3.16 Favored 'General case' 0 N--CA 1.485 1.293 0 CA-C-N 124.448 3.295 . . . . 0.0 115.665 -178.156 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 36' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -53.0 -41.46 64.66 Favored 'General case' 0 CA--C 1.558 1.253 0 CA-C-O 117.213 -1.375 . . . . 0.0 113.932 175.073 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 37' ' ' ILE . . . . . 0.441 ' HA ' ' HB3' ' B' ' 40' ' ' ASP . 1.6 tp -75.08 -24.91 18.0 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.405 0 N-CA-C 116.37 1.989 . . . . 0.0 116.37 173.165 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 38' ' ' VAL . . . . . 0.521 HG11 HD11 ' A' ' 19' ' ' LEU . 2.2 t -81.15 -49.76 17.65 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.809 0 C-N-CA 127.487 2.315 . . . . 0.0 111.03 175.643 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 9.7 tt0 -44.27 -47.88 9.45 Favored 'General case' 0 CA--C 1.559 1.3 0 C-N-CA 124.771 1.229 . . . . 0.0 113.649 153.814 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 40' ' ' ASP . . . . . 0.441 ' HB3' ' HA ' ' B' ' 37' ' ' ILE 0.582 0.7 OUTLIER -53.09 -59.01 5.09 Favored 'General case' 0 CA--C 1.553 1.081 0 N-CA-C 116.092 1.886 . . . . 0.0 116.092 157.317 . . . . . . . . 4 4 . 1 . 015 nuclear build full ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -67.4 -37.34 82.96 Favored 'General case' 0 CA--C 1.555 1.147 0 N-CA-C 116.591 2.071 . . . . 0.0 116.591 -159.465 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . 0.331 1.2 pp -89.05 -25.28 22.03 Favored 'General case' 0 N--CA 1.49 1.553 0 N-CA-C 119.321 3.082 . . . . 0.0 119.321 157.418 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 43' ' ' SER . . . . . . . . . . . . . 49.4 m -150.54 53.01 0.88 Allowed 'General case' 0 N--CA 1.496 1.828 0 CA-C-N 123.116 2.689 . . . . 0.0 116.831 -176.09 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 44' ' ' LYS . . . . . . . . . . . . 0.275 67.3 mttm -131.58 104.66 14.48 Favored Pre-proline 0 N--CA 1.518 2.939 0 N-CA-C 117.521 2.415 . . . . 0.0 117.521 158.229 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 8.3 Cg_exo -66.64 163.35 33.25 Favored 'Trans proline' 0 CA--C 1.572 2.397 0 C-N-CA 122.453 2.102 . . . . 0.0 115.032 143.427 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 46' ' ' SER . . . . . . . . . . . . . 57.9 m -147.55 -77.16 0.01 OUTLIER Pre-proline 0 N--CA 1.497 1.882 0 CA-C-O 115.519 -2.182 . . . . 0.0 110.837 163.271 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 78.6 Cg_endo -74.98 77.51 3.1 Favored 'Trans proline' 0 CA--C 1.567 2.154 0 CA-C-N 125.978 3.171 . . . . 0.0 111.608 164.597 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 48' ' ' VAL . . . . . . . . . . . . 0.295 12.0 p -81.93 68.38 0.52 Allowed 'Isoleucine or valine' 0 N--CA 1.5 2.05 0 CA-C-O 123.924 1.821 . . . . 0.0 114.54 -166.163 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 49' ' ' THR . . . . . . . . . . . . . 44.0 p -121.33 71.52 0.96 Allowed 'General case' 0 N--CA 1.496 1.847 0 CA-C-N 114.051 -1.431 . . . . 0.0 109.68 -163.517 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 50' ' ' GLY . . . . . . . . . . . . . . . 78.36 45.87 9.51 Favored Glycine 0 N--CA 1.497 2.741 0 N-CA-C 116.65 1.42 . . . . 0.0 116.65 -164.81 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 51' ' ' TYR . . . . . . . . . . . . 0.375 0.0 OUTLIER -88.29 -28.99 20.71 Favored 'General case' 0 CA--C 1.593 2.613 0 N-CA-C 116.597 2.073 . . . . 0.0 116.597 -161.225 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 52' ' ' ARG . . . . . . . . . . . . 0.722 39.1 ttt180 127.01 -115.9 0.0 OUTLIER 'General case' 0 N--CA 1.523 3.225 0 N-CA-C 119.331 3.086 . . . . 0.0 119.331 149.919 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 6.7 p-10 178.37 155.07 0.38 Allowed 'General case' 0 N--CA 1.501 2.079 2 O-C-N 110.968 -7.333 . . . . 0.0 120.564 16.8 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 54' ' ' ASP . . . . . 0.485 ' CA ' ' HB2' ' A' ' 53' ' ' ASN 1.848 0.0 OUTLIER -48.7 19.88 0.0 OUTLIER 'General case' 0 N--CA 1.498 1.974 1 N-CA-C 123.111 4.486 . . . . 0.0 123.111 165.879 . . . . . . . . 5 4 . 1 . 015 nuclear build full ' B' B ' 55' ' ' ALA . . . . . . . . . . . . 0.309 . . -82.77 -7.84 59.63 Favored 'General case' 0 CA--C 1.574 1.872 0 O-C-N 118.705 -2.497 . . . . 0.0 115.222 142.441 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 56' ' ' GLU . . . . . 0.539 ' C ' ' HB3' ' B' ' 59' ' ' ALA . 3.9 mm-40 -45.88 -3.11 0.01 OUTLIER 'General case' 0 CA--C 1.592 2.588 1 N-CA-C 123.075 4.472 . . . . 0.0 123.075 120.563 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 57' ' ' ARG . . . . . 0.424 ' HB2' ' CB ' ' B' ' 54' ' ' ASP 0.266 16.9 ttt-85 -112.29 -50.43 2.9 Favored 'General case' 0 N--CA 1.501 2.088 0 O-C-N 119.105 -2.247 . . . . 0.0 111.455 -177.866 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 58' ' ' LEU . . . . . 0.544 HD22 HG12 ' A' ' 37' ' ' ILE 0.252 1.7 mt -49.89 -35.53 23.91 Favored 'General case' 0 CA--C 1.586 2.362 0 CA-C-N 114.936 -1.029 . . . . 0.0 112.513 155.701 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 59' ' ' ALA . . . . . 0.539 ' HB3' ' C ' ' B' ' 56' ' ' GLU . . . -44.78 -78.27 0.02 OUTLIER 'General case' 0 N--CA 1.488 1.441 0 N-CA-C 117.779 2.511 . . . . 0.0 117.779 143.938 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -87.68 4.13 45.2 Favored 'General case' 0 N--CA 1.489 1.496 0 N-CA-C 117.705 2.483 . . . . 0.0 117.705 -163.586 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 19.1 tt0 -91.9 -28.93 16.96 Favored 'General case' 0 CA--C 1.559 1.293 0 CA-C-O 116.165 -1.874 . . . . 0.0 112.609 150.831 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 62' ' ' GLN . . . . . 0.77 ' O ' HG13 ' B' ' 66' ' ' VAL 0.29 0.0 OUTLIER -78.69 -59.49 2.76 Favored 'General case' 0 C--N 1.37 1.469 0 CA-C-N 124.982 3.537 . . . . 0.0 109.086 176.551 . . . . . . . . 4 4 . 1 . 015 nuclear build full ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 48.3 t -107.58 71.79 0.83 Allowed 'General case' 0 CA--C 1.552 1.046 0 CA-C-O 122.838 1.304 . . . . 0.0 111.81 160.12 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 64' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -82.01 -58.39 2.99 Favored 'General case' 0 CA--C 1.563 1.459 0 O-C-N 118.524 -2.61 . . . . 0.0 116.925 77.254 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 18.2 mt -75.86 -4.96 43.69 Favored 'General case' 0 N--CA 1.506 2.328 0 N-CA-C 118.351 2.723 . . . . 0.0 118.351 -151.781 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 66' ' ' VAL . . . . . 0.77 HG13 ' O ' ' B' ' 62' ' ' GLN 0.271 32.5 m . . . . . 0 N--CA 1.508 2.444 0 N-CA-C 117.611 2.449 . . . . 0.0 117.611 167.293 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 2.5 p30 . . . . . 0 CA--C 1.567 1.606 0 CA-C-O 118.756 -0.64 . . . . 0.0 112.074 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 5.7 Cg_exo -87.89 148.55 7.04 Favored 'Trans proline' 0 CA--C 1.549 1.247 0 C-N-CA 122.486 2.124 . . . . 0.0 114.676 -170.704 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 37.8 m80 -73.57 141.3 46.66 Favored 'General case' 0 CA--C 1.561 1.394 0 CA-C-N 113.384 -1.734 . . . . 0.0 113.355 173.555 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . 0.758 ' CZ ' HD12 ' B' ' 34' ' ' LEU . 24.3 p90 -125.93 163.81 22.15 Favored 'General case' 0 CA--C 1.559 1.317 0 O-C-N 120.035 -1.666 . . . . 0.0 111.2 115.807 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 1.1 p-10 -73.98 91.08 2.0 Favored 'General case' 0 CA--C 1.567 1.604 0 O-C-N 120.106 -1.621 . . . . 0.0 110.398 159.525 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . 0.631 ' CD2' HD13 ' B' ' 34' ' ' LEU . 4.1 t80 -66.99 168.07 10.62 Favored 'General case' 0 CA--C 1.559 1.325 0 CA-C-O 124.049 1.88 . . . . 0.0 110.489 154.274 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 9.6 tpt180 163.28 109.03 0.0 OUTLIER 'General case' 0 N--CA 1.488 1.443 0 O-C-N 119.724 -1.86 . . . . 0.0 106.211 -120.173 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' MET . . . . . 0.641 ' SD ' HD23 ' A' ' 19' ' ' LEU . 13.6 mtm -144.73 123.21 6.75 Favored Pre-proline 0 CA--C 1.562 1.438 0 CA-C-N 114.08 -1.418 . . . . 0.0 108.881 -157.228 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_exo -43.66 147.92 0.99 Allowed 'Trans proline' 0 CA--C 1.562 1.9 0 C-N-CA 122.613 2.209 . . . . 0.0 115.952 159.657 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 1.3 tpt -48.99 -40.79 32.02 Favored 'General case' 0 N--CA 1.494 1.749 0 N-CA-C 117.195 2.294 . . . . 0.0 117.195 -166.942 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 1.1 pm0 -56.77 -49.42 75.34 Favored 'General case' 0 CA--C 1.562 1.406 0 N-CA-C 117.774 2.509 . . . . 0.0 117.774 167.092 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -62.33 -45.54 98.53 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.27 0 CA-C-N 122.721 2.51 . . . . 0.0 113.116 173.891 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -78.15 -23.91 47.55 Favored 'General case' 0 CA--C 1.552 1.055 0 N-CA-C 116.51 2.041 . . . . 0.0 116.51 176.532 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 51.0 mt-10 -68.67 -38.52 80.44 Favored 'General case' 0 CA--C 1.559 1.296 0 CA-C-N 121.579 1.99 . . . . 0.0 114.33 154.089 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . 0.608 11.5 pttt -81.39 -35.09 31.19 Favored 'General case' 0 N--CA 1.497 1.907 0 CA-C-N 124.487 3.312 . . . . 0.0 117.142 177.68 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.641 HD23 ' SD ' ' A' ' 11' ' ' MET 0.293 12.6 tp -63.92 -39.13 93.46 Favored 'General case' 0 CA--C 1.567 1.606 0 O-C-N 120.193 -1.567 . . . . 0.0 114.83 159.735 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.576 ' HB2' ' SD ' ' A' ' 30' ' ' MET . 20.0 ttpt -89.08 -20.78 23.91 Favored 'General case' 0 CA--C 1.568 1.656 0 CA-C-O 115.167 -2.349 . . . . 0.0 117.027 175.887 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -102.83 6.5 39.25 Favored 'General case' 0 N--CA 1.529 3.493 0 N-CA-C 119.987 3.329 . . . . 0.0 119.987 164.358 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.509 ' O ' ' N ' ' A' ' 24' ' ' GLU . 2.2 tpp180 -72.71 -140.46 0.01 OUTLIER 'General case' 0 C--N 1.308 -1.205 0 CA-C-O 115.218 -2.325 . . . . 0.0 111.798 106.984 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.585 ' HB2' ' HB3' ' A' ' 33' ' ' GLU 0.66 . . 39.12 -48.32 0.0 OUTLIER 'General case' 0 CA--C 1.593 2.605 1 CA-C-N 127.101 4.5 . . . . 0.0 120.085 -163.865 . . . . . . . . 4 3 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . 0.509 ' N ' ' O ' ' A' ' 22' ' ' ARG . 2.5 tt0 . . . . . 0 N--CA 1.496 1.857 1 O-C-N 115.878 -4.264 . . . . 0.0 119.987 121.481 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.424 ' O ' ' HB2' ' A' ' 33' ' ' GLU 0.398 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.401 0 N-CA-C 105.864 -1.902 . . . . 0.0 105.864 . . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . 0.528 ' H ' ' HB3' ' A' ' 32' ' ' SER . 32.6 t -102.0 112.55 25.23 Favored 'General case' 0 N--CA 1.488 1.458 0 CA-C-O 115.107 -2.378 . . . . 0.0 106.307 -118.733 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' MET . . . . . 0.576 ' SD ' ' HB2' ' A' ' 20' ' ' LYS . 21.1 mtp -37.45 -41.2 0.42 Allowed 'General case' 0 N--CA 1.506 2.366 0 N-CA-C 120.165 3.394 . . . . 0.0 120.165 -145.811 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 14.5 t-20 -42.1 -51.75 4.49 Favored 'General case' 0 CA--C 1.597 2.771 0 O-C-N 116.867 -3.646 . . . . 0.0 116.142 159.224 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . 0.528 ' HB3' ' H ' ' A' ' 29' ' ' SER 0.37 24.4 t -46.12 -65.63 0.52 Allowed 'General case' 0 N--CA 1.5 2.042 0 N-CA-C 119.738 3.236 . . . . 0.0 119.738 144.598 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . 0.585 ' HB3' ' HB2' ' A' ' 23' ' ' ALA . 0.1 OUTLIER -71.14 -54.54 10.71 Favored 'General case' 0 N--CA 1.512 2.664 0 N-CA-C 119.269 3.063 . . . . 0.0 119.269 -176.789 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.762 HD12 ' CZ ' ' B' ' 7' ' ' PHE . 0.1 OUTLIER -37.46 -52.84 1.16 Allowed 'General case' 0 CA--C 1.55 0.96 0 CA-C-O 115.586 -2.149 . . . . 0.0 108.814 162.855 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.494 ' HG ' ' CE1' ' B' ' 9' ' ' PHE . 12.9 mt -61.96 -51.32 68.57 Favored 'General case' 0 C--N 1.369 1.444 0 CA-C-N 123.036 2.653 . . . . 0.0 115.098 177.091 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . 0.326 0.0 OUTLIER -67.04 -36.67 82.58 Favored 'General case' 0 CA--C 1.575 1.922 0 CA-C-O 116.081 -1.914 . . . . 0.0 115.022 -178.979 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 8.7 tt -61.97 -44.67 99.24 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.254 0 CA-C-N 124.133 3.151 . . . . 0.0 115.533 154.049 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.497 HG23 ' O ' ' A' ' 34' ' ' LEU . 2.7 t -65.25 -48.23 84.27 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.117 0 CA-C-N 123.351 2.796 . . . . 0.0 112.782 -172.66 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 30.4 mt-30 -48.71 -47.76 40.9 Favored 'General case' 0 CA--C 1.567 1.631 0 C-N-CA 125.571 1.549 . . . . 0.0 114.226 155.685 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . 0.458 2.1 m-20 -52.83 -34.96 56.46 Favored 'General case' 0 CA--C 1.578 2.035 0 N-CA-C 118.68 2.844 . . . . 0.0 118.68 157.475 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . 0.425 ' HB3' ' HA ' ' A' ' 38' ' ' VAL . . . . . . . . 0 CA--C 1.55 0.965 0 N-CA-C 113.606 0.965 . . . . 0.0 113.606 -161.909 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo . . . . . 0 CA--C 1.555 1.543 0 N-CA-C 116.891 1.843 . . . . 0.0 116.891 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' B' B ' 6' ' ' HIS . . . . . . . . . . . . . 71.9 m80 -77.14 136.67 38.61 Favored 'General case' 0 CA--C 1.577 2.0 0 CA-C-N 113.615 -1.63 . . . . 0.0 111.859 164.222 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 7' ' ' PHE . . . . . 0.762 ' CZ ' HD12 ' A' ' 34' ' ' LEU . 1.2 p90 -136.28 158.1 45.22 Favored 'General case' 0 CA--C 1.57 1.746 0 O-C-N 119.869 -1.769 . . . . 0.0 111.87 150.036 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 8' ' ' ASN . . . . . . . . . . . . . 80.8 m-20 -69.35 103.87 2.11 Favored 'General case' 0 CA--C 1.571 1.773 0 O-C-N 120.374 -1.454 . . . . 0.0 113.033 174.622 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 9' ' ' PHE . . . . . 0.636 ' CG ' HD13 ' A' ' 34' ' ' LEU . 6.8 t80 -120.65 104.81 10.22 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 124.31 1.044 . . . . 0.0 108.318 160.334 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 10' ' ' ARG . . . . . . . . . . . . 0.438 0.1 OUTLIER 91.75 86.9 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.737 1 O-C-N 113.503 -5.748 . . . . 0.0 111.2 -9.779 . . . . . . . . 4 3 . 1 . 001 nuclear nobuild core ' B' B ' 11' ' ' MET . . . . . 0.461 ' HE2' ' CD2' ' B' ' 9' ' ' PHE . 16.4 mtm -155.93 126.7 3.5 Favored Pre-proline 0 CA--C 1.572 1.808 0 CA-C-O 116.894 -1.527 . . . . 0.0 110.241 -154.777 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 12' ' ' PRO . . . . . . . . . . . . . 87.0 Cg_exo -42.55 147.55 0.56 Allowed 'Trans proline' 0 C--N 1.373 1.828 0 C-N-CA 123.788 2.992 . . . . 0.0 117.751 168.941 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 13' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -44.33 -53.17 6.99 Favored 'General case' 0 N--CA 1.493 1.723 0 N-CA-C 118.105 2.632 . . . . 0.0 118.105 -162.851 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -62.1 -39.26 91.89 Favored 'General case' 0 CA--C 1.561 1.375 0 N-CA-C 116.793 2.145 . . . . 0.0 116.793 173.034 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -59.98 -52.25 63.34 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.181 0 CA-C-N 123.509 2.868 . . . . 0.0 111.604 170.423 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -72.14 -30.04 64.64 Favored 'General case' 0 CA--C 1.553 1.07 0 N-CA-C 116.364 1.987 . . . . 0.0 116.364 179.152 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 17' ' ' GLU . . . . . . . . . . . . . 38.3 mt-10 -61.54 -49.25 77.45 Favored 'General case' 0 N--CA 1.492 1.674 0 CA-C-N 122.4 2.364 . . . . 0.0 114.086 155.333 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . 0.255 51.0 mtmt -58.48 -49.54 76.98 Favored 'General case' 0 N--CA 1.489 1.492 0 CA-C-N 122.055 2.207 . . . . 0.0 115.748 174.026 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 19' ' ' LEU . . . . . 0.519 ' HB3' ' CE ' ' B' ' 30' ' ' MET 0.266 0.5 OUTLIER -66.21 -35.82 81.44 Favored 'General case' 0 CA--C 1.571 1.761 0 C-N-CA 125.574 1.55 . . . . 0.0 114.766 174.218 . . . . . . . . 4 4 . 1 . 001 nuclear nobuild core ' B' B ' 20' ' ' LYS . . . . . . . . . . . . . 15.9 ttpt -87.33 -31.2 20.3 Favored 'General case' 0 CA--C 1.564 1.492 0 N-CA-C 114.502 1.297 . . . . 0.0 114.502 178.201 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 13.8 m-85 -59.05 -72.29 0.1 Allowed 'General case' 0 N--CA 1.487 1.409 0 CA-C-O 114.855 -2.498 . . . . 0.0 110.956 155.014 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 22' ' ' ARG . . . . . 0.411 ' O ' ' HB3' ' B' ' 26' ' ' ASN 0.299 13.2 ttt85 -23.83 -50.28 0.02 OUTLIER 'General case' 0 CA--C 1.59 2.496 0 CA-C-N 125.098 3.59 . . . . 0.0 117.043 166.514 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 23' ' ' ALA . . . . . 0.448 ' HB2' ' CB ' ' B' ' 33' ' ' GLU 0.272 . . -53.78 -76.23 0.03 OUTLIER 'General case' 0 CA--C 1.587 2.383 0 N-CA-C 119.332 3.086 . . . . 0.0 119.332 154.849 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 51.1 mm-40 -71.11 -39.29 72.16 Favored 'General case' 0 CA--C 1.578 2.027 0 N-CA-C 119.229 3.048 . . . . 0.0 119.229 -178.351 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 25' ' ' ALA . . . . . . . . . . . . . . . -40.72 -49.87 3.08 Favored 'General case' 0 CA--C 1.578 2.053 0 N-CA-C 117.304 2.335 . . . . 0.0 117.304 154.938 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 26' ' ' ASN . . . . . 0.411 ' HB3' ' O ' ' B' ' 22' ' ' ARG 0.303 0.0 OUTLIER -117.3 -36.71 3.68 Favored 'General case' 0 CA--C 1.578 2.028 0 N-CA-C 115.454 1.65 . . . . 0.0 115.454 -156.386 . . . . . . . . 4 4 . 1 . 001 nuclear nobuild core ' B' B ' 27' ' ' GLY . . . . . . . . . . . . . . . 131.64 31.75 0.5 Allowed Glycine 0 N--CA 1.496 2.674 0 N-CA-C 119.041 2.377 . . . . 0.0 119.041 172.825 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 28' ' ' ARG . . . . . 0.646 ' HE ' ' HB3' ' B' ' 36' ' ' GLN 0.343 3.2 mtm-85 -131.09 164.19 25.99 Favored 'General case' 0 CA--C 1.585 2.299 0 N-CA-C 103.647 -2.723 . . . . 0.0 103.647 168.177 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 29' ' ' SER . . . . . . . . . . . . . 89.9 p -127.41 107.59 10.09 Favored 'General case' 0 N--CA 1.511 2.623 1 O-C-N 116.064 -4.148 . . . . 0.0 108.2 -168.053 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 30' ' ' MET . . . . . 0.519 ' CE ' ' HB3' ' B' ' 19' ' ' LEU . 24.2 mtp -42.88 -42.81 3.81 Favored 'General case' 0 N--CA 1.498 1.972 0 N-CA-C 119.476 3.139 . . . . 0.0 119.476 -133.339 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 31' ' ' ASN . . . . . . . . . . . . 0.274 0.1 OUTLIER -49.28 -43.1 42.83 Favored 'General case' 0 CA--C 1.593 2.608 0 O-C-N 116.712 -3.742 . . . . 0.0 114.966 165.383 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 32' ' ' SER . . . . . . . . . . . . 0.29 27.2 t -50.47 -73.38 0.04 OUTLIER 'General case' 0 N--CA 1.501 2.124 0 N-CA-C 117.54 2.422 . . . . 0.0 117.54 141.927 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 33' ' ' GLU . . . . . 0.448 ' CB ' ' HB2' ' B' ' 23' ' ' ALA . 5.2 tm-20 -65.05 -49.0 71.8 Favored 'General case' 0 N--CA 1.506 2.346 0 N-CA-C 119.598 3.184 . . . . 0.0 119.598 -171.274 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 34' ' ' LEU . . . . . 0.758 HD12 ' CZ ' ' A' ' 7' ' ' PHE . 0.1 OUTLIER -41.51 -57.01 2.36 Favored 'General case' 0 CA--C 1.556 1.198 0 CA-C-O 115.495 -2.193 . . . . 0.0 108.628 158.926 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 35' ' ' LEU . . . . . . . . . . . . . 11.9 mt -60.93 -48.34 82.29 Favored 'General case' 0 N--CA 1.491 1.596 0 CA-C-N 124.44 3.291 . . . . 0.0 116.392 179.058 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 36' ' ' GLN . . . . . 0.646 ' HB3' ' HE ' ' B' ' 28' ' ' ARG . 0.0 OUTLIER -68.46 -34.56 76.16 Favored 'General case' 0 N--CA 1.478 0.964 0 CA-C-O 116.748 -1.596 . . . . 0.0 114.023 178.726 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 37' ' ' ILE . . . . . . . . . . . . . 2.0 tp -70.84 -27.94 32.12 Favored 'Isoleucine or valine' 0 CA--C 1.567 1.602 0 CA-C-O 115.836 -2.031 . . . . 0.0 115.363 163.191 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 38' ' ' VAL . . . . . 0.474 HG21 HD22 ' B' ' 34' ' ' LEU . 2.6 t -86.38 -52.96 11.26 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.194 0 C-N-CA 127.812 2.445 . . . . 0.0 110.917 -174.55 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 33.9 mt-30 -52.96 -37.67 61.36 Favored 'General case' 0 CA--C 1.562 1.427 0 CA-C-O 117.922 -1.037 . . . . 0.0 112.901 156.401 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 40' ' ' ASP . . . . . . . . . . . . 0.322 54.0 t0 -55.78 -54.63 42.13 Favored 'General case' 0 N--CA 1.49 1.548 0 N-CA-C 117.567 2.432 . . . . 0.0 117.567 154.516 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 41' ' ' ALA . . . . . . . . . . . . 0.315 . . -64.17 -40.43 96.11 Favored 'General case' 0 CA--C 1.558 1.253 0 N-CA-C 116.215 1.932 . . . . 0.0 116.215 -167.747 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 42' ' ' LEU . . . . . 0.495 ' HB3' HH21 ' A' ' 22' ' ' ARG . 2.6 pp . . . . . 0 N--CA 1.49 1.549 0 N-CA-C 118.176 2.658 . . . . 0.0 118.176 171.65 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 1.8 p30 . . . . . 0 CA--C 1.567 1.601 0 CA-C-O 118.594 -0.717 . . . . 0.0 112.178 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_exo -97.31 136.84 0.43 Allowed 'Trans proline' 0 CA--C 1.552 1.411 0 CA-C-N 122.296 1.856 . . . . 0.0 113.256 -161.995 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 75.2 m80 -81.1 122.01 26.81 Favored 'General case' 0 CA--C 1.573 1.841 0 CA-C-N 114.263 -1.335 . . . . 0.0 110.571 174.539 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . 0.781 ' CZ ' HD12 ' B' ' 34' ' ' LEU . 1.5 p90 -125.56 157.82 36.14 Favored 'General case' 0 CA--C 1.567 1.631 0 O-C-N 119.984 -1.698 . . . . 0.0 112.184 159.408 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 83.9 m-20 -68.96 103.45 1.83 Allowed 'General case' 0 CA--C 1.57 1.723 0 O-C-N 120.893 -1.129 . . . . 0.0 112.613 176.034 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . 0.622 ' CG ' HD13 ' B' ' 34' ' ' LEU . 5.6 t80 -124.47 104.95 9.03 Favored 'General case' 0 CA--C 1.537 0.48 0 N-CA-C 107.328 -1.36 . . . . 0.0 107.328 162.337 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . 0.478 0.1 OUTLIER 93.93 85.55 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.781 1 O-C-N 113.686 -5.634 . . . . 0.0 110.843 -12.54 . . . . . . . . 4 3 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' MET . . . . . 0.482 ' HG2' HD21 ' B' ' 35' ' ' LEU . 15.7 mtt -157.14 134.33 6.74 Favored Pre-proline 0 CA--C 1.57 1.738 0 CA-C-O 117.777 -1.106 . . . . 0.0 111.813 -154.715 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 67.8 Cg_exo -49.4 156.35 2.76 Favored 'Trans proline' 0 CA--C 1.564 2.022 0 C-N-CA 123.106 2.537 . . . . 0.0 118.277 167.191 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 9.0 tpp -62.7 -41.65 99.24 Favored 'General case' 0 N--CA 1.488 1.443 0 N-CA-C 116.793 2.146 . . . . 0.0 116.793 -161.579 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 -61.23 -38.72 87.64 Favored 'General case' 0 CA--C 1.565 1.54 0 N-CA-C 115.991 1.848 . . . . 0.0 115.991 165.635 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.457 ' CG1' HG12 ' B' ' 38' ' ' VAL . 1.5 t -58.46 -43.85 87.64 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.077 0 CA-C-N 122.267 2.303 . . . . 0.0 114.983 175.943 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . 0.535 0.1 OUTLIER -117.73 22.25 12.44 Favored 'General case' 0 N--CA 1.483 1.205 0 N-CA-C 119.35 3.093 . . . . 0.0 119.35 171.922 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -66.75 -45.62 77.99 Favored 'General case' 0 CA--C 1.565 1.537 0 O-C-N 118.54 -2.6 . . . . 0.0 113.278 121.201 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . 0.256 46.2 mtmt -63.8 -52.6 59.54 Favored 'General case' 0 N--CA 1.489 1.494 0 CA-C-N 122.535 2.425 . . . . 0.0 116.079 177.454 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.538 HD21 ' CD2' ' A' ' 34' ' ' LEU . 11.7 tp -68.36 -35.55 77.9 Favored 'General case' 0 CA--C 1.564 1.494 0 C-N-CA 124.945 1.298 . . . . 0.0 113.556 173.078 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 2.3 ttpt -87.02 -24.02 24.79 Favored 'General case' 0 CA--C 1.572 1.813 0 CA-C-N 121.309 1.868 . . . . 0.0 114.31 178.667 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 13.9 m-85 -65.34 -68.87 0.33 Allowed 'General case' 0 N--CA 1.488 1.456 0 CA-C-O 114.365 -2.731 . . . . 0.0 111.15 154.887 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . 0.291 24.4 ttt180 -25.46 -48.53 0.02 OUTLIER 'General case' 0 CA--C 1.591 2.528 0 CA-C-N 125.363 3.71 . . . . 0.0 115.94 165.521 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -57.58 -76.56 0.04 OUTLIER 'General case' 0 CA--C 1.589 2.476 0 N-CA-C 117.523 2.416 . . . . 0.0 117.523 157.446 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 36.7 mt-10 . . . . . 0 N--CA 1.507 2.378 0 N-CA-C 118.512 2.782 . . . . 0.0 118.512 178.201 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 37.5 mtm-85 . . . . . 0 CA--C 1.572 1.797 0 N-CA-C 106.546 -1.649 . . . . 0.0 106.546 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . 0.434 ' H ' ' HB2' ' A' ' 32' ' ' SER . 33.5 m -122.77 113.34 19.05 Favored 'General case' 0 N--CA 1.503 2.206 0 O-C-N 118.457 -2.652 . . . . 0.0 104.835 -176.478 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' MET . . . . . 0.43 ' HE3' ' HB3' ' A' ' 19' ' ' LEU . 24.4 mtp -44.54 -41.27 6.31 Favored 'General case' 0 N--CA 1.501 2.105 0 N-CA-C 119.486 3.143 . . . . 0.0 119.486 -143.408 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -48.0 -41.53 25.63 Favored 'General case' 0 CA--C 1.595 2.682 0 CA-C-N 124.794 3.452 . . . . 0.0 115.071 165.226 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . 0.434 ' HB2' ' H ' ' A' ' 29' ' ' SER 0.291 67.3 m -55.31 -61.34 2.4 Favored 'General case' 0 N--CA 1.503 2.201 0 N-CA-C 120.686 3.587 . . . . 0.0 120.686 145.98 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 11.5 tp10 -62.78 -60.56 3.33 Favored 'General case' 0 N--CA 1.523 3.217 0 CA-C-N 125.096 3.589 . . . . 0.0 115.731 178.709 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.733 HD12 ' CZ ' ' B' ' 7' ' ' PHE . 0.1 OUTLIER -41.16 -55.29 2.68 Favored 'General case' 0 CA--C 1.546 0.816 0 CA-C-O 115.587 -2.149 . . . . 0.0 108.214 170.473 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 15.9 mt -61.66 -51.19 69.46 Favored 'General case' 0 C--N 1.37 1.489 0 CA-C-N 123.074 2.67 . . . . 0.0 114.412 176.528 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . 0.424 ' C ' HE21 ' A' ' 36' ' ' GLN . 0.0 OUTLIER -54.49 -42.28 70.56 Favored 'General case' 0 CA--C 1.567 1.632 0 N-CA-C 115.675 1.732 . . . . 0.0 115.675 175.68 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 5.3 tp -72.92 -29.16 28.46 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.958 0 CA-C-N 122.301 2.319 . . . . 0.0 116.636 166.484 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.495 ' HA ' ' HB3' ' A' ' 41' ' ' ALA . 8.1 t -80.01 -50.11 18.15 Favored 'Isoleucine or valine' 0 CA--C 1.58 2.118 0 C-N-CA 126.683 1.993 . . . . 0.0 110.042 -178.238 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 26.0 mt-30 -48.09 -40.96 24.96 Favored 'General case' 0 N--CA 1.488 1.429 0 N-CA-C 114.476 1.287 . . . . 0.0 114.476 153.836 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . 0.335 79.2 m-20 -50.5 -62.73 1.42 Allowed 'General case' 0 N--CA 1.491 1.595 0 CA-C-N 120.415 1.461 . . . . 0.0 114.142 154.029 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . 0.495 ' HB3' ' HA ' ' A' ' 38' ' ' VAL 0.285 . . . . . . . 0 CA--C 1.562 1.409 0 N-CA-C 119.184 3.031 . . . . 0.0 119.184 -171.326 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 4.8 Cg_exo . . . . . 0 CA--C 1.553 1.461 0 CA-C-O 122.889 1.12 . . . . 0.0 113.123 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' B' B ' 6' ' ' HIS . . . . . . . . . . . . . 76.3 m80 -76.7 141.14 41.02 Favored 'General case' 0 CA--C 1.56 1.347 0 CA-C-N 113.517 -1.674 . . . . 0.0 113.184 -178.157 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 7' ' ' PHE . . . . . 0.733 ' CZ ' HD12 ' A' ' 34' ' ' LEU 0.266 27.7 p90 -121.29 167.54 12.62 Favored 'General case' 0 CA--C 1.564 1.497 0 O-C-N 119.838 -1.789 . . . . 0.0 110.285 116.972 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 8' ' ' ASN . . . . . . . . . . . . . 16.7 m120 -84.39 94.01 8.4 Favored 'General case' 0 N--CA 1.486 1.354 0 O-C-N 119.479 -2.013 . . . . 0.0 108.062 164.211 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 9' ' ' PHE . . . . . 0.642 ' CD2' HD13 ' A' ' 34' ' ' LEU . 5.7 t80 -68.41 162.73 24.79 Favored 'General case' 0 CA--C 1.557 1.229 0 CA-C-O 124.486 2.089 . . . . 0.0 110.824 158.957 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 10' ' ' ARG . . . . . . . . . . . . . 28.1 tpt85 177.08 97.93 0.01 OUTLIER 'General case' 0 N--CA 1.486 1.374 0 CA-C-N 113.385 -1.734 . . . . 0.0 106.713 -126.463 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 11' ' ' MET . . . . . 0.517 ' SD ' ' CD2' ' B' ' 9' ' ' PHE . 0.7 OUTLIER -122.64 120.51 27.81 Favored Pre-proline 0 CA--C 1.563 1.47 0 CA-C-O 117.049 -1.453 . . . . 0.0 110.864 -161.269 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 12' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_exo -44.91 149.78 1.08 Allowed 'Trans proline' 0 CA--C 1.566 2.123 0 CA-C-N 123.702 2.358 . . . . 0.0 116.051 159.942 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 13' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -54.14 -41.96 68.98 Favored 'General case' 0 N--CA 1.498 1.964 0 N-CA-C 117.374 2.361 . . . . 0.0 117.374 -157.501 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 9.1 pt-20 -63.46 -39.26 93.99 Favored 'General case' 0 CA--C 1.564 1.508 0 N-CA-C 116.54 2.052 . . . . 0.0 116.54 168.747 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 15' ' ' VAL . . . . . 0.437 ' CG1' HG12 ' A' ' 38' ' ' VAL . 0.8 OUTLIER -61.16 -46.38 96.75 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.091 0 CA-C-N 123.04 2.655 . . . . 0.0 113.421 172.259 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 2.1 ttt180 -74.7 -39.99 61.62 Favored 'General case' 0 C--O 1.218 -0.592 0 CA-C-O 116.353 -1.784 . . . . 0.0 115.027 174.419 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 17' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -58.91 -38.13 78.21 Favored 'General case' 0 CA--C 1.566 1.585 0 CA-C-N 123.386 2.812 . . . . 0.0 114.371 163.604 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . 0.309 50.5 mtmt -67.93 -50.04 58.37 Favored 'General case' 0 CA--C 1.566 1.591 0 CA-C-N 121.6 2.0 . . . . 0.0 115.227 170.347 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 19' ' ' LEU . . . . . 0.639 ' HG ' ' SD ' ' B' ' 30' ' ' MET 0.322 13.3 tp -67.82 -37.77 82.39 Favored 'General case' 0 CA--C 1.574 1.872 0 CA-C-N 121.024 1.738 . . . . 0.0 114.336 174.458 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 20' ' ' LYS . . . . . . . . . . . . . 29.2 ttpt -88.5 -27.02 21.74 Favored 'General case' 0 CA--C 1.566 1.595 0 O-C-N 120.466 -1.396 . . . . 0.0 113.996 -179.988 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 19.9 m-30 -62.59 -70.5 0.2 Allowed 'General case' 0 N--CA 1.493 1.684 0 CA-C-O 113.607 -3.092 . . . . 0.0 110.27 155.326 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . 0.288 53.5 ttt180 -20.5 -53.07 0.01 OUTLIER 'General case' 0 CA--C 1.593 2.624 0 CA-C-N 125.751 3.887 . . . . 0.0 116.882 165.016 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 23' ' ' ALA . . . . . 0.491 ' HB2' ' CB ' ' B' ' 33' ' ' GLU . . . -54.22 -75.74 0.03 OUTLIER 'General case' 0 CA--C 1.589 2.475 0 N-CA-C 119.06 2.985 . . . . 0.0 119.06 157.091 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 -68.95 -39.13 79.69 Favored 'General case' 0 N--CA 1.502 2.137 0 N-CA-C 118.897 2.925 . . . . 0.0 118.897 -179.55 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 25' ' ' ALA . . . . . . . . . . . . . . . -38.97 -48.96 1.66 Allowed 'General case' 0 CA--C 1.581 2.137 0 N-CA-C 116.92 2.193 . . . . 0.0 116.92 156.08 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 26' ' ' ASN . . . . . . . . . . . . 0.299 0.0 OUTLIER -112.19 -47.8 3.08 Favored 'General case' 0 CA--C 1.578 2.047 0 N-CA-C 115.066 1.506 . . . . 0.0 115.066 -163.036 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 27' ' ' GLY . . . . . . . . . . . . . . . 148.66 44.65 0.03 OUTLIER Glycine 0 N--CA 1.5 2.926 0 N-CA-C 118.189 2.036 . . . . 0.0 118.189 176.472 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 28' ' ' ARG . . . . . 0.429 ' HE ' ' HG2' ' B' ' 33' ' ' GLU 0.334 1.1 ptt180 -156.92 153.44 28.12 Favored 'General case' 0 N--CA 1.495 1.797 0 N-CA-C 105.586 -2.005 . . . . 0.0 105.586 -173.115 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 29' ' ' SER . . . . . . . . . . . . . 75.1 p -119.77 110.5 16.86 Favored 'General case' 0 N--CA 1.502 2.126 0 O-C-N 118.312 -2.743 . . . . 0.0 105.638 -168.547 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 30' ' ' MET . . . . . 0.639 ' SD ' ' HG ' ' B' ' 19' ' ' LEU . 0.0 OUTLIER -39.85 -43.96 1.55 Allowed 'General case' 0 N--CA 1.493 1.703 0 N-CA-C 120.651 3.574 . . . . 0.0 120.651 -143.557 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 31' ' ' ASN . . . . . 0.405 ' O ' ' HB2' ' B' ' 35' ' ' LEU . 12.1 t-20 -44.4 -45.77 9.13 Favored 'General case' 0 CA--C 1.594 2.639 0 CA-C-N 124.029 3.104 . . . . 0.0 114.699 164.42 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 32' ' ' SER . . . . . . . . . . . . 0.326 30.9 t -50.61 -68.54 0.16 Allowed 'General case' 0 N--CA 1.5 2.044 0 N-CA-C 119.591 3.182 . . . . 0.0 119.591 144.561 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 33' ' ' GLU . . . . . 0.491 ' CB ' ' HB2' ' B' ' 23' ' ' ALA . 10.5 tm-20 -60.93 -58.44 8.41 Favored 'General case' 0 N--CA 1.515 2.793 0 N-CA-C 118.508 2.781 . . . . 0.0 118.508 -177.186 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 34' ' ' LEU . . . . . 0.781 HD12 ' CZ ' ' A' ' 7' ' ' PHE . 0.1 OUTLIER -39.91 -54.16 2.22 Favored 'General case' 0 CA--C 1.563 1.448 0 CA-C-O 116.46 -1.733 . . . . 0.0 107.305 166.2 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 35' ' ' LEU . . . . . 0.484 ' HG ' ' CE1' ' A' ' 9' ' ' PHE . 9.3 mt -63.26 -61.79 2.12 Favored 'General case' 0 C--N 1.371 1.53 0 CA-C-N 123.563 2.892 . . . . 0.0 115.977 -174.627 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 36' ' ' GLN . . . . . . . . . . . . 0.489 0.0 OUTLIER -60.76 -25.08 66.23 Favored 'General case' 0 CA--C 1.571 1.757 0 N-CA-C 115.352 1.612 . . . . 0.0 115.352 177.917 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 37' ' ' ILE . . . . . . . . . . . . . 1.9 tp -77.62 -32.57 18.34 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.788 0 CA-C-N 121.788 2.085 . . . . 0.0 116.24 163.833 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 38' ' ' VAL . . . . . 0.623 HG21 HD22 ' B' ' 34' ' ' LEU . 4.3 t -74.38 -50.38 27.45 Favored 'Isoleucine or valine' 0 CA--C 1.572 1.79 0 C-N-CA 127.942 2.497 . . . . 0.0 110.94 178.494 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 30.2 mt-30 -40.1 -49.23 2.57 Favored 'General case' 0 CA--C 1.567 1.601 0 N-CA-C 114.97 1.47 . . . . 0.0 114.97 149.798 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 40' ' ' ASP . . . . . . . . . . . . 0.339 1.5 t0 -57.45 -38.63 74.77 Favored 'General case' 0 CA--C 1.572 1.815 0 N-CA-C 118.241 2.682 . . . . 0.0 118.241 160.903 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 41' ' ' ALA . . . . . 0.555 ' HB3' ' HA ' ' B' ' 38' ' ' VAL . . . -72.99 -34.63 66.54 Favored 'General case' 0 CA--C 1.564 1.515 0 N-CA-C 116.914 2.19 . . . . 0.0 116.914 -176.83 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 42' ' ' LEU . . . . . 0.425 HD11 ' HB2' ' A' ' 19' ' ' LEU . 12.8 mt . . . . . 0 CA--C 1.56 1.334 0 C-N-CA 126.086 1.754 . . . . 0.0 113.185 176.776 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 21.7 p-10 . . . . . 0 CA--C 1.572 1.823 0 CA-C-O 118.72 -0.657 . . . . 0.0 111.241 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 23.6 Cg_exo -84.03 154.75 13.0 Favored 'Trans proline' 0 CA--C 1.557 1.633 0 CA-C-N 122.4 1.893 . . . . 0.0 116.374 -159.661 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 77.1 m80 -86.37 137.08 32.85 Favored 'General case' 0 CA--C 1.561 1.386 0 CA-C-N 114.04 -1.436 . . . . 0.0 113.568 -175.138 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . 0.711 ' CZ ' HD12 ' B' ' 34' ' ' LEU . 1.6 p90 -139.28 140.45 37.65 Favored 'General case' 0 N--CA 1.485 1.293 0 O-C-N 120.751 -1.218 . . . . 0.0 108.409 137.583 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 39.9 m-20 -73.92 100.86 3.63 Favored 'General case' 0 CA--C 1.563 1.458 0 O-C-N 120.434 -1.416 . . . . 0.0 111.469 -178.424 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . 0.69 ' HD2' HD11 ' A' ' 34' ' ' LEU . 5.3 t80 -79.65 77.0 6.28 Favored 'General case' 0 CA--C 1.576 1.953 0 CA-C-O 127.683 3.611 . . . . 0.0 111.216 169.593 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . 0.283 28.8 ptt180 -47.04 138.65 6.43 Favored 'General case' 0 N--CA 1.478 0.936 0 CA-C-N 109.577 -3.465 . . . . 0.0 118.011 130.238 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' MET . . . . . 0.439 ' HB2' ' HB2' ' A' ' 16' ' ' ARG . 9.1 mtt -147.75 138.07 12.7 Favored Pre-proline 0 CA--C 1.572 1.791 0 CA-C-N 112.928 -1.942 . . . . 0.0 110.204 -176.326 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 87.1 Cg_exo -41.46 142.61 1.08 Allowed 'Trans proline' 0 C--N 1.375 1.944 0 C-N-CA 123.627 2.885 . . . . 0.0 116.497 167.588 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 1.7 tpt -44.3 -38.03 3.64 Favored 'General case' 0 CA--C 1.569 1.711 0 N-CA-C 119.675 3.213 . . . . 0.0 119.675 -167.001 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -61.96 -47.13 86.25 Favored 'General case' 0 N--CA 1.486 1.342 0 N-CA-C 117.548 2.425 . . . . 0.0 117.548 167.734 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.459 HG21 HD22 ' B' ' 35' ' ' LEU . 0.1 OUTLIER -67.37 -42.44 87.43 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.911 0 CA-C-N 122.949 2.613 . . . . 0.0 112.509 173.262 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . 0.439 ' HB2' ' HB2' ' A' ' 11' ' ' MET 0.318 0.0 OUTLIER -79.15 -29.24 42.95 Favored 'General case' 0 N--CA 1.486 1.329 0 CA-C-N 123.078 2.672 . . . . 0.0 116.313 176.083 . . . . . . . . 4 4 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -67.42 -44.76 77.98 Favored 'General case' 0 N--CA 1.49 1.533 0 CA-C-N 123.38 2.809 . . . . 0.0 113.254 156.926 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . 0.552 8.8 pttt -74.02 -31.73 63.05 Favored 'General case' 0 N--CA 1.484 1.25 0 N-CA-C 116.643 2.09 . . . . 0.0 116.643 179.366 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.507 ' HB3' ' CE ' ' A' ' 30' ' ' MET 0.294 0.9 OUTLIER -69.07 -43.79 73.87 Favored 'General case' 0 N--CA 1.492 1.634 0 CA-C-N 122.764 2.529 . . . . 0.0 113.624 162.004 . . . . . . . . 4 4 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 1.5 ttpt -77.38 -38.92 49.01 Favored 'General case' 0 CA--C 1.562 1.428 0 N-CA-C 115.158 1.54 . . . . 0.0 115.158 -177.919 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 29.4 m-85 -55.86 -77.71 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.573 0 CA-C-O 113.408 -3.187 . . . . 0.0 110.832 154.557 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . 0.331 0.0 OUTLIER -28.72 -48.73 0.06 Allowed 'General case' 0 CA--C 1.589 2.463 1 CA-C-N 126.117 4.053 . . . . 0.0 117.113 176.053 . . . . . . . . 4 3 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.48 ' HB2' ' HB3' ' A' ' 33' ' ' GLU . . . -47.54 -77.65 0.02 OUTLIER 'General case' 0 CA--C 1.586 2.334 0 N-CA-C 120.54 3.533 . . . . 0.0 120.54 152.254 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 54.2 mm-40 . . . . . 0 N--CA 1.499 2.005 0 N-CA-C 118.603 2.816 . . . . 0.0 118.603 179.188 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.566 ' HE ' ' HB3' ' A' ' 36' ' ' GLN 0.288 18.3 mtm-85 . . . . . 0 N--CA 1.5 2.034 0 N-CA-C 102.688 -3.079 . . . . 0.0 102.688 . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 23.2 t -115.92 112.71 22.27 Favored 'General case' 0 N--CA 1.509 2.492 0 O-C-N 116.617 -3.802 . . . . 0.0 108.818 -164.8 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' MET . . . . . 0.507 ' CE ' ' HB3' ' A' ' 19' ' ' LEU . 25.6 mtp -42.62 -45.29 4.56 Favored 'General case' 0 N--CA 1.501 2.077 0 N-CA-C 119.474 3.139 . . . . 0.0 119.474 -134.707 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 18.7 t-20 -47.15 -43.56 21.08 Favored 'General case' 0 CA--C 1.6 2.888 1 O-C-N 115.928 -4.233 . . . . 0.0 114.816 165.088 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . 0.291 13.6 t -53.18 -72.24 0.06 Allowed 'General case' 0 N--CA 1.502 2.161 0 N-CA-C 117.306 2.336 . . . . 0.0 117.306 143.384 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . 0.48 ' HB3' ' HB2' ' A' ' 23' ' ' ALA . 4.5 tm-20 -68.41 -45.62 72.13 Favored 'General case' 0 N--CA 1.504 2.256 0 CA-C-N 124.471 3.305 . . . . 0.0 119.338 -171.994 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.846 HD12 ' CZ ' ' B' ' 7' ' ' PHE . 0.1 OUTLIER -41.43 -55.99 2.64 Favored 'General case' 0 CA--C 1.557 1.245 0 CA-C-O 114.866 -2.492 . . . . 0.0 108.39 156.762 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 11.8 mt -62.21 -45.94 91.11 Favored 'General case' 0 N--CA 1.493 1.706 0 CA-C-N 125.7 3.864 . . . . 0.0 116.762 177.493 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . 0.566 ' HB3' ' HE ' ' A' ' 28' ' ' ARG . 0.1 OUTLIER -70.97 -40.88 71.69 Favored 'General case' 0 N--CA 1.483 1.184 0 CA-C-O 116.705 -1.617 . . . . 0.0 113.48 178.955 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . 0.458 ' O ' ' HB2' ' A' ' 41' ' ' ALA . 1.3 tt -61.67 -31.7 51.58 Favored 'Isoleucine or valine' 0 C--O 1.199 -1.593 0 CA-C-O 114.329 -2.748 . . . . 0.0 115.178 160.474 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.457 HG21 HD22 ' A' ' 34' ' ' LEU . 2.6 t -84.38 -51.84 13.4 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.096 0 CA-C-N 123.698 2.954 . . . . 0.0 110.884 -173.57 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 33.9 mt-30 -48.76 -41.57 32.76 Favored 'General case' 0 CA--C 1.568 1.643 0 C-N-CA 124.208 1.003 . . . . 0.0 113.656 155.014 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . 0.352 17.4 t0 -50.31 -57.91 6.83 Favored 'General case' 0 N--CA 1.49 1.526 0 N-CA-C 116.916 2.191 . . . . 0.0 116.916 153.981 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . 0.458 ' HB2' ' O ' ' A' ' 37' ' ' ILE . . . . . . . . 0 CA--C 1.551 0.995 0 N-CA-C 116.733 2.124 . . . . 0.0 116.733 -157.496 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 90.0 Cg_endo . . . . . 0 CA--C 1.557 1.636 0 N-CA-C 115.945 1.479 . . . . 0.0 115.945 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' B' B ' 6' ' ' HIS . . . . . . . . . . . . . 54.9 m80 -75.19 154.21 37.75 Favored 'General case' 0 CA--C 1.557 1.231 0 CA-C-N 113.8 -1.546 . . . . 0.0 114.597 174.656 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 7' ' ' PHE . . . . . 0.846 ' CZ ' HD12 ' A' ' 34' ' ' LEU . 17.8 p90 -131.19 162.66 29.45 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 120.197 -1.564 . . . . 0.0 112.395 120.026 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 8' ' ' ASN . . . . . . . . . . . . . 6.1 p-10 -61.73 92.47 0.04 OUTLIER 'General case' 0 CA--C 1.567 1.628 0 N-CA-C 114.422 1.267 . . . . 0.0 114.422 165.403 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 9' ' ' PHE . . . . . 0.65 ' CD2' HD13 ' A' ' 34' ' ' LEU 0.263 0.8 OUTLIER -79.53 164.77 23.62 Favored 'General case' 0 CA--C 1.563 1.476 0 CA-C-O 125.543 2.592 . . . . 0.0 109.511 153.905 . . . . . . . . 4 4 . 1 . 003 nuclear nobuild core ' B' B ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 162.63 103.33 0.0 OUTLIER 'General case' 0 C--N 1.308 -1.231 0 CA-C-N 111.819 -2.446 . . . . 0.0 104.658 -123.846 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 11' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -139.96 128.75 13.37 Favored Pre-proline 0 CA--C 1.567 1.631 0 CA-C-O 117.669 -1.158 . . . . 0.0 110.88 -158.883 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 12' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -59.46 153.42 54.52 Favored 'Trans proline' 0 CA--C 1.562 1.905 0 CA-C-N 123.779 2.385 . . . . 0.0 114.116 169.445 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 13' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -57.84 -36.55 72.44 Favored 'General case' 0 N--CA 1.495 1.821 0 N-CA-C 117.026 2.232 . . . . 0.0 117.026 -155.03 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -60.13 -44.23 95.07 Favored 'General case' 0 CA--C 1.563 1.458 0 N-CA-C 117.146 2.276 . . . . 0.0 117.146 165.705 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 15' ' ' VAL . . . . . 0.406 ' CG1' HG12 ' A' ' 38' ' ' VAL . 0.3 OUTLIER -63.06 -46.33 96.46 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.131 0 CA-C-N 123.57 2.896 . . . . 0.0 112.612 172.921 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 16' ' ' ARG . . . . . . . . . . . . 0.255 0.0 OUTLIER -76.63 -27.87 55.87 Favored 'General case' 0 N--CA 1.479 1.009 0 N-CA-C 116.261 1.949 . . . . 0.0 116.261 177.297 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 17' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -67.44 -44.46 78.65 Favored 'General case' 0 N--CA 1.49 1.573 0 CA-C-N 122.833 2.56 . . . . 0.0 113.699 156.925 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 55.4 mtmt -58.5 -54.89 41.9 Favored 'General case' 0 N--CA 1.49 1.561 0 CA-C-N 122.378 2.354 . . . . 0.0 114.93 171.316 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 19' ' ' LEU . . . . . 0.496 HD21 ' HG ' ' B' ' 34' ' ' LEU . 12.9 tp -63.57 -35.63 81.13 Favored 'General case' 0 CA--C 1.562 1.44 0 N-CA-C 115.124 1.527 . . . . 0.0 115.124 176.453 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 20' ' ' LYS . . . . . 0.444 ' HA ' ' HB3' ' B' ' 23' ' ' ALA . 11.8 ttpt -87.82 -23.0 24.17 Favored 'General case' 0 CA--C 1.572 1.803 0 N-CA-C 114.314 1.228 . . . . 0.0 114.314 176.185 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 21' ' ' PHE . . . . . 0.41 ' O ' ' HB3' ' B' ' 25' ' ' ALA . 11.2 m-85 -64.53 -71.71 0.17 Allowed 'General case' 0 N--CA 1.491 1.62 0 CA-C-O 115.167 -2.349 . . . . 0.0 110.635 154.678 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . 0.369 0.0 OUTLIER -18.58 -52.28 0.01 OUTLIER 'General case' 0 CA--C 1.597 2.754 0 CA-C-N 124.616 3.371 . . . . 0.0 115.106 159.794 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 23' ' ' ALA . . . . . 0.444 ' HB3' ' HA ' ' B' ' 20' ' ' LYS 0.331 . . -55.67 -77.96 0.02 OUTLIER 'General case' 0 CA--C 1.586 2.338 0 N-CA-C 120.202 3.408 . . . . 0.0 120.202 154.182 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 12.6 mm-40 -68.93 -36.59 78.16 Favored 'General case' 0 N--CA 1.502 2.16 0 N-CA-C 119.323 3.083 . . . . 0.0 119.323 -178.719 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 25' ' ' ALA . . . . . 0.41 ' HB3' ' O ' ' B' ' 21' ' ' PHE . . . -42.79 -49.82 5.69 Favored 'General case' 0 CA--C 1.58 2.127 0 N-CA-C 116.496 2.036 . . . . 0.0 116.496 154.413 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 26' ' ' ASN . . . . . . . . . . . . . 6.8 m-20 -82.23 -54.61 5.11 Favored 'General case' 0 CA--C 1.572 1.789 0 N-CA-C 114.275 1.213 . . . . 0.0 114.275 179.131 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 27' ' ' GLY . . . . . . . . . . . . . . . 116.67 23.94 3.86 Favored Glycine 0 N--CA 1.498 2.793 0 N-CA-C 117.835 1.894 . . . . 0.0 117.835 -152.661 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 28' ' ' ARG . . . . . . . . . . . . 0.291 81.7 mtm180 -119.09 155.61 31.22 Favored 'General case' 0 CA--C 1.58 2.106 0 N-CA-C 103.738 -2.69 . . . . 0.0 103.738 170.927 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 29' ' ' SER . . . . . . . . . . . . . 87.5 p -122.98 108.13 12.59 Favored 'General case' 0 N--CA 1.507 2.387 0 O-C-N 116.852 -3.655 . . . . 0.0 107.576 -166.47 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 30' ' ' MET . . . . . . . . . . . . . 23.4 mtp -40.6 -45.93 2.43 Favored 'General case' 0 N--CA 1.5 2.033 0 N-CA-C 119.15 3.019 . . . . 0.0 119.15 -137.592 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 31' ' ' ASN . . . . . . . . . . . . 0.286 0.1 OUTLIER -48.56 -43.65 35.85 Favored 'General case' 0 CA--C 1.601 2.926 0 CA-C-N 125.178 3.626 . . . . 0.0 114.707 167.08 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 32' ' ' SER . . . . . . . . . . . . 0.296 70.0 m -53.04 -63.19 1.23 Allowed 'General case' 0 N--CA 1.508 2.473 0 N-CA-C 119.902 3.297 . . . . 0.0 119.902 145.527 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 33' ' ' GLU . . . . . 0.441 ' HB3' ' HB2' ' B' ' 23' ' ' ALA . 8.5 tm-20 -70.28 -54.76 11.31 Favored 'General case' 0 N--CA 1.504 2.234 0 CA-C-N 123.668 2.94 . . . . 0.0 118.901 -178.707 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 34' ' ' LEU . . . . . 0.711 HD12 ' CZ ' ' A' ' 7' ' ' PHE . 0.1 OUTLIER -36.39 -52.23 0.83 Allowed 'General case' 0 CA--C 1.554 1.111 0 CA-C-O 115.829 -2.034 . . . . 0.0 108.74 161.119 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 35' ' ' LEU . . . . . 0.459 HD22 HG21 ' A' ' 15' ' ' VAL . 19.7 mt -62.67 -47.64 82.78 Favored 'General case' 0 C--N 1.369 1.416 0 CA-C-N 123.689 2.949 . . . . 0.0 116.351 174.075 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 36' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -69.07 -31.42 70.16 Favored 'General case' 0 N--CA 1.49 1.557 0 N-CA-C 116.305 1.965 . . . . 0.0 116.305 179.491 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 37' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -73.38 -34.53 43.56 Favored 'Isoleucine or valine' 0 C--O 1.2 -1.519 0 CA-C-O 114.978 -2.439 . . . . 0.0 113.908 159.526 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 38' ' ' VAL . . . . . 0.402 ' HA ' ' HB3' ' B' ' 41' ' ' ALA . 2.6 t -76.05 -49.31 26.02 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.314 0 CA-C-N 123.969 3.077 . . . . 0.0 112.448 -176.639 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 31.5 mt-30 -55.06 -38.76 68.44 Favored 'General case' 0 CA--C 1.57 1.749 0 CA-C-O 117.631 -1.176 . . . . 0.0 112.908 156.43 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 40' ' ' ASP . . . . . . . . . . . . 0.42 7.1 t0 -52.41 -45.32 65.85 Favored 'General case' 0 N--CA 1.504 2.255 0 N-CA-C 116.737 2.125 . . . . 0.0 116.737 154.485 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 41' ' ' ALA . . . . . 0.402 ' HB3' ' HA ' ' B' ' 38' ' ' VAL 0.296 . . -84.16 -53.78 5.28 Favored 'General case' 0 CA--C 1.553 1.068 0 N-CA-C 115.807 1.78 . . . . 0.0 115.807 -161.136 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . 0.316 1.5 pp . . . . . 0 N--CA 1.494 1.754 0 N-CA-C 117.286 2.328 . . . . 0.0 117.286 160.951 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 7.4 p-10 . . . . . 0 CA--C 1.57 1.737 0 N-CA-C 112.478 0.547 . . . . 0.0 112.478 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 4.4 Cg_exo -99.07 154.01 0.63 Allowed 'Trans proline' 0 C--N 1.362 1.281 0 CA-C-N 121.936 1.727 . . . . 0.0 113.889 -157.743 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 61.7 m80 -72.34 138.42 47.3 Favored 'General case' 0 CA--C 1.562 1.413 0 CA-C-N 113.546 -1.661 . . . . 0.0 113.633 177.356 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . 0.806 ' CZ ' HD12 ' B' ' 34' ' ' LEU 0.268 35.5 p90 -116.43 170.97 8.15 Favored 'General case' 0 CA--C 1.565 1.549 0 O-C-N 120.065 -1.647 . . . . 0.0 110.438 113.902 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 93.1 m-20 -89.13 94.53 9.97 Favored 'General case' 0 N--CA 1.485 1.319 0 O-C-N 119.764 -1.835 . . . . 0.0 107.556 162.364 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . 0.635 ' CG ' HD13 ' B' ' 34' ' ' LEU . 8.9 t80 -66.9 162.83 20.92 Favored 'General case' 0 CA--C 1.556 1.202 0 CA-C-O 124.344 2.021 . . . . 0.0 111.345 160.904 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 38.3 tpt85 170.96 103.35 0.01 OUTLIER 'General case' 0 N--CA 1.486 1.346 0 O-C-N 119.785 -1.822 . . . . 0.0 106.881 -119.19 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' MET . . . . . 0.595 ' SD ' HD23 ' A' ' 19' ' ' LEU . 11.6 mtm -138.85 122.9 11.3 Favored Pre-proline 0 CA--C 1.561 1.375 0 CA-C-O 117.296 -1.335 . . . . 0.0 110.872 -153.763 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 75.1 Cg_exo -43.0 143.11 1.96 Allowed 'Trans proline' 0 CA--C 1.562 1.923 0 C-N-CA 122.952 2.435 . . . . 0.0 116.013 163.32 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . 0.403 ' SD ' ' HG3' ' A' ' 17' ' ' GLU . 9.5 tpp -55.34 -28.68 55.35 Favored 'General case' 0 N--CA 1.491 1.609 0 N-CA-C 119.533 3.16 . . . . 0.0 119.533 -163.987 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . 0.268 9.2 pt-20 -62.7 -48.63 78.43 Favored 'General case' 0 CA--C 1.566 1.586 0 N-CA-C 116.411 2.004 . . . . 0.0 116.411 160.959 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -60.13 -44.19 94.61 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.288 0 CA-C-N 123.114 2.688 . . . . 0.0 113.438 174.345 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -80.84 -21.28 40.9 Favored 'General case' 0 CA--C 1.556 1.181 0 N-CA-C 116.63 2.085 . . . . 0.0 116.63 175.759 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 0.403 ' HG3' ' SD ' ' A' ' 13' ' ' MET . 38.9 mt-10 -67.34 -47.61 69.97 Favored 'General case' 0 N--CA 1.49 1.555 0 CA-C-N 123.183 2.719 . . . . 0.0 113.766 151.946 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 46.7 mtmt -57.6 -57.04 14.44 Favored 'General case' 0 N--CA 1.485 1.307 0 CA-C-N 121.609 2.004 . . . . 0.0 114.353 174.157 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.595 HD23 ' SD ' ' A' ' 11' ' ' MET 0.267 12.0 tp -64.18 -40.0 95.18 Favored 'General case' 0 CA--C 1.563 1.445 0 C-N-CA 124.812 1.245 . . . . 0.0 113.499 176.081 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 10.6 ttpt -80.26 -25.12 39.65 Favored 'General case' 0 CA--C 1.569 1.705 0 CA-C-N 120.537 1.517 . . . . 0.0 114.947 176.201 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 18.7 m-30 -70.43 -71.48 0.24 Allowed 'General case' 0 N--CA 1.488 1.468 0 CA-C-O 114.074 -2.869 . . . . 0.0 110.764 162.23 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.644 HH21 HD11 ' A' ' 37' ' ' ILE 0.261 7.3 tpt180 -14.09 -56.26 0.0 OUTLIER 'General case' 0 CA--C 1.595 2.683 0 CA-C-N 125.92 3.964 . . . . 0.0 116.042 159.515 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.512 ' HB2' ' CB ' ' A' ' 33' ' ' GLU . . . -55.77 -79.42 0.02 OUTLIER 'General case' 0 CA--C 1.586 2.329 0 N-CA-C 118.421 2.748 . . . . 0.0 118.421 157.921 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 66.5 mm-40 . . . . . 0 CA--C 1.574 1.904 0 N-CA-C 119.34 3.089 . . . . 0.0 119.34 -175.437 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.511 HH12 HD13 ' A' ' 37' ' ' ILE . 84.4 mtm180 . . . . . 0 CA--C 1.576 1.961 0 N-CA-C 104.748 -2.315 . . . . 0.0 104.748 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 9.4 t -137.76 115.15 11.1 Favored 'General case' 0 N--CA 1.503 2.219 0 O-C-N 117.157 -3.465 . . . . 0.0 107.071 -171.766 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 19.9 mtp -53.05 -40.7 64.17 Favored 'General case' 0 N--CA 1.491 1.62 0 N-CA-C 118.224 2.676 . . . . 0.0 118.224 -126.724 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 13.0 t-20 -45.58 -43.58 12.24 Favored 'General case' 0 CA--C 1.598 2.793 0 CA-C-N 125.505 3.775 . . . . 0.0 114.857 165.151 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . 0.416 89.1 p -56.95 -58.29 8.79 Favored 'General case' 0 N--CA 1.503 2.214 0 N-CA-C 120.348 3.462 . . . . 0.0 120.348 149.555 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . 0.512 ' CB ' ' HB2' ' A' ' 23' ' ' ALA . 10.5 tm-20 -64.82 -61.14 2.36 Favored 'General case' 0 N--CA 1.507 2.389 0 CA-C-N 123.127 2.694 . . . . 0.0 117.761 176.804 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.819 HD12 ' CZ ' ' B' ' 7' ' ' PHE . 0.0 OUTLIER -38.23 -53.44 1.45 Allowed 'General case' 0 CA--C 1.545 0.77 0 CA-C-O 115.748 -2.072 . . . . 0.0 108.126 169.019 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.495 ' HG ' ' CE1' ' B' ' 9' ' ' PHE . 11.9 mt -63.99 -56.29 16.17 Favored 'General case' 0 C--N 1.367 1.343 0 CA-C-N 123.03 2.65 . . . . 0.0 115.171 178.848 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . 0.424 ' C ' HE21 ' A' ' 36' ' ' GLN 0.276 0.0 OUTLIER -58.56 -31.1 67.68 Favored 'General case' 0 CA--C 1.57 1.727 0 CA-C-O 116.612 -1.661 . . . . 0.0 114.626 176.874 . . . . . . . . 4 4 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . 0.644 HD11 HH21 ' A' ' 22' ' ' ARG . 2.8 tp -79.28 -31.7 14.58 Favored 'Isoleucine or valine' 0 CA--C 1.567 1.62 0 CA-C-N 122.318 2.327 . . . . 0.0 116.414 164.393 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.433 HG21 HD22 ' A' ' 34' ' ' LEU . 3.1 t -77.19 -48.72 24.29 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.911 0 CA-C-N 122.285 2.311 . . . . 0.0 110.934 178.821 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 29.6 mt-30 -51.36 -46.21 62.66 Favored 'General case' 0 CA--C 1.551 0.987 0 CA-C-O 116.198 -1.858 . . . . 0.0 113.005 155.824 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . 0.407 ' HB3' ' HA ' ' A' ' 37' ' ' ILE 0.297 42.0 t0 -44.51 -55.24 5.26 Favored 'General case' 0 N--CA 1.502 2.157 0 CA-C-N 121.763 2.074 . . . . 0.0 113.644 158.497 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . 0.283 . . . . . . . 0 CA--C 1.544 0.721 0 N-CA-C 119.324 3.083 . . . . 0.0 119.324 -161.678 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 4.5 Cg_exo . . . . . 0 CA--C 1.557 1.669 0 N-CA-C 114.011 0.735 . . . . 0.0 114.011 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' B' B ' 6' ' ' HIS . . . . . . . . . . . . . 77.5 m80 -85.82 135.28 33.78 Favored 'General case' 0 CA--C 1.579 2.059 0 CA-C-N 114.959 -1.019 . . . . 0.0 112.117 174.647 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 7' ' ' PHE . . . . . 0.819 ' CZ ' HD12 ' A' ' 34' ' ' LEU . 3.0 p90 -135.94 161.7 34.9 Favored 'General case' 0 CA--C 1.571 1.778 0 O-C-N 119.896 -1.752 . . . . 0.0 112.345 151.058 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 8' ' ' ASN . . . . . . . . . . . . . 7.8 p-10 -62.32 102.75 0.33 Allowed 'General case' 0 CA--C 1.575 1.909 0 N-CA-C 116.001 1.852 . . . . 0.0 116.001 171.782 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 9' ' ' PHE . . . . . 0.622 ' CG ' HD13 ' A' ' 34' ' ' LEU . 4.9 t80 -126.81 105.99 9.04 Favored 'General case' 0 CA--C 1.538 0.516 0 N-CA-C 107.661 -1.237 . . . . 0.0 107.661 159.662 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 10' ' ' ARG . . . . . . . . . . . . 0.469 0.0 OUTLIER 92.79 87.45 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.566 1 O-C-N 114.162 -5.337 . . . . 0.0 109.339 -11.415 . . . . . . . . 4 3 . 1 . 004 nuclear nobuild core ' B' B ' 11' ' ' MET . . . . . 0.633 ' SD ' HD23 ' B' ' 19' ' ' LEU . 8.4 mtm -148.87 126.29 5.6 Favored Pre-proline 0 CA--C 1.566 1.565 0 CA-C-O 117.045 -1.455 . . . . 0.0 110.371 -160.261 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 12' ' ' PRO . . . . . . . . . . . . . 76.9 Cg_exo -42.55 140.47 2.68 Favored 'Trans proline' 0 C--N 1.371 1.72 0 C-N-CA 123.242 2.628 . . . . 0.0 116.261 161.944 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 13' ' ' MET . . . . . 0.452 ' SD ' ' HG3' ' B' ' 17' ' ' GLU . 23.4 tpp -54.76 -29.19 53.29 Favored 'General case' 0 N--CA 1.495 1.78 0 N-CA-C 119.006 2.965 . . . . 0.0 119.006 -163.886 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -61.95 -48.25 81.22 Favored 'General case' 0 N--CA 1.492 1.672 0 N-CA-C 117.008 2.225 . . . . 0.0 117.008 163.972 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -58.92 -50.58 79.08 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.138 0 CA-C-N 121.163 1.801 . . . . 0.0 113.001 172.123 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -73.83 -26.09 60.41 Favored 'General case' 0 CA--C 1.545 0.759 0 N-CA-C 116.7 2.111 . . . . 0.0 116.7 175.826 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 17' ' ' GLU . . . . . 0.452 ' HG3' ' SD ' ' B' ' 13' ' ' MET . 43.2 mt-10 -64.13 -48.2 76.98 Favored 'General case' 0 N--CA 1.49 1.565 0 CA-C-N 123.908 3.049 . . . . 0.0 112.959 156.883 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . 0.615 23.5 pttt -67.26 -40.28 86.19 Favored 'General case' 0 N--CA 1.488 1.442 0 N-CA-C 117.415 2.376 . . . . 0.0 117.415 178.963 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 19' ' ' LEU . . . . . 0.633 HD23 ' SD ' ' B' ' 11' ' ' MET . 12.5 tp -69.75 -35.88 75.33 Favored 'General case' 0 CA--C 1.565 1.52 0 N-CA-C 115.081 1.512 . . . . 0.0 115.081 168.234 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 20' ' ' LYS . . . . . . . . . . . . . 14.3 ttpt -86.57 -30.74 21.64 Favored 'General case' 0 CA--C 1.567 1.627 0 N-CA-C 114.721 1.378 . . . . 0.0 114.721 178.814 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 21' ' ' PHE . . . . . 0.438 ' O ' ' HB3' ' B' ' 25' ' ' ALA . 24.5 m-85 -59.66 -68.56 0.27 Allowed 'General case' 0 N--CA 1.492 1.629 0 CA-C-O 114.188 -2.815 . . . . 0.0 111.514 155.23 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . 0.306 13.9 ttm-85 -25.68 -47.79 0.02 OUTLIER 'General case' 0 CA--C 1.597 2.788 0 CA-C-N 125.583 3.811 . . . . 0.0 116.979 163.411 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -61.36 -61.78 2.3 Favored 'General case' 0 CA--C 1.581 2.148 0 N-CA-C 119.936 3.31 . . . . 0.0 119.936 160.668 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 49.4 mt-10 -68.04 -51.34 47.96 Favored 'General case' 0 N--CA 1.502 2.128 0 N-CA-C 116.743 2.127 . . . . 0.0 116.743 175.041 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 25' ' ' ALA . . . . . 0.438 ' HB3' ' O ' ' B' ' 21' ' ' PHE . . . -40.92 -46.57 2.81 Favored 'General case' 0 CA--C 1.586 2.357 0 N-CA-C 117.455 2.391 . . . . 0.0 117.455 162.953 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 26' ' ' ASN . . . . . . . . . . . . . 77.8 m-20 -86.07 -42.23 14.11 Favored 'General case' 0 N--CA 1.503 2.224 0 N-CA-C 117.168 2.284 . . . . 0.0 117.168 170.896 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 27' ' ' GLY . . . . . . . . . . . . . . . 99.53 57.0 0.95 Allowed Glycine 0 N--CA 1.493 2.455 0 N-CA-C 116.174 1.23 . . . . 0.0 116.174 -159.878 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 28' ' ' ARG . . . . . . . . . . . . . 10.7 ptt-85 -156.33 100.48 1.99 Allowed 'General case' 0 N--CA 1.493 1.688 0 N-CA-C 106.683 -1.599 . . . . 0.0 106.683 176.936 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 29' ' ' SER . . . . . . . . . . . . . 31.6 t -79.92 133.38 36.21 Favored 'General case' 0 N--CA 1.5 2.026 0 O-C-N 119.259 -2.151 . . . . 0.0 108.381 -156.322 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 30' ' ' MET . . . . . . . . . . . . . 25.1 mtp -47.21 -41.01 17.47 Favored 'General case' 0 N--CA 1.501 2.111 0 N-CA-C 119.089 2.996 . . . . 0.0 119.089 -143.371 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 31' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -47.91 -40.72 22.68 Favored 'General case' 0 CA--C 1.593 2.609 0 CA-C-N 125.318 3.69 . . . . 0.0 115.392 166.006 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 32' ' ' SER . . . . . . . . . . . . 0.37 37.4 t -54.25 -72.51 0.06 Allowed 'General case' 0 CA--C 1.576 1.946 0 N-CA-C 118.255 2.687 . . . . 0.0 118.255 145.57 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -57.3 -57.2 13.68 Favored 'General case' 0 N--CA 1.522 3.165 0 CA-C-N 125.382 3.719 . . . . 0.0 116.926 -177.693 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 34' ' ' LEU . . . . . 0.806 HD12 ' CZ ' ' A' ' 7' ' ' PHE . 0.1 OUTLIER -40.59 -55.77 2.25 Favored 'General case' 0 CA--C 1.547 0.833 0 CA-C-O 115.698 -2.096 . . . . 0.0 108.382 169.054 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 35' ' ' LEU . . . . . 0.415 HD23 ' HA ' ' B' ' 35' ' ' LEU . 12.8 mt -59.78 -45.83 91.09 Favored 'General case' 0 C--N 1.367 1.365 0 CA-C-N 122.922 2.601 . . . . 0.0 116.135 175.575 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 36' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -56.12 -56.57 19.29 Favored 'General case' 0 CA--C 1.547 0.834 0 CA-C-O 117.534 -1.222 . . . . 0.0 113.276 175.27 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 37' ' ' ILE . . . . . . . . . . . . . 2.9 tp -63.8 -25.14 37.52 Favored 'Isoleucine or valine' 0 CA--C 1.563 1.461 0 CA-C-O 115.006 -2.426 . . . . 0.0 117.379 169.517 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 38' ' ' VAL . . . . . 0.492 HG21 HD22 ' B' ' 34' ' ' LEU . 3.5 t -83.29 -49.56 16.49 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.069 0 C-N-CA 127.311 2.244 . . . . 0.0 111.335 -177.018 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 26.6 mt-30 -49.66 -45.98 49.23 Favored 'General case' 0 CA--C 1.565 1.54 0 CA-C-O 118.286 -0.864 . . . . 0.0 112.214 154.614 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 40' ' ' ASP . . . . . . . . . . . . 0.343 0.2 OUTLIER -53.25 -41.28 65.31 Favored 'General case' 0 N--CA 1.492 1.636 0 N-CA-C 119.029 2.974 . . . . 0.0 119.029 157.759 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -68.3 -47.37 67.78 Favored 'General case' 0 N--CA 1.486 1.35 0 N-CA-C 114.715 1.376 . . . . 0.0 114.715 -165.646 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 1.4 pp . . . . . 0 CA--C 1.567 1.63 0 N-CA-C 117.794 2.516 . . . . 0.0 117.794 171.708 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 2.1 p30 . . . . . 0 CA--C 1.568 1.64 0 N-CA-C 112.969 0.729 . . . . 0.0 112.969 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 6.0 Cg_exo -100.2 155.35 0.5 Allowed 'Trans proline' 0 CA--C 1.553 1.472 0 C-N-CA 121.974 1.783 . . . . 0.0 113.835 -159.382 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 77.5 m80 -76.37 138.31 40.34 Favored 'General case' 0 CA--C 1.56 1.361 0 CA-C-N 113.664 -1.607 . . . . 0.0 113.479 -178.093 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . 0.809 ' CZ ' HD12 ' B' ' 34' ' ' LEU 0.274 36.2 p90 -116.03 164.56 14.26 Favored 'General case' 0 CA--C 1.561 1.381 0 CA-C-O 123.927 1.822 . . . . 0.0 110.244 117.003 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 26.6 p-10 -82.1 89.34 6.45 Favored 'General case' 0 CA--C 1.564 1.515 0 O-C-N 119.72 -1.863 . . . . 0.0 109.385 161.803 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . 0.598 ' CG ' HD13 ' B' ' 34' ' ' LEU . 9.0 t80 -66.39 167.93 9.75 Favored 'General case' 0 CA--C 1.557 1.24 0 CA-C-O 123.96 1.838 . . . . 0.0 110.334 159.243 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 38.8 tpt85 159.85 110.03 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.482 0 O-C-N 119.411 -2.056 . . . . 0.0 106.128 -116.23 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 2.2 mpt? -119.26 -168.66 0.13 Allowed Pre-proline 0 CA--C 1.576 1.949 0 C-N-CA 120.0 -0.68 . . . . 0.0 112.711 -168.048 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -98.11 161.57 0.81 Allowed 'Trans proline' 0 CA--C 1.566 2.09 0 CA-C-O 123.393 1.331 . . . . 0.0 114.119 133.098 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . 0.441 ' SD ' ' HG3' ' A' ' 17' ' ' GLU . 22.3 tpp -58.86 -33.81 70.89 Favored 'General case' 0 N--CA 1.497 1.911 0 N-CA-C 117.432 2.382 . . . . 0.0 117.432 -162.235 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . 0.25 9.1 pt-20 -62.26 -42.35 99.25 Favored 'General case' 0 N--CA 1.49 1.551 0 N-CA-C 116.39 1.996 . . . . 0.0 116.39 166.043 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.427 ' CG1' HG12 ' B' ' 38' ' ' VAL . 0.4 OUTLIER -61.0 -48.84 87.26 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.211 0 CA-C-N 122.566 2.439 . . . . 0.0 112.872 173.358 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 4.8 ttt180 -71.7 -33.76 69.05 Favored 'General case' 0 CA--C 1.547 0.85 0 CA-C-O 116.153 -1.88 . . . . 0.0 115.635 174.185 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 0.441 ' HG3' ' SD ' ' A' ' 13' ' ' MET . 40.7 mt-10 -59.44 -42.92 93.02 Favored 'General case' 0 N--CA 1.492 1.628 0 CA-C-N 123.986 3.085 . . . . 0.0 114.671 159.997 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . 0.271 39.9 mtmt -63.95 -49.57 72.05 Favored 'General case' 0 CA--C 1.566 1.582 0 CA-C-N 120.724 1.602 . . . . 0.0 115.142 172.054 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.644 ' HG ' ' SD ' ' A' ' 30' ' ' MET 0.303 13.3 tp -67.35 -38.84 85.47 Favored 'General case' 0 CA--C 1.57 1.745 0 C-N-CA 125.824 1.65 . . . . 0.0 114.616 173.173 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 31.9 ttpt -88.0 -25.97 22.86 Favored 'General case' 0 CA--C 1.561 1.403 0 CA-C-O 117.261 -1.352 . . . . 0.0 113.663 -179.743 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 19.1 m-85 -64.04 -74.48 0.1 Allowed 'General case' 0 N--CA 1.489 1.492 0 CA-C-O 112.211 -3.756 . . . . 0.0 109.822 154.104 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . 0.275 6.0 tpp180 -14.31 -60.17 0.01 OUTLIER 'General case' 0 CA--C 1.589 2.468 1 CA-C-N 126.402 4.183 . . . . 0.0 115.473 165.754 . . . . . . . . 3 2 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.513 ' HB2' ' HB3' ' A' ' 33' ' ' GLU . . . -50.38 -78.95 0.02 OUTLIER 'General case' 0 CA--C 1.584 2.257 0 N-CA-C 120.375 3.472 . . . . 0.0 120.375 156.592 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 30.4 mt-10 . . . . . 0 N--CA 1.503 2.201 0 N-CA-C 118.969 2.951 . . . . 0.0 118.969 -179.277 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 75.8 mtm180 . . . . . 0 N--CA 1.497 1.907 0 N-CA-C 105.608 -1.997 . . . . 0.0 105.608 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 35.3 t -121.64 106.01 10.95 Favored 'General case' 0 N--CA 1.502 2.143 0 O-C-N 118.14 -2.85 . . . . 0.0 106.477 -168.346 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' MET . . . . . 0.644 ' SD ' ' HG ' ' A' ' 19' ' ' LEU . 0.0 OUTLIER -38.85 -44.89 1.09 Allowed 'General case' 0 N--CA 1.494 1.729 0 N-CA-C 120.785 3.624 . . . . 0.0 120.785 -140.156 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 6.5 t-20 -45.96 -47.05 16.57 Favored 'General case' 0 CA--C 1.599 2.854 0 O-C-N 117.459 -3.276 . . . . 0.0 114.3 165.552 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . 0.332 31.2 t -47.35 -73.43 0.04 OUTLIER 'General case' 0 N--CA 1.504 2.245 0 N-CA-C 118.069 2.618 . . . . 0.0 118.069 142.929 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . 0.513 ' HB3' ' HB2' ' A' ' 23' ' ' ALA . 8.4 tm-20 -64.17 -55.23 23.24 Favored 'General case' 0 N--CA 1.501 2.103 0 N-CA-C 119.347 3.092 . . . . 0.0 119.347 -172.913 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.752 HD12 ' CZ ' ' B' ' 7' ' ' PHE . 0.2 OUTLIER -36.88 -52.8 0.94 Allowed 'General case' 0 CA--C 1.554 1.116 0 CA-C-O 115.764 -2.065 . . . . 0.0 107.341 163.691 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.471 HD22 HG21 ' B' ' 15' ' ' VAL . 14.0 mt -62.58 -51.99 65.18 Favored 'General case' 0 C--N 1.372 1.561 0 CA-C-N 122.925 2.602 . . . . 0.0 115.896 177.534 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -63.7 -36.05 82.57 Favored 'General case' 0 N--CA 1.484 1.257 0 N-CA-C 114.5 1.296 . . . . 0.0 114.5 -177.824 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 12.7 tt -73.01 -43.26 58.98 Favored 'Isoleucine or valine' 0 C--O 1.189 -2.099 0 CA-C-O 113.108 -3.33 . . . . 0.0 114.198 160.347 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.592 HG21 HD22 ' A' ' 34' ' ' LEU . 3.1 t -65.09 -50.17 75.74 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.647 1 CA-C-N 126.61 4.277 . . . . 0.0 113.888 -177.457 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 38.0 mt-30 -46.49 -57.93 4.25 Favored 'General case' 0 C--N 1.365 1.24 0 CA-C-O 114.131 -2.842 . . . . 0.0 108.949 158.377 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . 0.548 4.6 t70 -36.68 -56.2 0.84 Allowed 'General case' 0 N--CA 1.496 1.827 0 N-CA-C 118.301 2.704 . . . . 0.0 118.301 161.997 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . 0.261 . . . . . . . 0 CA--C 1.544 0.713 0 N-CA-C 118.013 2.597 . . . . 0.0 118.013 -149.2 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 21.7 Cg_exo . . . . . 0 CA--C 1.572 2.412 0 N-CA-C 115.921 1.47 . . . . 0.0 115.921 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' B' B ' 6' ' ' HIS . . . . . . . . . . . . . 80.1 m80 -96.02 145.52 25.38 Favored 'General case' 0 CA--C 1.581 2.153 0 CA-C-N 113.154 -1.839 . . . . 0.0 111.287 177.978 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 7' ' ' PHE . . . . . 0.752 ' CZ ' HD12 ' A' ' 34' ' ' LEU . 2.3 p90 -128.93 162.46 27.51 Favored 'General case' 0 CA--C 1.574 1.868 0 O-C-N 119.188 -2.195 . . . . 0.0 112.838 144.108 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 8' ' ' ASN . . . . . . . . . . . . . 7.9 p-10 -64.05 103.54 0.61 Allowed 'General case' 0 CA--C 1.572 1.789 0 O-C-N 120.153 -1.592 . . . . 0.0 115.134 171.646 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 9' ' ' PHE . . . . . 0.633 ' CG ' HD13 ' A' ' 34' ' ' LEU . 3.7 t80 -126.02 105.72 9.1 Favored 'General case' 0 CA--C 1.539 0.543 0 O-C-N 120.971 -1.08 . . . . 0.0 108.135 160.88 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 10' ' ' ARG . . . . . . . . . . . . 0.467 0.1 OUTLIER 94.64 87.39 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.596 1 O-C-N 114.081 -5.387 . . . . 0.0 109.519 -12.543 . . . . . . . . 4 3 . 1 . 005 nuclear nobuild core ' B' B ' 11' ' ' MET . . . . . 0.599 ' SD ' HD23 ' B' ' 19' ' ' LEU . 8.5 mtm -148.84 123.85 4.94 Favored Pre-proline 0 CA--C 1.566 1.568 0 CA-C-O 117.152 -1.404 . . . . 0.0 110.201 -159.133 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 12' ' ' PRO . . . . . . . . . . . . . 77.9 Cg_exo -40.76 143.16 0.62 Allowed 'Trans proline' 0 C--N 1.371 1.76 0 C-N-CA 123.467 2.778 . . . . 0.0 116.935 162.688 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 13' ' ' MET . . . . . 0.417 ' SD ' ' HG3' ' B' ' 17' ' ' GLU . 15.4 tpp -56.35 -32.47 64.74 Favored 'General case' 0 N--CA 1.493 1.691 0 N-CA-C 118.449 2.759 . . . . 0.0 118.449 -160.712 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 14' ' ' GLU . . . . . . . . . . . . 0.281 10.3 pt-20 -60.47 -50.92 71.64 Favored 'General case' 0 N--CA 1.49 1.534 0 N-CA-C 115.87 1.804 . . . . 0.0 115.87 162.36 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 15' ' ' VAL . . . . . 0.471 HG21 HD22 ' A' ' 35' ' ' LEU . 0.2 OUTLIER -58.35 -45.21 89.57 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.265 0 CA-C-N 122.924 2.602 . . . . 0.0 113.972 177.854 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 1.1 ttt180 -74.98 -34.4 61.99 Favored 'General case' 0 CA--C 1.544 0.727 0 CA-C-O 115.912 -1.994 . . . . 0.0 116.099 173.709 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 17' ' ' GLU . . . . . 0.417 ' HG3' ' SD ' ' B' ' 13' ' ' MET . 43.4 mt-10 -63.61 -39.37 94.2 Favored 'General case' 0 N--CA 1.497 1.886 0 CA-C-N 124.206 3.185 . . . . 0.0 114.052 161.632 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 44.5 mtmt -61.52 -60.55 3.52 Favored 'General case' 0 CA--C 1.568 1.641 0 CA-C-N 120.572 1.533 . . . . 0.0 114.199 169.913 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 19' ' ' LEU . . . . . 0.607 HD21 ' HG ' ' B' ' 34' ' ' LEU . 13.9 tp -60.86 -37.72 83.1 Favored 'General case' 0 N--CA 1.488 1.469 0 N-CA-C 115.249 1.574 . . . . 0.0 115.249 175.324 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 20' ' ' LYS . . . . . . . . . . . . . 19.8 ttpt -85.51 -30.87 23.09 Favored 'General case' 0 CA--C 1.561 1.366 0 CA-C-O 117.242 -1.361 . . . . 0.0 114.252 179.949 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 20.9 m-30 -64.91 -77.04 0.06 Allowed 'General case' 0 N--CA 1.491 1.598 0 CA-C-O 113.193 -3.289 . . . . 0.0 109.668 157.62 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 22' ' ' ARG . . . . . 0.514 ' HE ' HD12 ' B' ' 37' ' ' ILE 0.316 0.0 OUTLIER -19.89 -53.44 0.01 OUTLIER 'General case' 0 CA--C 1.585 2.327 0 CA-C-N 125.776 3.898 . . . . 0.0 116.39 171.022 . . . . . . . . 4 4 . 1 . 005 nuclear nobuild core ' B' B ' 23' ' ' ALA . . . . . 0.498 ' HB2' ' CB ' ' B' ' 33' ' ' GLU . . . -51.85 -80.63 0.01 OUTLIER 'General case' 0 CA--C 1.587 2.395 0 N-CA-C 118.978 2.955 . . . . 0.0 118.978 154.966 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 64.3 mm-40 -65.34 -35.28 80.5 Favored 'General case' 0 N--CA 1.501 2.099 0 N-CA-C 119.123 3.009 . . . . 0.0 119.123 -179.546 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 25' ' ' ALA . . . . . . . . . . . . . . . -39.25 -50.25 1.95 Allowed 'General case' 0 CA--C 1.588 2.43 0 N-CA-C 116.288 1.958 . . . . 0.0 116.288 153.38 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 26' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -95.65 -47.14 6.33 Favored 'General case' 0 CA--C 1.576 1.951 0 N-CA-C 116.592 2.071 . . . . 0.0 116.592 -174.059 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 27' ' ' GLY . . . . . . . . . . . . . . . 128.29 14.86 2.35 Favored Glycine 0 N--CA 1.498 2.822 0 N-CA-C 119.024 2.37 . . . . 0.0 119.024 -161.227 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 28' ' ' ARG . . . . . . . . . . . . . 79.0 mtm-85 -112.26 149.23 32.63 Favored 'General case' 0 N--CA 1.492 1.643 0 N-CA-C 104.779 -2.304 . . . . 0.0 104.779 168.766 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 29' ' ' SER . . . . . . . . . . . . . 92.3 p -117.93 109.58 16.68 Favored 'General case' 0 N--CA 1.503 2.185 0 O-C-N 118.053 -2.905 . . . . 0.0 105.786 -167.89 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 30' ' ' MET . . . . . . . . . . . . . 18.5 mtp -42.35 -42.73 3.27 Favored 'General case' 0 N--CA 1.499 1.985 0 N-CA-C 118.8 2.889 . . . . 0.0 118.8 -140.457 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 31' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -47.02 -42.63 18.53 Favored 'General case' 0 CA--C 1.592 2.586 0 CA-C-N 125.727 3.876 . . . . 0.0 115.556 165.444 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 32' ' ' SER . . . . . . . . . . . . 0.294 32.1 t -53.33 -67.8 0.23 Allowed 'General case' 0 N--CA 1.499 2.002 0 N-CA-C 119.048 2.981 . . . . 0.0 119.048 144.829 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 33' ' ' GLU . . . . . 0.498 ' CB ' ' HB2' ' B' ' 23' ' ' ALA . 0.1 OUTLIER -62.36 -59.85 4.4 Favored 'General case' 0 N--CA 1.513 2.687 0 CA-C-N 124.112 3.142 . . . . 0.0 117.066 -178.569 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 34' ' ' LEU . . . . . 0.809 HD12 ' CZ ' ' A' ' 7' ' ' PHE . 0.1 OUTLIER -34.74 -56.96 0.54 Allowed 'General case' 0 CA--C 1.547 0.832 0 CA-C-O 115.413 -2.232 . . . . 0.0 109.61 164.426 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 35' ' ' LEU . . . . . 0.412 ' HA ' HD23 ' B' ' 35' ' ' LEU . 10.1 mt -61.55 -49.28 77.31 Favored 'General case' 0 C--N 1.367 1.359 0 CA-C-N 123.145 2.702 . . . . 0.0 116.164 177.055 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 36' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -54.92 -52.88 61.58 Favored 'General case' 0 CA--C 1.574 1.901 0 CA-C-O 116.874 -1.536 . . . . 0.0 114.026 173.95 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 37' ' ' ILE . . . . . 0.514 HD12 ' HE ' ' B' ' 22' ' ' ARG . 4.3 tt -64.29 -30.71 50.88 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.861 0 CA-C-N 122.546 2.43 . . . . 0.0 115.957 168.821 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 38' ' ' VAL . . . . . 0.538 HG13 HD22 ' A' ' 19' ' ' LEU . 3.5 t -73.96 -46.75 45.19 Favored 'Isoleucine or valine' 0 CA--C 1.575 1.923 0 CA-C-N 121.441 1.928 . . . . 0.0 110.967 -179.71 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 31.2 mt-30 -52.08 -43.07 63.68 Favored 'General case' 0 CA--C 1.572 1.801 0 N-CA-C 114.13 1.159 . . . . 0.0 114.13 155.413 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 40' ' ' ASP . . . . . . . . . . . . 0.385 15.6 m-20 -53.53 -42.01 66.99 Favored 'General case' 0 N--CA 1.495 1.817 0 N-CA-C 116.782 2.141 . . . . 0.0 116.782 156.055 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 41' ' ' ALA . . . . . 0.505 ' HB3' ' HA ' ' B' ' 38' ' ' VAL . . . -70.34 -38.2 74.82 Favored 'General case' 0 CA--C 1.562 1.427 0 N-CA-C 115.27 1.581 . . . . 0.0 115.27 -171.609 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 42' ' ' LEU . . . . . 0.493 HD11 ' HB2' ' A' ' 19' ' ' LEU . 3.8 mt . . . . . 0 CA--C 1.565 1.535 0 C-N-CA 125.635 1.574 . . . . 0.0 114.258 174.066 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 6.7 p-10 . . . . . 0 CA--C 1.567 1.601 0 CA-C-O 119.226 -0.416 . . . . 0.0 111.155 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 5.5 Cg_exo -100.19 146.1 0.39 Allowed 'Trans proline' 0 C--N 1.366 1.476 0 C-N-CA 122.065 1.844 . . . . 0.0 112.618 -160.58 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 66.1 m80 -68.31 146.79 52.96 Favored 'General case' 0 N--CA 1.485 1.294 0 N-CA-C 114.415 1.265 . . . . 0.0 114.415 -179.971 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . 0.846 ' CZ ' HD12 ' B' ' 34' ' ' LEU . 20.2 p90 -138.62 160.12 40.4 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 120.918 -1.114 . . . . 0.0 112.336 135.275 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 21.1 m120 -55.22 100.81 0.04 OUTLIER 'General case' 0 CA--C 1.572 1.808 0 N-CA-C 114.869 1.433 . . . . 0.0 114.869 174.168 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . 0.643 ' CD2' HD13 ' B' ' 34' ' ' LEU . 10.1 t80 -130.97 103.78 6.74 Favored 'General case' 0 C--N 1.34 0.179 0 N-CA-C 106.685 -1.598 . . . . 0.0 106.685 165.479 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . 0.495 0.0 OUTLIER 88.42 68.66 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.691 1 O-C-N 114.367 -5.208 . . . . 0.0 112.533 -9.774 . . . . . . . . 4 3 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' MET . . . . . 0.611 ' SD ' HD23 ' A' ' 19' ' ' LEU . 8.4 ptp -144.02 116.77 5.71 Favored Pre-proline 0 CA--C 1.571 1.779 0 CA-C-O 115.114 -2.374 . . . . 0.0 109.27 -164.545 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 63.3 Cg_exo -34.69 143.94 0.06 OUTLIER 'Trans proline' 0 C--N 1.379 2.176 0 C-N-CA 124.667 3.578 . . . . 0.0 119.631 -172.564 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . 0.408 ' SD ' ' HG3' ' A' ' 17' ' ' GLU . 4.4 tpp -44.35 -41.59 6.2 Favored 'General case' 0 CA--C 1.581 2.141 0 N-CA-C 116.598 2.073 . . . . 0.0 116.598 -161.042 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -63.43 -44.29 95.01 Favored 'General case' 0 CA--C 1.571 1.788 0 N-CA-C 117.379 2.363 . . . . 0.0 117.379 167.979 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 1.6 t -54.56 -45.15 71.21 Favored 'Isoleucine or valine' 0 N--CA 1.513 2.705 0 CA-C-N 122.935 2.607 . . . . 0.0 113.301 169.63 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 7.1 ttt180 -74.87 -43.25 55.43 Favored 'General case' 0 C--O 1.212 -0.918 0 CA-C-O 116.107 -1.902 . . . . 0.0 115.093 174.908 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 0.408 ' HG3' ' SD ' ' A' ' 13' ' ' MET . 47.9 mt-10 -58.26 -32.1 68.05 Favored 'General case' 0 N--CA 1.493 1.681 0 CA-C-N 124.126 3.148 . . . . 0.0 115.266 163.296 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . 0.292 54.1 mtmt -67.82 -54.0 22.52 Favored 'General case' 0 CA--C 1.564 1.516 0 CA-C-N 121.112 1.778 . . . . 0.0 114.737 166.182 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.663 HD21 ' HG ' ' A' ' 34' ' ' LEU 0.288 14.9 tp -67.08 -33.84 76.37 Favored 'General case' 0 CA--C 1.574 1.874 0 N-CA-C 115.254 1.576 . . . . 0.0 115.254 175.632 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.496 ' HB2' ' SD ' ' A' ' 30' ' ' MET . 15.0 ttpt -91.71 -28.58 17.34 Favored 'General case' 0 CA--C 1.555 1.162 0 C-N-CA 126.788 2.035 . . . . 0.0 114.143 -178.671 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 22.1 m-30 -63.18 -71.21 0.17 Allowed 'General case' 0 N--CA 1.49 1.526 0 CA-C-O 113.265 -3.255 . . . . 0.0 109.383 153.841 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . 0.304 0.0 OUTLIER -25.09 -53.35 0.04 OUTLIER 'General case' 0 CA--C 1.587 2.399 0 CA-C-N 125.71 3.868 . . . . 0.0 116.158 171.393 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.524 ' HB2' ' HB3' ' A' ' 33' ' ' GLU . . . -50.61 -79.22 0.02 OUTLIER 'General case' 0 CA--C 1.585 2.296 0 N-CA-C 119.806 3.261 . . . . 0.0 119.806 154.557 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 75.2 mm-40 . . . . . 0 N--CA 1.499 2.007 0 N-CA-C 118.809 2.892 . . . . 0.0 118.809 -177.251 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 32.4 mtm-85 . . . . . 0 N--CA 1.492 1.653 0 CA-C-O 122.42 1.105 . . . . 0.0 108.17 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 8.6 t -123.76 116.78 23.57 Favored 'General case' 0 N--CA 1.496 1.841 0 N-CA-C 105.206 -2.146 . . . . 0.0 105.206 -177.952 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' MET . . . . . 0.496 ' SD ' ' HB2' ' A' ' 20' ' ' LYS . 13.2 mtp -43.38 -42.57 4.7 Favored 'General case' 0 N--CA 1.497 1.908 0 N-CA-C 119.101 3.0 . . . . 0.0 119.101 -143.886 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . 0.258 0.1 OUTLIER -48.09 -41.97 27.65 Favored 'General case' 0 CA--C 1.592 2.594 0 CA-C-N 125.255 3.661 . . . . 0.0 114.957 166.522 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . 0.333 34.8 t -52.6 -64.04 0.95 Allowed 'General case' 0 N--CA 1.499 2.005 0 N-CA-C 120.507 3.521 . . . . 0.0 120.507 145.569 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . 0.524 ' HB3' ' HB2' ' A' ' 23' ' ' ALA . 2.8 tp10 -72.48 -53.24 12.66 Favored 'General case' 0 N--CA 1.512 2.639 0 CA-C-N 123.461 2.846 . . . . 0.0 117.852 -177.523 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.663 ' HG ' HD21 ' A' ' 19' ' ' LEU . 0.2 OUTLIER -38.47 -54.18 1.5 Allowed 'General case' 0 CA--C 1.554 1.133 0 CA-C-O 115.773 -2.06 . . . . 0.0 109.429 162.097 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.518 HD21 ' HG2' ' B' ' 11' ' ' MET . 15.1 mt -63.38 -54.96 28.66 Favored 'General case' 0 C--N 1.37 1.481 0 CA-C-N 123.51 2.868 . . . . 0.0 114.935 176.398 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -52.4 -44.32 65.29 Favored 'General case' 0 CA--C 1.564 1.512 0 CA-C-O 116.818 -1.563 . . . . 0.0 115.04 175.868 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -68.58 -41.08 82.71 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.533 0 CA-C-N 121.946 2.157 . . . . 0.0 114.532 169.928 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.407 HG21 HD22 ' A' ' 34' ' ' LEU . 3.8 t -71.76 -46.24 62.37 Favored 'Isoleucine or valine' 0 CA--C 1.583 2.218 0 CA-C-N 121.393 1.906 . . . . 0.0 111.241 -178.108 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 26.5 mt-30 -51.8 -43.05 62.92 Favored 'General case' 0 N--CA 1.488 1.465 0 C-N-CA 124.65 1.18 . . . . 0.0 114.134 156.261 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . 0.459 24.2 m-20 -46.5 -56.47 5.93 Favored 'General case' 0 N--CA 1.488 1.461 0 N-CA-C 114.225 1.195 . . . . 0.0 114.225 155.622 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . 0.362 . . . . . . . 0 CA--C 1.543 0.704 0 N-CA-C 118.526 2.787 . . . . 0.0 118.526 -154.634 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 5' ' ' PRO . . . . . . . . . . . . 0.619 7.6 Cg_exo . . . . . 0 N--CA 1.492 1.407 1 N-CA-C 126.262 5.447 . . . . 0.0 126.262 . . . . . . . . . 2 1 . 1 . 006 nuclear nobuild core ' B' B ' 6' ' ' HIS . . . . . . . . . . . . . 64.9 m80 -75.17 111.73 10.71 Favored 'General case' 0 CA--C 1.564 1.503 0 N-CA-C 115.508 1.67 . . . . 0.0 115.508 -149.396 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 7' ' ' PHE . . . . . 0.607 ' CZ ' HD12 ' A' ' 34' ' ' LEU 0.292 30.7 p90 -122.09 -166.22 1.37 Allowed 'General case' 0 CA--C 1.563 1.462 0 O-C-N 120.35 -1.469 . . . . 0.0 108.919 128.772 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 8' ' ' ASN . . . . . . . . . . . . . 34.6 m-20 -116.09 105.65 12.85 Favored 'General case' 0 CA--C 1.555 1.166 0 O-C-N 120.102 -1.624 . . . . 0.0 107.37 166.598 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 9' ' ' PHE . . . . . 0.632 ' CE2' HD22 ' A' ' 34' ' ' LEU 0.25 5.0 t80 -71.75 92.72 1.22 Allowed 'General case' 0 CA--C 1.576 1.977 0 CA-C-O 126.676 3.131 . . . . 0.0 113.256 176.126 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 10' ' ' ARG . . . . . . . . . . . . . 28.5 ptt85 -81.9 130.14 34.98 Favored 'General case' 0 N--CA 1.48 1.05 1 CA-C-N 108.291 -4.05 . . . . 0.0 111.256 168.498 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 11' ' ' MET . . . . . 0.551 ' HE2' ' CD2' ' B' ' 9' ' ' PHE . 28.3 mtm -136.44 121.91 13.31 Favored Pre-proline 0 CA--C 1.565 1.527 0 CA-C-O 117.509 -1.234 . . . . 0.0 111.7 -163.703 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 12' ' ' PRO . . . . . . . . . . . . . 80.3 Cg_exo -43.66 145.03 1.95 Allowed 'Trans proline' 0 C--N 1.378 2.123 0 C-N-CA 123.913 3.076 . . . . 0.0 116.02 169.23 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 13' ' ' MET . . . . . . . . . . . . . 15.7 tpp -60.8 -34.06 73.93 Favored 'General case' 0 N--CA 1.492 1.655 0 N-CA-C 117.083 2.253 . . . . 0.0 117.083 -150.559 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -59.7 -49.31 78.23 Favored 'General case' 0 CA--C 1.573 1.861 0 N-CA-C 117.688 2.477 . . . . 0.0 117.688 161.335 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -58.28 -48.06 85.91 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.453 0 CA-C-N 123.369 2.804 . . . . 0.0 113.331 174.253 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 4.2 ttt180 -71.21 -37.23 72.08 Favored 'General case' 0 C--O 1.216 -0.703 0 CA-C-O 115.951 -1.976 . . . . 0.0 115.519 173.024 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 17' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -60.6 -35.81 77.02 Favored 'General case' 0 CA--C 1.569 1.709 0 CA-C-N 124.119 3.145 . . . . 0.0 114.185 161.578 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . 0.291 44.1 mtmt -67.79 -48.71 65.54 Favored 'General case' 0 CA--C 1.566 1.574 0 CA-C-N 121.443 1.929 . . . . 0.0 115.483 169.55 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 19' ' ' LEU . . . . . 0.451 ' HB3' ' CE ' ' B' ' 30' ' ' MET 0.278 0.4 OUTLIER -70.49 -36.29 73.73 Favored 'General case' 0 CA--C 1.574 1.891 0 CA-C-N 120.904 1.684 . . . . 0.0 115.06 173.604 . . . . . . . . 4 4 . 1 . 006 nuclear nobuild core ' B' B ' 20' ' ' LYS . . . . . 0.439 ' HB2' ' SD ' ' B' ' 30' ' ' MET . 15.8 ttpt -88.34 -27.89 21.35 Favored 'General case' 0 CA--C 1.555 1.168 0 C-N-CA 125.822 1.649 . . . . 0.0 113.682 178.729 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 22.1 m-30 -64.09 -72.89 0.13 Allowed 'General case' 0 N--CA 1.49 1.545 1 CA-C-O 111.469 -4.11 . . . . 0.0 109.598 156.052 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . 0.253 12.0 tpp180 -13.19 -61.04 0.01 OUTLIER 'General case' 0 CA--C 1.592 2.558 1 CA-C-N 127.07 4.487 . . . . 0.0 116.34 164.519 . . . . . . . . 3 2 . 1 . 006 nuclear nobuild core ' B' B ' 23' ' ' ALA . . . . . 0.426 ' HB2' ' CB ' ' B' ' 33' ' ' GLU . . . -54.96 -75.86 0.03 OUTLIER 'General case' 0 CA--C 1.59 2.486 0 N-CA-C 119.29 3.07 . . . . 0.0 119.29 160.561 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 52.6 mt-10 -68.46 -34.77 76.54 Favored 'General case' 0 N--CA 1.504 2.263 0 N-CA-C 118.819 2.896 . . . . 0.0 118.819 -179.345 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 25' ' ' ALA . . . . . . . . . . . . . . . -38.31 -46.87 1.15 Allowed 'General case' 0 CA--C 1.579 2.062 0 N-CA-C 115.973 1.842 . . . . 0.0 115.973 152.321 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 26' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -98.66 -51.21 3.99 Favored 'General case' 0 CA--C 1.577 1.984 0 N-CA-C 117.458 2.392 . . . . 0.0 117.458 -173.651 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 27' ' ' GLY . . . . . . . . . . . . . . . 117.69 23.47 3.68 Favored Glycine 0 CA--C 1.563 3.082 0 N-CA-C 119.575 2.59 . . . . 0.0 119.575 -151.251 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 28' ' ' ARG . . . . . 0.517 HH21 ' HG3' ' B' ' 36' ' ' GLN . 16.8 mtt85 -112.47 147.44 36.52 Favored 'General case' 0 CA--C 1.572 1.821 0 N-CA-C 103.769 -2.678 . . . . 0.0 103.769 158.984 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 29' ' ' SER . . . . . . . . . . . . . 35.6 t -113.42 112.18 23.2 Favored 'General case' 0 N--CA 1.505 2.302 0 O-C-N 117.793 -3.067 . . . . 0.0 105.67 -172.884 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 30' ' ' MET . . . . . 0.451 ' CE ' ' HB3' ' B' ' 19' ' ' LEU . 22.7 mtp -40.65 -45.61 2.4 Favored 'General case' 0 N--CA 1.5 2.038 0 N-CA-C 118.822 2.897 . . . . 0.0 118.822 -144.364 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 31' ' ' ASN . . . . . . . . . . . . . 20.0 t-20 -44.44 -44.03 8.18 Favored 'General case' 0 CA--C 1.594 2.673 0 CA-C-N 125.494 3.77 . . . . 0.0 115.576 165.045 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 32' ' ' SER . . . . . . . . . . . . 0.279 56.3 m -57.36 -60.42 3.67 Favored 'General case' 0 N--CA 1.5 2.034 0 N-CA-C 120.7 3.593 . . . . 0.0 120.7 148.464 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 33' ' ' GLU . . . . . 0.426 ' CB ' ' HB2' ' B' ' 23' ' ' ALA . 0.1 OUTLIER -67.49 -61.64 1.8 Allowed 'General case' 0 N--CA 1.51 2.542 0 CA-C-N 123.666 2.939 . . . . 0.0 115.293 177.667 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 34' ' ' LEU . . . . . 0.846 HD12 ' CZ ' ' A' ' 7' ' ' PHE . 0.0 OUTLIER -32.17 -53.78 0.3 Allowed 'General case' 0 N--CA 1.481 1.091 0 CA-C-O 115.289 -2.291 . . . . 0.0 109.266 163.967 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 35' ' ' LEU . . . . . 0.59 HD21 ' HB2' ' A' ' 11' ' ' MET . 11.8 mt -62.28 -54.42 41.01 Favored 'General case' 0 C--N 1.368 1.382 0 CA-C-N 123.528 2.876 . . . . 0.0 115.053 176.275 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 36' ' ' GLN . . . . . 0.517 ' HG3' HH21 ' B' ' 28' ' ' ARG . 0.9 OUTLIER -59.86 -39.46 85.29 Favored 'General case' 0 CA--C 1.569 1.679 0 CA-C-O 116.302 -1.809 . . . . 0.0 115.582 175.479 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 37' ' ' ILE . . . . . 0.454 ' HA ' ' HB3' ' B' ' 40' ' ' ASP . 10.4 tt -68.55 -26.3 33.02 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.622 0 CA-C-N 123.452 2.842 . . . . 0.0 115.253 162.668 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 38' ' ' VAL . . . . . 0.507 ' CG1' HD22 ' A' ' 19' ' ' LEU . 4.3 t -86.68 -47.05 16.36 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.094 0 CA-C-N 125.037 3.562 . . . . 0.0 112.77 -178.891 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 27.8 mt-30 -46.07 -49.37 16.5 Favored 'General case' 0 N--CA 1.484 1.269 0 CA-C-O 116.119 -1.896 . . . . 0.0 113.068 150.961 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 40' ' ' ASP . . . . . 0.454 ' HB3' ' HA ' ' B' ' 37' ' ' ILE 0.374 50.1 t0 -44.01 -61.3 1.5 Allowed 'General case' 0 N--CA 1.494 1.76 0 CA-C-N 120.892 1.678 . . . . 0.0 114.638 154.533 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -82.62 19.21 1.33 Allowed 'General case' 0 CA--C 1.55 0.98 0 N-CA-C 120.556 3.539 . . . . 0.0 120.556 -162.39 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.484 1.232 0 N-CA-C 116.358 1.985 . . . . 0.0 116.358 143.772 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 . . . . . 0 CA--C 1.57 1.717 0 N-CA-C 108.12 -1.067 . . . . 0.0 108.12 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 5.7 Cg_exo -99.74 146.61 0.45 Allowed 'Trans proline' 0 C--N 1.366 1.473 0 CA-C-N 122.688 1.996 . . . . 0.0 113.782 -154.049 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 73.5 m80 -67.56 137.35 55.64 Favored 'General case' 0 CA--C 1.564 1.508 0 CA-C-N 114.377 -1.283 . . . . 0.0 113.383 173.031 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . 0.726 ' CZ ' HD12 ' B' ' 34' ' ' LEU 0.267 27.5 p90 -120.52 167.74 12.08 Favored 'General case' 0 CA--C 1.562 1.415 0 O-C-N 119.557 -1.965 . . . . 0.0 110.576 115.314 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 98.5 m-20 -89.99 90.87 8.34 Favored 'General case' 0 N--CA 1.487 1.411 0 O-C-N 119.695 -1.878 . . . . 0.0 108.059 166.365 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . 0.658 ' CD2' HD13 ' B' ' 34' ' ' LEU . 8.5 t80 -63.67 150.77 43.57 Favored 'General case' 0 CA--C 1.557 1.217 0 CA-C-O 125.457 2.551 . . . . 0.0 112.344 168.749 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -154.32 94.55 1.73 Allowed 'General case' 0 C--N 1.307 -1.28 0 CA-C-N 111.616 -2.538 . . . . 0.0 107.825 -139.539 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' MET . . . . . 0.504 ' SD ' ' CD2' ' A' ' 9' ' ' PHE . 0.8 OUTLIER -114.77 115.59 43.71 Favored Pre-proline 0 CA--C 1.56 1.352 0 CA-C-O 117.219 -1.372 . . . . 0.0 111.785 -158.796 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 80.8 Cg_exo -42.47 140.61 2.55 Favored 'Trans proline' 0 CA--C 1.56 1.81 0 C-N-CA 122.79 2.327 . . . . 0.0 115.772 161.233 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . 0.409 ' SD ' ' HG3' ' A' ' 17' ' ' GLU . 22.9 tpp -55.68 -32.36 63.19 Favored 'General case' 0 N--CA 1.492 1.668 0 N-CA-C 118.376 2.732 . . . . 0.0 118.376 -157.671 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . 0.256 9.4 pt-20 -60.9 -46.49 90.45 Favored 'General case' 0 CA--C 1.568 1.66 0 N-CA-C 116.568 2.062 . . . . 0.0 116.568 162.186 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.432 ' CG1' HG12 ' B' ' 38' ' ' VAL . 0.6 OUTLIER -57.24 -49.6 79.35 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.234 0 CA-C-N 122.925 2.602 . . . . 0.0 112.82 172.7 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 1.4 ttt180 -72.39 -33.95 67.56 Favored 'General case' 0 C--O 1.216 -0.703 0 CA-C-O 116.086 -1.911 . . . . 0.0 115.433 175.39 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 0.409 ' HG3' ' SD ' ' A' ' 13' ' ' MET . 39.6 mt-10 -61.89 -40.32 95.01 Favored 'General case' 0 CA--C 1.566 1.563 0 CA-C-N 124.062 3.119 . . . . 0.0 114.53 161.093 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . 0.255 46.3 mtmt -67.92 -48.5 65.79 Favored 'General case' 0 CA--C 1.564 1.484 0 CA-C-N 121.577 1.989 . . . . 0.0 115.366 173.024 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.614 ' HB3' ' CE ' ' A' ' 30' ' ' MET 0.365 0.2 OUTLIER -68.16 -37.3 80.86 Favored 'General case' 0 CA--C 1.574 1.876 0 C-N-CA 124.791 1.236 . . . . 0.0 112.461 172.362 . . . . . . . . 4 4 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.523 ' HA ' ' HB3' ' A' ' 23' ' ' ALA . 27.8 ttpt -90.17 -22.83 21.52 Favored 'General case' 0 CA--C 1.567 1.612 0 O-C-N 119.155 -2.216 . . . . 0.0 115.382 179.534 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 14.8 m-85 -62.8 -68.02 0.37 Allowed 'General case' 0 N--CA 1.492 1.657 0 CA-C-O 114.009 -2.901 . . . . 0.0 110.511 151.88 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.417 ' HE ' HG13 ' A' ' 37' ' ' ILE 0.349 32.2 ttt85 -28.45 -45.19 0.03 OUTLIER 'General case' 0 CA--C 1.601 2.933 0 CA-C-N 125.682 3.856 . . . . 0.0 116.917 166.635 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.523 ' HB3' ' HA ' ' A' ' 20' ' ' LYS 0.288 . . -54.2 -80.29 0.02 OUTLIER 'General case' 0 CA--C 1.58 2.103 0 N-CA-C 118.111 2.634 . . . . 0.0 118.111 153.796 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 51.8 mm-40 . . . . . 0 CA--C 1.578 2.049 0 N-CA-C 118.742 2.867 . . . . 0.0 118.742 -178.3 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 75.7 mtm180 . . . . . 0 CA--C 1.576 1.975 0 N-CA-C 104.308 -2.479 . . . . 0.0 104.308 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 77.3 p -126.03 109.85 12.88 Favored 'General case' 0 N--CA 1.509 2.508 0 O-C-N 117.47 -3.269 . . . . 0.0 107.654 -171.822 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' MET . . . . . 0.614 ' CE ' ' HB3' ' A' ' 19' ' ' LEU . 0.1 OUTLIER -45.56 -38.52 6.53 Favored 'General case' 0 N--CA 1.496 1.863 0 N-CA-C 120.265 3.432 . . . . 0.0 120.265 -137.739 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 11.0 t-20 -47.3 -46.51 25.14 Favored 'General case' 0 CA--C 1.597 2.771 0 CA-C-N 124.931 3.514 . . . . 0.0 114.411 163.808 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . 0.314 17.5 t -48.77 -76.22 0.02 OUTLIER 'General case' 0 N--CA 1.5 2.05 0 N-CA-C 117.582 2.438 . . . . 0.0 117.582 143.923 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . 0.458 ' HB3' ' HB2' ' A' ' 23' ' ' ALA . 10.6 tm-20 -60.74 -53.58 55.66 Favored 'General case' 0 N--CA 1.506 2.351 0 CA-C-N 123.559 2.89 . . . . 0.0 118.745 -172.104 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.644 HD13 ' CG ' ' B' ' 9' ' ' PHE . 0.2 OUTLIER -42.99 -53.98 4.49 Favored 'General case' 0 CA--C 1.567 1.618 0 CA-C-O 115.699 -2.096 . . . . 0.0 106.244 167.52 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.481 ' HG ' ' CE1' ' B' ' 9' ' ' PHE . 19.7 mt -62.93 -44.56 95.75 Favored 'General case' 0 C--N 1.375 1.701 0 CA-C-N 124.093 3.133 . . . . 0.0 115.759 177.545 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . 0.437 ' O ' ' HB2' ' A' ' 40' ' ' ASP . 0.0 OUTLIER -61.47 -44.46 97.06 Favored 'General case' 0 N--CA 1.48 1.046 0 CA-C-O 115.632 -2.128 . . . . 0.0 113.8 177.892 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . 0.417 HG13 ' HE ' ' A' ' 22' ' ' ARG . 0.4 OUTLIER -69.79 -35.12 63.74 Favored 'Isoleucine or valine' 0 CA--C 1.564 1.504 0 CA-C-N 121.278 1.853 . . . . 0.0 115.027 165.95 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.584 HG21 HD22 ' A' ' 34' ' ' LEU . 6.6 t -76.51 -46.56 31.55 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.839 0 CA-C-N 121.93 2.15 . . . . 0.0 111.641 -173.147 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 14.0 tp60 -62.61 -36.77 83.82 Favored 'General case' 0 CA--C 1.567 1.613 0 O-C-N 121.142 -0.974 . . . . 0.0 112.957 160.58 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . 0.437 ' HB2' ' O ' ' A' ' 36' ' ' GLN 0.446 0.3 OUTLIER -41.35 -53.4 3.3 Favored 'General case' 0 N--CA 1.502 2.164 0 N-CA-C 116.467 2.025 . . . . 0.0 116.467 149.101 . . . . . . . . 4 4 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . 0.408 ' HB3' ' HA ' ' A' ' 38' ' ' VAL . . . . . . . . 0 CA--C 1.553 1.092 0 N-CA-C 118.031 2.604 . . . . 0.0 118.031 -164.722 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 7.3 Cg_exo . . . . . 0 CA--C 1.553 1.442 0 N-CA-C 115.514 1.313 . . . . 0.0 115.514 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' B' B ' 6' ' ' HIS . . . . . . . . . . . . . 80.3 m80 -79.51 126.19 30.55 Favored 'General case' 0 CA--C 1.566 1.575 0 CA-C-N 113.99 -1.459 . . . . 0.0 112.277 175.278 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 7' ' ' PHE . . . . . 0.591 ' CZ ' HD12 ' A' ' 34' ' ' LEU . 0.8 OUTLIER -128.93 155.61 45.04 Favored 'General case' 0 CA--C 1.567 1.609 0 O-C-N 120.655 -1.278 . . . . 0.0 111.067 154.322 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 8' ' ' ASN . . . . . . . . . . . . . 6.7 p-10 -59.18 103.27 0.17 Allowed 'General case' 0 CA--C 1.575 1.904 0 N-CA-C 115.709 1.744 . . . . 0.0 115.709 171.15 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 9' ' ' PHE . . . . . 0.644 ' CG ' HD13 ' A' ' 34' ' ' LEU . 2.6 t80 -126.49 104.95 8.42 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 124.515 1.126 . . . . 0.0 108.557 158.365 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 10' ' ' ARG . . . . . . . . . . . . 0.472 34.8 tpt85 97.66 83.55 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.784 1 O-C-N 113.746 -5.596 . . . . 0.0 111.297 -19.161 . . . . . . . . 3 2 . 1 . 007 nuclear nobuild core ' B' B ' 11' ' ' MET . . . . . 0.455 ' HG2' HD21 ' A' ' 35' ' ' LEU . 16.1 mtt -151.5 130.13 6.25 Favored Pre-proline 0 CA--C 1.567 1.621 0 CA-C-O 117.26 -1.352 . . . . 0.0 110.46 -155.842 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 12' ' ' PRO . . . . . . . . . . . . . 83.8 Cg_exo -43.92 147.87 1.16 Allowed 'Trans proline' 0 CA--C 1.559 1.734 0 C-N-CA 123.172 2.582 . . . . 0.0 117.971 168.101 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 13' ' ' MET . . . . . . . . . . . . . 2.0 tpt -47.27 -39.84 15.4 Favored 'General case' 0 CA--C 1.575 1.917 0 N-CA-C 117.867 2.543 . . . . 0.0 117.867 -166.393 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -63.85 -50.92 66.97 Favored 'General case' 0 N--CA 1.487 1.421 0 N-CA-C 116.722 2.119 . . . . 0.0 116.722 171.15 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 15' ' ' VAL . . . . . 0.466 HG12 HG12 ' A' ' 38' ' ' VAL . 0.0 OUTLIER -59.35 -51.15 76.04 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.612 0 CA-C-N 121.145 1.793 . . . . 0.0 113.65 176.522 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -67.0 -31.63 72.32 Favored 'General case' 0 CA--C 1.547 0.847 0 CA-C-O 115.987 -1.959 . . . . 0.0 116.266 170.811 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 17' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -60.23 -47.47 85.82 Favored 'General case' 0 N--CA 1.492 1.629 0 CA-C-N 123.775 2.989 . . . . 0.0 113.822 160.691 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . 0.671 3.9 pttt -72.13 -35.43 69.1 Favored 'General case' 0 CA--C 1.568 1.641 0 N-CA-C 118.359 2.726 . . . . 0.0 118.359 177.459 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 19' ' ' LEU . . . . . 0.646 ' HB3' ' HE1' ' B' ' 30' ' ' MET 0.361 0.4 OUTLIER -68.81 -40.13 79.7 Favored 'General case' 0 CA--C 1.587 2.37 0 O-C-N 120.753 -1.217 . . . . 0.0 113.637 164.568 . . . . . . . . 4 4 . 1 . 007 nuclear nobuild core ' B' B ' 20' ' ' LYS . . . . . . . . . . . . . 28.8 ttpt -88.75 -30.39 19.09 Favored 'General case' 0 CA--C 1.56 1.358 0 O-C-N 120.135 -1.603 . . . . 0.0 115.09 -177.368 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 35.5 m-85 -58.52 -69.61 0.18 Allowed 'General case' 0 N--CA 1.49 1.526 0 CA-C-O 112.211 -3.757 . . . . 0.0 110.387 153.708 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . 0.295 23.5 ttt180 -21.99 -56.76 0.03 OUTLIER 'General case' 0 CA--C 1.589 2.46 1 CA-C-N 126.717 4.326 . . . . 0.0 116.579 168.219 . . . . . . . . 3 2 . 1 . 007 nuclear nobuild core ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -51.99 -71.94 0.06 Allowed 'General case' 0 CA--C 1.575 1.927 0 N-CA-C 121.199 3.778 . . . . 0.0 121.199 157.544 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 66.7 mm-40 -73.25 -32.11 64.52 Favored 'General case' 0 N--CA 1.497 1.917 0 N-CA-C 118.019 2.6 . . . . 0.0 118.019 -177.996 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 25' ' ' ALA . . . . . . . . . . . . . . . -41.71 -48.36 4.17 Favored 'General case' 0 CA--C 1.578 2.023 0 N-CA-C 116.775 2.139 . . . . 0.0 116.775 151.462 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 26' ' ' ASN . . . . . . . . . . . . 0.253 0.1 OUTLIER -93.82 -41.2 9.77 Favored 'General case' 0 CA--C 1.581 2.169 0 N-CA-C 116.862 2.171 . . . . 0.0 116.862 -179.349 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 27' ' ' GLY . . . . . . . . . . . . . . . 113.94 49.98 0.52 Allowed Glycine 0 N--CA 1.497 2.72 0 N-CA-C 116.152 1.221 . . . . 0.0 116.152 -167.218 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 28' ' ' ARG . . . . . . . . . . . . . 5.2 ttt85 -156.24 86.95 1.03 Allowed 'General case' 0 N--CA 1.496 1.837 0 N-CA-C 106.817 -1.549 . . . . 0.0 106.817 -164.826 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 29' ' ' SER . . . . . . . . . . . . . 12.3 t -81.9 129.57 34.8 Favored 'General case' 0 N--CA 1.5 2.027 0 O-C-N 118.58 -2.575 . . . . 0.0 107.747 -150.95 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 30' ' ' MET . . . . . 0.646 ' HE1' ' HB3' ' B' ' 19' ' ' LEU . 0.0 OUTLIER -46.62 -39.79 11.84 Favored 'General case' 0 N--CA 1.496 1.871 0 N-CA-C 119.546 3.165 . . . . 0.0 119.546 -143.349 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 31' ' ' ASN . . . . . . . . . . . . 0.261 0.1 OUTLIER -48.55 -39.38 23.37 Favored 'General case' 0 CA--C 1.589 2.456 0 CA-C-N 125.781 3.9 . . . . 0.0 114.997 166.332 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 32' ' ' SER . . . . . . . . . . . . 0.319 33.5 t -56.77 -67.19 0.33 Allowed 'General case' 0 CA--C 1.576 1.952 0 N-CA-C 119.39 3.108 . . . . 0.0 119.39 147.385 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . 0.25 6.2 tp10 -66.23 -55.1 17.83 Favored 'General case' 0 N--CA 1.52 3.068 0 CA-C-N 124.963 3.529 . . . . 0.0 115.809 -178.298 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 34' ' ' LEU . . . . . 0.726 HD12 ' CZ ' ' A' ' 7' ' ' PHE . 0.1 OUTLIER -39.71 -54.91 2.0 Favored 'General case' 0 CA--C 1.553 1.086 0 CA-C-O 115.057 -2.401 . . . . 0.0 108.086 167.239 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 35' ' ' LEU . . . . . . . . . . . . . 11.6 mt -63.08 -54.66 34.5 Favored 'General case' 0 C--N 1.373 1.622 0 CA-C-N 124.485 3.312 . . . . 0.0 115.124 177.533 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 36' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -56.59 -38.13 71.59 Favored 'General case' 0 CA--C 1.566 1.592 0 N-CA-C 115.484 1.661 . . . . 0.0 115.484 177.858 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 37' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -69.66 -38.05 75.48 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.474 0 N-CA-C 115.658 1.725 . . . . 0.0 115.658 164.885 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 38' ' ' VAL . . . . . 0.477 HG21 HD22 ' B' ' 34' ' ' LEU . 3.1 t -73.83 -48.07 40.87 Favored 'Isoleucine or valine' 0 CA--C 1.577 1.989 0 C-N-CA 127.14 2.176 . . . . 0.0 111.732 -178.849 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -47.17 -51.44 18.28 Favored 'General case' 0 CA--C 1.556 1.208 0 CA-C-O 117.508 -1.234 . . . . 0.0 113.427 153.416 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 40' ' ' ASP . . . . . . . . . . . . 0.936 0.5 OUTLIER -52.14 -37.41 54.32 Favored 'General case' 0 CA--C 1.573 1.833 0 N-CA-C 118.879 2.918 . . . . 0.0 118.879 160.706 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 41' ' ' ALA . . . . . 0.428 ' HB3' ' HA ' ' B' ' 38' ' ' VAL . . . -68.86 -49.01 61.94 Favored 'General case' 0 CA--C 1.554 1.126 0 N-CA-C 115.892 1.812 . . . . 0.0 115.892 -170.263 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 1.4 pp . . . . . 0 CA--C 1.566 1.585 0 N-CA-C 117.534 2.42 . . . . 0.0 117.534 178.364 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 23.8 p-10 . . . . . 0 CA--C 1.57 1.745 0 N-CA-C 113.18 0.807 . . . . 0.0 113.18 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 65.2 Cg_endo -67.5 157.7 60.54 Favored 'Trans proline' 0 CA--C 1.564 2.024 0 C-N-CA 123.044 2.496 . . . . 0.0 117.566 175.949 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' HIS . . . . . 0.444 ' HA ' ' HA ' ' B' ' 10' ' ' ARG . 76.0 m80 -85.1 145.13 27.81 Favored 'General case' 0 CA--C 1.565 1.538 0 N-CA-C 115.296 1.591 . . . . 0.0 115.296 -171.28 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . 0.793 ' CZ ' HD12 ' B' ' 34' ' ' LEU . 1.3 p90 -128.31 136.78 51.46 Favored 'General case' 0 N--CA 1.487 1.407 0 O-C-N 120.094 -1.629 . . . . 0.0 109.351 135.987 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 58.5 m-20 -73.53 92.47 1.91 Allowed 'General case' 0 CA--C 1.558 1.257 0 O-C-N 120.953 -1.092 . . . . 0.0 110.748 175.75 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . 0.696 ' CD2' HD13 ' B' ' 34' ' ' LEU . 3.9 t80 -68.87 163.35 24.51 Favored 'General case' 0 CA--C 1.562 1.423 0 CA-C-O 124.69 2.186 . . . . 0.0 110.466 164.347 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 173.18 98.74 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.783 0 CA-C-N 113.114 -1.857 . . . . 0.0 107.135 -124.304 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 7.3 mtt -145.75 131.74 9.54 Favored Pre-proline 0 N--CA 1.496 1.852 0 CA-C-O 116.751 -1.595 . . . . 0.0 112.275 -153.125 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 79.9 Cg_exo -43.27 150.16 0.43 Allowed 'Trans proline' 0 CA--C 1.561 1.846 0 C-N-CA 123.113 2.542 . . . . 0.0 116.936 170.585 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 21.2 tpp -64.38 -28.72 69.89 Favored 'General case' 0 N--CA 1.491 1.619 0 N-CA-C 116.987 2.217 . . . . 0.0 116.987 -164.192 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 9.1 pm0 -57.54 -48.01 80.46 Favored 'General case' 0 CA--C 1.566 1.571 0 N-CA-C 116.973 2.212 . . . . 0.0 116.973 156.365 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.401 ' CG1' HG12 ' B' ' 38' ' ' VAL . 2.0 t -60.97 -47.28 94.26 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.047 0 CA-C-N 122.019 2.19 . . . . 0.0 115.25 -179.747 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . 0.509 0.1 OUTLIER -114.87 27.43 9.43 Favored 'General case' 0 N--CA 1.485 1.314 0 N-CA-C 118.376 2.732 . . . . 0.0 118.376 170.979 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 5.5 pt-20 -71.61 -45.96 60.62 Favored 'General case' 0 N--CA 1.483 1.222 0 O-C-N 119.141 -2.224 . . . . 0.0 113.517 119.856 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . 0.297 56.0 mtmt -60.98 -52.26 65.77 Favored 'General case' 0 CA--C 1.563 1.469 0 N-CA-C 116.338 1.977 . . . . 0.0 116.338 177.986 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.744 ' HB3' ' CE ' ' A' ' 30' ' ' MET . 6.9 mt -65.67 -43.93 87.79 Favored 'General case' 0 CA--C 1.576 1.946 0 CA-C-N 120.291 1.405 . . . . 0.0 114.326 166.898 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 5.7 ttpt -77.7 -29.36 51.33 Favored 'General case' 0 CA--C 1.572 1.806 0 CA-C-N 123.296 2.771 . . . . 0.0 113.69 -178.499 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 17.3 m-30 -63.71 -67.86 0.39 Allowed 'General case' 0 N--CA 1.485 1.317 0 CA-C-O 115.627 -2.13 . . . . 0.0 111.725 159.792 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . 0.307 14.1 ttt180 -26.06 -49.19 0.03 OUTLIER 'General case' 0 CA--C 1.595 2.697 0 CA-C-N 124.626 3.376 . . . . 0.0 115.889 164.782 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . 0.293 . . -55.26 -76.53 0.03 OUTLIER 'General case' 0 CA--C 1.591 2.52 0 O-C-N 117.174 -3.454 . . . . 0.0 118.225 156.278 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 38.8 mt-10 . . . . . 0 N--CA 1.504 2.238 0 N-CA-C 119.342 3.09 . . . . 0.0 119.342 -179.182 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.458 ' CZ ' HE21 ' A' ' 36' ' ' GLN 0.396 36.6 mtm105 . . . . . 0 N--CA 1.498 1.945 0 N-CA-C 107.39 -1.337 . . . . 0.0 107.39 . . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . 0.449 ' H ' ' HB3' ' A' ' 32' ' ' SER . 80.2 p -131.4 105.81 7.84 Favored 'General case' 0 N--CA 1.502 2.171 0 O-C-N 117.487 -3.258 . . . . 0.0 105.757 -172.0 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' MET . . . . . 0.744 ' CE ' ' HB3' ' A' ' 19' ' ' LEU . 0.0 OUTLIER -38.26 -45.65 1.0 Allowed 'General case' 0 N--CA 1.495 1.81 0 N-CA-C 120.336 3.458 . . . . 0.0 120.336 -139.947 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 15.0 t-20 -42.63 -47.59 5.3 Favored 'General case' 0 CA--C 1.597 2.763 0 O-C-N 117.758 -3.089 . . . . 0.0 115.293 162.788 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . 0.449 ' HB3' ' H ' ' A' ' 29' ' ' SER 0.277 42.8 t -54.0 -63.94 0.99 Allowed 'General case' 0 N--CA 1.501 2.119 0 N-CA-C 120.073 3.36 . . . . 0.0 120.073 147.052 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 5.9 tm-20 -69.35 -51.77 33.65 Favored 'General case' 0 N--CA 1.515 2.79 0 CA-C-N 123.042 2.655 . . . . 0.0 116.986 -175.598 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.767 HD12 ' CZ ' ' B' ' 7' ' ' PHE . 0.0 OUTLIER -44.08 -54.8 5.21 Favored 'General case' 0 CA--C 1.561 1.387 0 CA-C-O 115.535 -2.174 . . . . 0.0 107.59 162.793 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.423 ' HG ' ' CE1' ' B' ' 9' ' ' PHE . 10.9 mt -64.3 -56.2 16.1 Favored 'General case' 0 N--CA 1.491 1.622 0 CA-C-N 124.759 3.436 . . . . 0.0 115.099 -176.598 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . 0.458 HE21 ' CZ ' ' A' ' 28' ' ' ARG . 0.5 OUTLIER -57.73 -38.59 75.58 Favored 'General case' 0 CA--C 1.563 1.45 0 CA-C-O 115.928 -1.987 . . . . 0.0 113.366 177.206 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -69.59 -33.3 56.19 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.668 0 CA-C-N 122.485 2.402 . . . . 0.0 115.441 166.972 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.691 HG13 HD12 ' B' ' 19' ' ' LEU . 2.3 t -74.98 -49.49 28.35 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.544 0 C-N-CA 128.535 2.734 . . . . 0.0 112.974 178.906 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 34.3 mt-30 -43.34 -55.13 4.25 Favored 'General case' 0 N--CA 1.484 1.254 0 CA-C-O 116.695 -1.622 . . . . 0.0 112.294 151.531 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . 0.429 0.9 OUTLIER -41.6 -49.81 4.1 Favored 'General case' 0 N--CA 1.495 1.812 0 N-CA-C 118.072 2.619 . . . . 0.0 118.072 158.789 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . 0.331 . . . . . . . 0 CA--C 1.548 0.875 0 N-CA-C 117.784 2.513 . . . . 0.0 117.784 -159.361 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo . . . . . 0 CA--C 1.568 2.196 0 N-CA-C 116.991 1.881 . . . . 0.0 116.991 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' B' B ' 6' ' ' HIS . . . . . . . . . . . . . 76.6 m80 -88.27 153.46 21.2 Favored 'General case' 0 CA--C 1.569 1.711 0 CA-C-N 111.723 -2.49 . . . . 0.0 112.429 169.544 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 7' ' ' PHE . . . . . 0.767 ' CZ ' HD12 ' A' ' 34' ' ' LEU . 10.0 p90 -130.43 159.69 36.29 Favored 'General case' 0 CA--C 1.568 1.647 0 O-C-N 119.491 -2.006 . . . . 0.0 112.047 129.782 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 8' ' ' ASN . . . . . . . . . . . . . 14.6 p-10 -65.74 87.69 0.09 Allowed 'General case' 0 CA--C 1.567 1.626 0 N-CA-C 114.279 1.214 . . . . 0.0 114.279 168.937 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 9' ' ' PHE . . . . . 0.678 ' CD2' HD13 ' A' ' 34' ' ' LEU 0.254 1.9 t80 -79.76 179.44 7.53 Favored 'General case' 0 CA--C 1.556 1.177 0 CA-C-O 123.724 1.726 . . . . 0.0 110.361 158.932 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 10' ' ' ARG . . . . . 0.444 ' HA ' ' HA ' ' A' ' 6' ' ' HIS 0.425 67.4 mtt180 -127.16 -136.94 0.25 Allowed 'General case' 0 N--CA 1.477 0.886 0 CA-C-N 114.246 -1.343 . . . . 0.0 110.832 -164.418 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 11' ' ' MET . . . . . 0.523 ' SD ' ' CD2' ' B' ' 9' ' ' PHE . 5.1 mmt -146.12 171.14 6.8 Favored Pre-proline 0 CA--C 1.579 2.071 0 O-C-N 117.301 -3.375 . . . . 0.0 110.683 63.331 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 12' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -45.76 131.92 13.31 Favored 'Trans proline' 0 C--N 1.371 1.721 0 O-C-N 117.103 -2.104 . . . . 0.0 113.328 147.882 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 13' ' ' MET . . . . . . . . . . . . . 22.5 tpp -60.17 -27.12 66.86 Favored 'General case' 0 CA--C 1.568 1.637 0 N-CA-C 118.14 2.644 . . . . 0.0 118.14 -154.335 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 14' ' ' GLU . . . . . . . . . . . . 0.271 11.1 pt-20 -57.14 -50.07 73.96 Favored 'General case' 0 CA--C 1.565 1.546 0 N-CA-C 117.001 2.223 . . . . 0.0 117.001 162.309 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 15' ' ' VAL . . . . . 0.471 ' CG1' HG12 ' A' ' 38' ' ' VAL . 0.1 OUTLIER -63.52 -43.06 98.17 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.884 0 CA-C-N 121.037 1.744 . . . . 0.0 114.375 173.756 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 16' ' ' ARG . . . . . . . . . . . . 0.261 4.8 ttt180 -78.97 -32.22 45.26 Favored 'General case' 0 N--CA 1.478 0.943 0 CA-C-O 116.058 -1.925 . . . . 0.0 114.518 175.404 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 17' ' ' GLU . . . . . . . . . . . . . 5.3 pt-20 -64.77 -43.97 91.53 Favored 'General case' 0 N--CA 1.484 1.26 0 CA-C-N 124.0 3.091 . . . . 0.0 113.305 163.209 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . 0.615 16.5 pttt -70.14 -33.25 71.57 Favored 'General case' 0 CA--C 1.565 1.551 0 N-CA-C 117.858 2.54 . . . . 0.0 117.858 173.712 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 19' ' ' LEU . . . . . 0.691 HD12 HG13 ' A' ' 38' ' ' VAL 0.367 0.7 OUTLIER -76.59 -40.27 50.01 Favored 'General case' 0 CA--C 1.567 1.617 0 CA-C-N 121.016 1.735 . . . . 0.0 114.021 166.689 . . . . . . . . 4 4 . 1 . 008 nuclear nobuild core ' B' B ' 20' ' ' LYS . . . . . . . . . . . . . 3.0 ttpt -79.71 -32.77 41.32 Favored 'General case' 0 CA--C 1.563 1.458 0 O-C-N 119.861 -1.774 . . . . 0.0 114.556 179.174 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 18.9 m-85 -60.78 -73.86 0.09 Allowed 'General case' 0 N--CA 1.491 1.619 1 CA-C-O 111.613 -4.042 . . . . 0.0 109.951 155.213 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . 0.276 17.9 ttt180 -22.81 -54.82 0.03 OUTLIER 'General case' 0 N--CA 1.506 2.334 1 CA-C-N 127.601 4.728 . . . . 0.0 117.066 170.655 . . . . . . . . 3 2 . 1 . 008 nuclear nobuild core ' B' B ' 23' ' ' ALA . . . . . 0.516 ' HB2' ' CB ' ' B' ' 33' ' ' GLU . . . -48.63 -79.8 0.01 OUTLIER 'General case' 0 CA--C 1.58 2.102 0 N-CA-C 118.489 2.774 . . . . 0.0 118.489 156.592 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 46.4 mm-40 -65.82 -34.22 77.65 Favored 'General case' 0 N--CA 1.498 1.93 0 N-CA-C 118.978 2.955 . . . . 0.0 118.978 -178.429 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 25' ' ' ALA . . . . . . . . . . . . . . . -41.96 -48.1 4.47 Favored 'General case' 0 CA--C 1.578 2.052 0 N-CA-C 117.536 2.421 . . . . 0.0 117.536 153.712 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 26' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -97.97 -44.52 6.63 Favored 'General case' 0 CA--C 1.576 1.951 0 N-CA-C 116.64 2.089 . . . . 0.0 116.64 -173.614 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 27' ' ' GLY . . . . . . . . . . . . . . . 122.62 13.7 4.58 Favored Glycine 0 N--CA 1.498 2.798 0 N-CA-C 119.05 2.38 . . . . 0.0 119.05 -159.584 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 28' ' ' ARG . . . . . 0.675 ' HE ' ' HG2' ' B' ' 33' ' ' GLU . 61.8 mtm-85 -109.54 154.72 22.31 Favored 'General case' 0 CA--C 1.575 1.924 0 N-CA-C 103.981 -2.6 . . . . 0.0 103.981 167.302 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 29' ' ' SER . . . . . . . . . . . . . 79.1 p -129.35 112.35 13.76 Favored 'General case' 0 N--CA 1.505 2.311 0 O-C-N 117.049 -3.532 . . . . 0.0 106.001 -169.737 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 30' ' ' MET . . . . . 0.468 ' CE ' ' HB3' ' B' ' 19' ' ' LEU . 24.1 mtp -47.15 -38.58 11.95 Favored 'General case' 0 N--CA 1.497 1.915 0 N-CA-C 118.772 2.878 . . . . 0.0 118.772 -135.198 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 31' ' ' ASN . . . . . . . . . . . . 0.26 0.1 OUTLIER -48.21 -43.27 31.85 Favored 'General case' 0 CA--C 1.598 2.816 0 O-C-N 116.906 -3.622 . . . . 0.0 115.315 164.425 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 32' ' ' SER . . . . . . . . . . . . 0.461 75.4 p -54.84 -63.5 1.13 Allowed 'General case' 0 N--CA 1.505 2.319 0 N-CA-C 118.755 2.872 . . . . 0.0 118.755 145.262 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 33' ' ' GLU . . . . . 0.675 ' HG2' ' HE ' ' B' ' 28' ' ' ARG . 3.0 tm-20 -67.18 -50.15 62.11 Favored 'General case' 0 N--CA 1.511 2.624 0 N-CA-C 120.35 3.463 . . . . 0.0 120.35 -177.052 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 34' ' ' LEU . . . . . 0.793 HD12 ' CZ ' ' A' ' 7' ' ' PHE . 0.1 OUTLIER -42.07 -54.69 3.48 Favored 'General case' 0 CA--C 1.554 1.126 0 CA-C-O 114.881 -2.485 . . . . 0.0 107.756 159.807 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 35' ' ' LEU . . . . . 0.415 HD23 ' HA ' ' B' ' 35' ' ' LEU . 12.2 mt -60.38 -40.11 89.71 Favored 'General case' 0 N--CA 1.492 1.633 0 CA-C-N 124.75 3.432 . . . . 0.0 116.766 176.028 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 36' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.22 -46.07 74.94 Favored 'General case' 0 N--CA 1.488 1.438 0 N-CA-C 115.017 1.488 . . . . 0.0 115.017 176.145 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 37' ' ' ILE . . . . . . . . . . . . . 5.3 tt -63.12 -30.2 49.11 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.408 0 CA-C-O 114.858 -2.496 . . . . 0.0 116.101 161.89 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 38' ' ' VAL . . . . . 0.616 ' HA ' ' HB3' ' B' ' 41' ' ' ALA . 2.2 t -83.63 -46.21 18.4 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.923 0 CA-C-N 121.893 2.133 . . . . 0.0 112.704 -172.301 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 33.5 mt-30 -57.28 -38.89 74.63 Favored 'General case' 0 CA--C 1.572 1.82 0 O-C-N 121.148 -0.97 . . . . 0.0 112.497 157.291 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 40' ' ' ASP . . . . . . . . . . . . 0.528 5.2 m-20 -52.93 -41.45 64.46 Favored 'General case' 0 CA--C 1.58 2.103 0 N-CA-C 119.264 3.061 . . . . 0.0 119.264 151.168 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 41' ' ' ALA . . . . . 0.616 ' HB3' ' HA ' ' B' ' 38' ' ' VAL . . . -75.68 -20.62 58.3 Favored 'General case' 0 N--CA 1.493 1.715 0 N-CA-C 116.695 2.109 . . . . 0.0 116.695 -175.663 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 22.4 mt . . . . . 0 N--CA 1.488 1.464 0 C-N-CA 125.057 1.343 . . . . 0.0 113.673 170.743 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 26.3 p-10 . . . . . 0 CA--C 1.57 1.736 0 N-CA-C 113.715 1.006 . . . . 0.0 113.715 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 1.9 Cg_endo -109.55 173.51 0.07 OUTLIER 'Trans proline' 0 CA--C 1.556 1.619 0 C-N-CA 121.94 1.76 . . . . 0.0 112.964 -157.554 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . 0.268 1.8 p-80 -143.61 148.35 35.73 Favored 'General case' 0 N--CA 1.486 1.347 0 N-CA-C 118.173 2.657 . . . . 0.0 118.173 -144.581 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . 0.53 ' CZ ' HD23 ' B' ' 34' ' ' LEU . 25.5 p90 -131.71 166.18 22.08 Favored 'General case' 0 CA--C 1.561 1.393 0 CA-C-N 113.806 -1.543 . . . . 0.0 109.033 168.91 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 14.1 m120 -74.39 98.39 3.26 Favored 'General case' 0 CA--C 1.563 1.467 0 O-C-N 119.641 -1.912 . . . . 0.0 110.872 162.67 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . 0.436 ' HD2' HD11 ' A' ' 34' ' ' LEU . 3.6 t80 -69.97 157.61 37.15 Favored 'General case' 0 CA--C 1.568 1.662 0 CA-C-O 124.26 1.981 . . . . 0.0 109.873 147.283 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 12.3 tpt180 169.27 87.34 0.0 OUTLIER 'General case' 0 N--CA 1.502 2.137 0 O-C-N 119.264 -2.147 . . . . 0.0 106.904 -124.283 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -136.79 121.7 12.79 Favored Pre-proline 0 CA--C 1.575 1.909 0 CA-C-O 117.248 -1.358 . . . . 0.0 112.886 -149.172 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 98.9 Cg_exo -43.26 150.91 0.35 Allowed 'Trans proline' 0 C--N 1.379 2.142 0 C-N-CA 123.875 3.05 . . . . 0.0 118.969 -179.904 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -50.94 -40.19 56.72 Favored 'General case' 0 N--CA 1.499 1.994 0 N-CA-C 117.983 2.586 . . . . 0.0 117.983 -165.805 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 9.6 pt-20 -63.37 -43.25 98.15 Favored 'General case' 0 CA--C 1.564 1.492 0 N-CA-C 116.287 1.958 . . . . 0.0 116.287 165.428 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.429 ' CG1' HG12 ' B' ' 38' ' ' VAL . 1.2 t -59.96 -48.91 86.0 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.064 0 CA-C-N 123.002 2.637 . . . . 0.0 112.637 172.457 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 3.4 ttt180 -69.7 -41.29 75.59 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-N 121.13 1.786 . . . . 0.0 115.797 174.111 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -60.91 -37.68 83.08 Favored 'General case' 0 CA--C 1.565 1.543 0 CA-C-N 123.289 2.768 . . . . 0.0 114.378 166.237 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 48.4 mtmt -62.47 -62.76 1.53 Allowed 'General case' 0 CA--C 1.564 1.488 0 CA-C-N 121.229 1.832 . . . . 0.0 114.481 166.7 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.541 HD21 ' HG ' ' A' ' 34' ' ' LEU . 12.5 tp -56.89 -36.19 69.84 Favored 'General case' 0 N--CA 1.491 1.578 0 N-CA-C 115.855 1.798 . . . . 0.0 115.855 176.319 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 12.1 ttpt -89.29 -27.85 20.28 Favored 'General case' 0 CA--C 1.568 1.656 0 C-N-CA 125.143 1.377 . . . . 0.0 114.046 179.081 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 13.2 m-30 -65.31 -70.67 0.22 Allowed 'General case' 0 N--CA 1.493 1.681 0 CA-C-O 115.103 -2.38 . . . . 0.0 110.926 156.887 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . 0.574 ' HE ' HD12 ' A' ' 37' ' ' ILE 0.35 0.0 OUTLIER -23.55 -47.71 0.01 OUTLIER 'General case' 0 CA--C 1.6 2.869 0 CA-C-N 124.631 3.378 . . . . 0.0 115.102 163.794 . . . . . . . . 4 4 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.407 ' HB2' ' CB ' ' A' ' 33' ' ' GLU . . . -57.94 -76.96 0.03 OUTLIER 'General case' 0 CA--C 1.587 2.377 0 N-CA-C 117.61 2.448 . . . . 0.0 117.61 156.726 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 . . . . . 0 N--CA 1.503 2.198 0 N-CA-C 118.948 2.944 . . . . 0.0 118.948 179.102 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 29.1 mtm-85 . . . . . 0 CA--C 1.569 1.689 0 N-CA-C 106.532 -1.655 . . . . 0.0 106.532 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 38.1 t -119.6 115.0 23.09 Favored 'General case' 0 N--CA 1.501 2.105 0 O-C-N 118.842 -2.411 . . . . 0.0 105.411 -177.681 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 22.7 mtp -43.72 -40.93 4.54 Favored 'General case' 0 N--CA 1.5 2.068 0 N-CA-C 119.109 3.003 . . . . 0.0 119.109 -146.175 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -46.17 -44.63 16.14 Favored 'General case' 0 CA--C 1.601 2.906 0 CA-C-N 125.683 3.856 . . . . 0.0 115.371 163.721 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . 0.356 28.7 t -49.07 -75.59 0.03 OUTLIER 'General case' 0 N--CA 1.503 2.191 0 N-CA-C 118.338 2.718 . . . . 0.0 118.338 143.608 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . 0.407 ' CB ' ' HB2' ' A' ' 23' ' ' ALA . 10.4 tp10 -60.6 -55.01 38.45 Favored 'General case' 0 N--CA 1.516 2.87 0 CA-C-N 124.217 3.19 . . . . 0.0 116.191 -173.208 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.788 HD12 ' CZ ' ' B' ' 7' ' ' PHE . 0.1 OUTLIER -39.88 -53.9 2.23 Favored 'General case' 0 CA--C 1.55 0.972 0 CA-C-O 115.805 -2.045 . . . . 0.0 108.3 167.481 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.428 HD23 ' HA ' ' A' ' 35' ' ' LEU . 13.1 mt -61.1 -47.24 87.21 Favored 'General case' 0 N--CA 1.486 1.348 0 CA-C-N 123.263 2.756 . . . . 0.0 115.913 174.75 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.56 -44.71 93.21 Favored 'General case' 0 N--CA 1.479 0.989 0 CA-C-O 116.748 -1.596 . . . . 0.0 114.269 177.472 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . 0.574 HD12 ' HE ' ' A' ' 22' ' ' ARG . 3.8 tt -69.94 -32.68 52.46 Favored 'Isoleucine or valine' 0 C--O 1.199 -1.598 0 CA-C-O 114.989 -2.434 . . . . 0.0 114.719 166.168 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.478 HG21 HD22 ' A' ' 34' ' ' LEU . 3.0 t -78.21 -48.36 23.09 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.179 0 CA-C-N 123.581 2.9 . . . . 0.0 112.156 -174.435 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 27.2 mt-30 -49.4 -46.15 47.03 Favored 'General case' 0 CA--C 1.563 1.462 0 C-N-CA 123.77 0.828 . . . . 0.0 112.153 154.507 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . 0.422 3.9 t0 -51.55 -41.65 61.25 Favored 'General case' 0 N--CA 1.488 1.439 0 N-CA-C 118.913 2.931 . . . . 0.0 118.913 158.444 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . 0.275 . . . . . . . 0 N--CA 1.479 0.978 0 N-CA-C 115.465 1.654 . . . . 0.0 115.465 -155.494 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 7.2 Cg_exo . . . . . 0 CA--C 1.552 1.379 0 CA-C-O 121.601 0.584 . . . . 0.0 113.183 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' B' B ' 6' ' ' HIS . . . . . . . . . . . . . 67.5 m80 -72.29 128.13 34.69 Favored 'General case' 0 CA--C 1.575 1.923 0 CA-C-N 114.852 -1.067 . . . . 0.0 111.784 173.008 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 7' ' ' PHE . . . . . 0.788 ' CZ ' HD12 ' A' ' 34' ' ' LEU 0.252 2.5 p90 -131.92 149.47 52.43 Favored 'General case' 0 CA--C 1.565 1.529 0 O-C-N 119.882 -1.761 . . . . 0.0 111.036 147.877 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 8' ' ' ASN . . . . . . . . . . . . . 12.9 m120 -71.86 84.69 0.94 Allowed 'General case' 0 N--CA 1.491 1.606 0 O-C-N 120.521 -1.362 . . . . 0.0 112.234 176.727 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 9' ' ' PHE . . . . . 0.673 ' CD2' HD13 ' A' ' 34' ' ' LEU . 9.0 t80 -81.23 149.75 28.9 Favored 'General case' 0 CA--C 1.561 1.374 0 CA-C-O 126.151 2.881 . . . . 0.0 111.306 171.033 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 10' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -172.6 112.5 0.26 Allowed 'General case' 0 C--N 1.307 -1.243 0 CA-C-N 111.5 -2.591 . . . . 0.0 105.54 -129.351 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 11' ' ' MET . . . . . 0.408 ' SD ' ' CD2' ' B' ' 9' ' ' PHE . 0.9 OUTLIER -133.71 117.91 14.31 Favored Pre-proline 0 CA--C 1.564 1.487 0 CA-C-O 117.375 -1.298 . . . . 0.0 110.032 -153.176 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 12' ' ' PRO . . . . . . . . . . . . . 76.1 Cg_exo -42.92 145.59 1.09 Allowed 'Trans proline' 0 C--N 1.374 1.869 0 C-N-CA 123.249 2.633 . . . . 0.0 116.1 163.886 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 13' ' ' MET . . . . . . . . . . . . . 3.5 tpt -51.56 -41.18 60.94 Favored 'General case' 0 N--CA 1.494 1.736 0 N-CA-C 118.551 2.797 . . . . 0.0 118.551 -154.632 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -63.39 -43.29 98.0 Favored 'General case' 0 CA--C 1.563 1.457 0 N-CA-C 116.722 2.119 . . . . 0.0 116.722 166.708 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -57.43 -47.25 85.22 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.39 0 CA-C-N 124.394 3.27 . . . . 0.0 112.951 172.576 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 1.9 ttt180 -75.13 -37.84 61.26 Favored 'General case' 0 N--CA 1.475 0.818 0 CA-C-O 116.6 -1.666 . . . . 0.0 115.236 176.381 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 17' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -61.74 -37.37 83.99 Favored 'General case' 0 CA--C 1.569 1.676 0 CA-C-N 123.12 2.691 . . . . 0.0 114.056 163.405 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . 0.269 43.2 mtmt -66.3 -49.93 65.36 Favored 'General case' 0 CA--C 1.563 1.461 0 CA-C-N 122.018 2.19 . . . . 0.0 115.112 170.416 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 19' ' ' LEU . . . . . 0.53 HD21 HD22 ' B' ' 34' ' ' LEU 0.27 11.8 tp -70.12 -39.22 75.59 Favored 'General case' 0 N--CA 1.487 1.391 0 C-N-CA 124.98 1.312 . . . . 0.0 114.526 176.374 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 20' ' ' LYS . . . . . 0.402 ' HB2' ' SD ' ' B' ' 30' ' ' MET . 13.4 ttpt -84.92 -28.6 25.81 Favored 'General case' 0 CA--C 1.565 1.525 0 CA-C-O 117.423 -1.275 . . . . 0.0 114.271 177.597 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 18.5 m-30 -67.03 -70.72 0.23 Allowed 'General case' 0 N--CA 1.492 1.644 0 CA-C-O 113.093 -3.337 . . . . 0.0 109.945 160.337 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . 0.275 37.2 ttt85 -20.26 -53.78 0.02 OUTLIER 'General case' 0 CA--C 1.587 2.391 1 CA-C-N 126.284 4.129 . . . . 0.0 116.372 165.399 . . . . . . . . 3 2 . 1 . 009 nuclear nobuild core ' B' B ' 23' ' ' ALA . . . . . 0.494 ' HB2' ' CB ' ' B' ' 33' ' ' GLU . . . -54.32 -79.53 0.02 OUTLIER 'General case' 0 CA--C 1.588 2.438 0 N-CA-C 117.288 2.329 . . . . 0.0 117.288 159.023 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 66.7 mm-40 -71.49 -32.58 68.4 Favored 'General case' 0 CA--C 1.575 1.934 0 N-CA-C 119.361 3.097 . . . . 0.0 119.361 -176.41 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 25' ' ' ALA . . . . . . . . . . . . . . . -41.56 -49.99 4.05 Favored 'General case' 0 CA--C 1.58 2.1 0 N-CA-C 116.549 2.055 . . . . 0.0 116.549 153.131 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 26' ' ' ASN . . . . . . . . . . . . 0.264 0.0 OUTLIER -107.6 -42.27 4.81 Favored 'General case' 0 CA--C 1.576 1.972 0 N-CA-C 116.09 1.885 . . . . 0.0 116.09 -163.975 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 27' ' ' GLY . . . . . . . . . . . . . . . 134.27 12.24 1.46 Allowed Glycine 0 N--CA 1.498 2.824 0 N-CA-C 119.232 2.453 . . . . 0.0 119.232 -167.097 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 28' ' ' ARG . . . . . 0.408 ' HE ' ' HG2' ' B' ' 33' ' ' GLU . 72.4 mtm-85 -111.35 165.75 11.69 Favored 'General case' 0 CA--C 1.575 1.922 0 CA-C-N 120.39 2.095 . . . . 0.0 105.424 168.087 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 29' ' ' SER . . . . . . . . . . . . . 8.8 t -133.7 113.62 12.54 Favored 'General case' 0 N--CA 1.506 2.361 0 O-C-N 117.103 -3.498 . . . . 0.0 107.129 -177.247 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 30' ' ' MET . . . . . 0.402 ' SD ' ' HB2' ' B' ' 20' ' ' LYS . 25.6 mtp -44.8 -34.46 2.32 Favored 'General case' 0 N--CA 1.5 2.029 0 N-CA-C 121.338 3.829 . . . . 0.0 121.338 -139.533 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 31' ' ' ASN . . . . . . . . . . . . 0.26 8.8 t-20 -49.75 -49.64 47.42 Favored 'General case' 0 CA--C 1.591 2.543 0 O-C-N 118.572 -2.58 . . . . 0.0 113.882 161.318 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 32' ' ' SER . . . . . . . . . . . . 0.29 27.6 t -49.43 -64.26 0.86 Allowed 'General case' 0 N--CA 1.501 2.115 0 N-CA-C 119.649 3.203 . . . . 0.0 119.649 146.955 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 33' ' ' GLU . . . . . 0.494 ' CB ' ' HB2' ' B' ' 23' ' ' ALA . 0.0 OUTLIER -67.55 -60.47 2.53 Favored 'General case' 0 N--CA 1.516 2.863 0 CA-C-N 123.45 2.841 . . . . 0.0 116.156 -176.449 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 34' ' ' LEU . . . . . 0.53 HD23 ' CZ ' ' A' ' 7' ' ' PHE 0.543 0.1 OUTLIER -49.06 -37.06 19.83 Favored 'General case' 0 CA--C 1.563 1.48 0 CA-C-O 114.184 -2.817 . . . . 0.0 108.207 172.009 . . . . . . . . 4 4 . 1 . 009 nuclear nobuild core ' B' B ' 35' ' ' LEU . . . . . 0.405 ' HA ' HD23 ' B' ' 35' ' ' LEU . 13.9 mt -64.67 -56.73 11.92 Favored 'General case' 0 N--CA 1.491 1.613 1 CA-C-N 126.158 4.072 . . . . 0.0 115.725 167.559 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 36' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -50.64 -40.26 52.78 Favored 'General case' 0 CA--C 1.58 2.101 0 N-CA-C 115.784 1.772 . . . . 0.0 115.784 175.734 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 37' ' ' ILE . . . . . 0.423 ' HA ' ' HB3' ' B' ' 40' ' ' ASP . 0.5 OUTLIER -74.03 -35.62 42.28 Favored 'Isoleucine or valine' 0 CA--C 1.571 1.762 0 N-CA-C 116.164 1.913 . . . . 0.0 116.164 166.47 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 38' ' ' VAL . . . . . 0.518 ' HA ' ' HB3' ' B' ' 41' ' ' ALA . 3.3 t -72.5 -46.76 54.47 Favored 'Isoleucine or valine' 0 CA--C 1.575 1.941 0 O-C-N 119.041 -2.287 . . . . 0.0 110.796 177.699 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 23.7 mt-30 -51.38 -40.85 60.06 Favored 'General case' 0 CA--C 1.562 1.427 0 N-CA-C 114.539 1.311 . . . . 0.0 114.539 155.517 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 40' ' ' ASP . . . . . 0.423 ' HB3' ' HA ' ' B' ' 37' ' ' ILE . 44.8 t0 -53.32 -47.71 69.07 Favored 'General case' 0 N--CA 1.492 1.634 0 N-CA-C 116.518 2.044 . . . . 0.0 116.518 156.102 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 41' ' ' ALA . . . . . 0.518 ' HB3' ' HA ' ' B' ' 38' ' ' VAL 0.263 . . -69.6 -26.86 64.65 Favored 'General case' 0 CA--C 1.564 1.514 0 N-CA-C 117.462 2.393 . . . . 0.0 117.462 -174.618 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 CA--C 1.573 1.856 0 C-N-CA 124.687 1.195 . . . . 0.0 112.993 175.356 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 2.1 p30 . . . . . 0 CA--C 1.568 1.67 0 CA-C-O 118.652 -0.689 . . . . 0.0 112.1 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 3.7 Cg_exo -98.06 148.74 0.75 Allowed 'Trans proline' 0 CA--C 1.551 1.343 0 CA-C-N 122.363 1.88 . . . . 0.0 114.131 -155.246 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 80.8 m80 -84.9 130.42 34.65 Favored 'General case' 0 CA--C 1.566 1.577 0 CA-C-N 113.946 -1.479 . . . . 0.0 112.369 178.476 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . 0.482 ' CZ ' HD23 ' B' ' 34' ' ' LEU . 3.2 p90 -132.45 159.56 38.99 Favored 'General case' 0 CA--C 1.567 1.625 0 CA-C-O 122.704 1.24 . . . . 0.0 111.048 153.896 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 70.7 m-80 -66.18 101.73 0.75 Allowed 'General case' 0 CA--C 1.573 1.847 0 O-C-N 120.877 -1.14 . . . . 0.0 112.68 173.999 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . 0.457 ' CE1' ' HG ' ' B' ' 35' ' ' LEU . 5.2 t80 -120.18 110.08 16.19 Favored 'General case' 0 CA--C 1.547 0.838 0 N-CA-C 106.372 -1.714 . . . . 0.0 106.372 157.839 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . 0.383 0.0 OUTLIER 98.66 89.05 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.633 1 O-C-N 113.897 -5.502 . . . . 0.0 110.098 -17.654 . . . . . . . . 4 3 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' MET . . . . . 0.496 ' SD ' ' HG3' ' A' ' 16' ' ' ARG . 1.6 mpt? -147.74 149.57 33.91 Favored Pre-proline 0 CA--C 1.567 1.632 0 CA-C-O 118.086 -0.959 . . . . 0.0 111.976 -170.237 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_exo -44.85 141.94 5.56 Favored 'Trans proline' 0 CA--C 1.567 2.155 0 C-N-CA 122.436 2.091 . . . . 0.0 115.989 154.783 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . 0.433 ' SD ' ' HG3' ' A' ' 17' ' ' GLU . 13.7 tpp -56.07 -27.79 54.96 Favored 'General case' 0 N--CA 1.496 1.847 0 N-CA-C 118.934 2.939 . . . . 0.0 118.934 -169.811 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 7.6 pt-20 -65.93 -47.62 74.12 Favored 'General case' 0 CA--C 1.57 1.712 0 N-CA-C 115.957 1.836 . . . . 0.0 115.957 165.304 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -60.37 -49.07 85.72 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.216 0 CA-C-N 122.263 2.301 . . . . 0.0 112.513 174.402 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . 0.496 ' HG3' ' SD ' ' A' ' 11' ' ' MET . 5.8 ttt180 -69.8 -33.11 71.91 Favored 'General case' 0 CA--C 1.548 0.894 0 CA-C-O 116.047 -1.93 . . . . 0.0 115.562 173.8 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 0.433 ' HG3' ' SD ' ' A' ' 13' ' ' MET . 37.1 mt-10 -60.19 -48.1 83.16 Favored 'General case' 0 N--CA 1.491 1.615 0 CA-C-N 123.941 3.064 . . . . 0.0 114.197 160.312 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . 0.405 ' HB3' HD13 ' B' ' 42' ' ' LEU . 53.0 mtmt -61.89 -45.66 92.79 Favored 'General case' 0 CA--C 1.562 1.436 0 N-CA-C 116.134 1.902 . . . . 0.0 116.134 174.529 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.589 ' CD2' HD22 ' A' ' 34' ' ' LEU 0.258 14.0 tp -69.0 -40.55 78.65 Favored 'General case' 0 CA--C 1.565 1.544 0 N-CA-C 115.01 1.485 . . . . 0.0 115.01 172.195 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.453 ' HB2' ' SD ' ' A' ' 30' ' ' MET . 16.1 ttpt -85.22 -26.2 26.87 Favored 'General case' 0 CA--C 1.567 1.603 0 N-CA-C 114.259 1.207 . . . . 0.0 114.259 179.757 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 13.1 m-85 -61.94 -69.31 0.26 Allowed 'General case' 0 N--CA 1.49 1.554 0 CA-C-O 114.05 -2.881 . . . . 0.0 110.722 155.224 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . 0.304 1.9 ttt85 -23.22 -49.21 0.02 OUTLIER 'General case' 0 CA--C 1.598 2.8 0 CA-C-N 125.363 3.711 . . . . 0.0 116.53 163.406 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . 0.268 . . -58.13 -77.43 0.03 OUTLIER 'General case' 0 CA--C 1.59 2.502 0 N-CA-C 117.301 2.334 . . . . 0.0 117.301 158.482 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 87.9 mt-10 . . . . . 0 N--CA 1.503 2.193 0 N-CA-C 118.774 2.879 . . . . 0.0 118.774 178.606 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 12.0 mtt85 . . . . . 0 CA--C 1.57 1.746 0 N-CA-C 106.03 -1.841 . . . . 0.0 106.03 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . 0.491 ' H ' ' HB3' ' A' ' 32' ' ' SER . 41.3 t -119.71 115.14 23.32 Favored 'General case' 0 N--CA 1.503 2.184 0 O-C-N 118.377 -2.702 . . . . 0.0 105.096 -178.948 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' MET . . . . . 0.453 ' SD ' ' HB2' ' A' ' 20' ' ' LYS . 8.3 mtp -43.22 -36.71 1.86 Allowed 'General case' 0 N--CA 1.502 2.145 0 N-CA-C 121.405 3.854 . . . . 0.0 121.405 -148.282 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . 0.421 ' O ' ' HB2' ' A' ' 35' ' ' LEU . 11.5 t-20 -48.71 -46.36 40.63 Favored 'General case' 0 CA--C 1.592 2.586 0 O-C-N 118.572 -2.58 . . . . 0.0 114.457 162.0 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . 0.491 ' HB3' ' H ' ' A' ' 29' ' ' SER 0.287 46.6 t -51.78 -66.41 0.39 Allowed 'General case' 0 N--CA 1.499 2.004 0 N-CA-C 119.908 3.299 . . . . 0.0 119.908 146.918 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 -64.49 -59.92 3.76 Favored 'General case' 0 N--CA 1.515 2.801 0 CA-C-N 123.895 3.043 . . . . 0.0 114.774 -176.042 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.589 HD22 ' CD2' ' A' ' 19' ' ' LEU 0.477 0.3 OUTLIER -51.17 -41.36 60.11 Favored 'General case' 0 CA--C 1.56 1.365 0 CA-C-O 113.55 -3.119 . . . . 0.0 106.692 174.912 . . . . . . . . 4 4 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.451 HD23 ' HA ' ' A' ' 35' ' ' LEU . 12.9 mt -62.99 -55.36 26.39 Favored 'General case' 0 N--CA 1.495 1.813 1 CA-C-N 127.281 4.582 . . . . 0.0 115.403 169.59 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . 0.276 1.0 OUTLIER -55.75 -49.81 72.1 Favored 'General case' 0 CA--C 1.566 1.561 0 CA-C-O 116.25 -1.833 . . . . 0.0 113.764 179.559 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 1.6 tt -60.11 -39.48 80.59 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.843 0 CA-C-N 122.619 2.463 . . . . 0.0 115.124 165.421 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.45 ' CG1' HD22 ' B' ' 19' ' ' LEU . 2.4 t -70.1 -49.97 51.36 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.994 0 CA-C-N 123.418 2.826 . . . . 0.0 112.696 -178.015 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 24.8 mt-30 -43.46 -46.7 6.91 Favored 'General case' 0 N--CA 1.489 1.522 0 C-N-CA 124.781 1.233 . . . . 0.0 113.724 152.995 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . 0.372 28.7 m-20 -58.46 -42.59 87.78 Favored 'General case' 0 CA--C 1.558 1.285 0 N-CA-C 117.356 2.354 . . . . 0.0 117.356 163.928 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . 0.265 . . . . . . . 0 CA--C 1.553 1.095 0 N-CA-C 115.955 1.835 . . . . 0.0 115.955 -159.589 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 95.2 Cg_endo . . . . . 0 CA--C 1.567 2.169 0 CA-C-O 124.543 1.81 . . . . 0.0 116.128 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' B' B ' 6' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -154.15 148.1 25.59 Favored 'General case' 0 CA--C 1.548 0.873 0 CA-C-N 112.745 -2.025 . . . . 0.0 114.663 -153.175 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 7' ' ' PHE . . . . . 0.552 ' CZ ' HD23 ' A' ' 34' ' ' LEU . 17.3 p90 -122.53 170.36 10.08 Favored 'General case' 0 CA--C 1.561 1.371 0 CA-C-O 122.978 1.371 . . . . 0.0 109.961 153.18 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 8' ' ' ASN . . . . . . . . . . . . . 20.7 m-80 -85.18 92.52 8.42 Favored 'General case' 0 N--CA 1.485 1.291 0 O-C-N 119.894 -1.754 . . . . 0.0 108.06 160.616 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 9' ' ' PHE . . . . . . . . . . . . . 16.0 t80 -69.55 159.04 34.09 Favored 'General case' 0 CA--C 1.561 1.39 0 CA-C-O 125.296 2.474 . . . . 0.0 110.809 162.002 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 10' ' ' ARG . . . . . . . . . . . . . 2.3 tmm_? -176.35 107.76 0.08 Allowed 'General case' 0 C--N 1.304 -1.386 0 N-CA-C 103.399 -2.815 . . . . 0.0 103.399 -122.643 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 11' ' ' MET . . . . . 0.556 ' SD ' HD23 ' B' ' 19' ' ' LEU . 13.4 mtm -134.43 119.59 14.28 Favored Pre-proline 0 N--CA 1.484 1.235 0 CA-C-O 117.218 -1.373 . . . . 0.0 112.216 -161.428 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 12' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_exo -40.61 141.11 0.9 Allowed 'Trans proline' 0 C--N 1.372 1.8 0 C-N-CA 122.962 2.442 . . . . 0.0 116.192 160.991 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 13' ' ' MET . . . . . . . . . . . . . 27.2 tpp -58.98 -26.13 64.21 Favored 'General case' 0 N--CA 1.495 1.822 0 N-CA-C 118.378 2.733 . . . . 0.0 118.378 -157.754 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 14' ' ' GLU . . . . . . . . . . . . 0.252 6.4 pt-20 -64.4 -49.14 72.74 Favored 'General case' 0 CA--C 1.572 1.803 0 N-CA-C 116.213 1.931 . . . . 0.0 116.213 161.477 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -58.22 -47.0 88.56 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.301 0 CA-C-N 122.568 2.44 . . . . 0.0 113.309 173.646 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 2.7 ttt180 -75.06 -32.57 61.54 Favored 'General case' 0 CA--C 1.543 0.684 0 CA-C-O 116.305 -1.807 . . . . 0.0 115.763 175.652 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 17' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -61.39 -44.83 96.47 Favored 'General case' 0 N--CA 1.492 1.647 0 CA-C-N 123.23 2.741 . . . . 0.0 113.242 159.916 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . 0.262 53.2 mtmt -58.74 -52.68 64.65 Favored 'General case' 0 CA--C 1.562 1.421 0 CA-C-N 121.173 1.806 . . . . 0.0 115.345 171.215 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 19' ' ' LEU . . . . . 0.556 HD23 ' SD ' ' B' ' 11' ' ' MET 0.26 12.5 tp -71.12 -36.35 72.1 Favored 'General case' 0 CA--C 1.563 1.444 0 N-CA-C 115.442 1.645 . . . . 0.0 115.442 178.41 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 20' ' ' LYS . . . . . 0.469 ' HB2' ' SD ' ' B' ' 30' ' ' MET . 18.3 ttpt -83.66 -20.81 32.92 Favored 'General case' 0 CA--C 1.584 2.262 0 N-CA-C 114.132 1.16 . . . . 0.0 114.132 172.756 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 21' ' ' PHE . . . . . 0.493 ' O ' ' HB3' ' B' ' 25' ' ' ALA . 9.4 m-30 -73.34 -65.88 0.76 Allowed 'General case' 0 N--CA 1.497 1.875 0 CA-C-N 122.547 2.43 . . . . 0.0 110.847 162.866 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . 0.311 0.2 OUTLIER -17.23 -52.57 0.01 OUTLIER 'General case' 0 CA--C 1.597 2.76 0 CA-C-N 124.79 3.45 . . . . 0.0 114.757 153.614 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 23' ' ' ALA . . . . . 0.479 ' HB2' ' CB ' ' B' ' 33' ' ' GLU . . . -58.27 -77.06 0.03 OUTLIER 'General case' 0 CA--C 1.575 1.905 0 N-CA-C 118.272 2.693 . . . . 0.0 118.272 158.975 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 58.0 mm-40 -75.5 -33.65 60.79 Favored 'General case' 0 CA--C 1.576 1.98 0 N-CA-C 118.303 2.705 . . . . 0.0 118.303 -174.996 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 25' ' ' ALA . . . . . 0.493 ' HB3' ' O ' ' B' ' 21' ' ' PHE . . . -45.61 -51.66 11.79 Favored 'General case' 0 CA--C 1.585 2.293 0 N-CA-C 116.009 1.855 . . . . 0.0 116.009 154.162 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 26' ' ' ASN . . . . . . . . . . . . . 90.8 m-20 -78.68 -53.02 7.59 Favored 'General case' 0 N--CA 1.499 1.989 0 N-CA-C 115.145 1.535 . . . . 0.0 115.145 174.867 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 27' ' ' GLY . . . . . . . . . . . . . . . 120.36 24.69 2.6 Favored Glycine 0 CA--C 1.562 2.99 0 N-CA-C 118.403 2.121 . . . . 0.0 118.403 -154.277 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 28' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -104.88 178.96 4.41 Favored 'General case' 0 CA--C 1.574 1.87 0 CA-C-N 120.211 2.005 . . . . 0.0 107.798 157.546 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 29' ' ' SER . . . . . 0.472 ' H ' ' HB2' ' B' ' 32' ' ' SER . 6.8 t -135.24 115.95 13.88 Favored 'General case' 0 N--CA 1.5 2.052 0 O-C-N 118.73 -2.481 . . . . 0.0 106.92 171.385 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 30' ' ' MET . . . . . 0.469 ' SD ' ' HB2' ' B' ' 20' ' ' LYS 0.355 2.7 ptm -48.84 -17.2 0.16 Allowed 'General case' 0 N--CA 1.506 2.341 1 N-CA-C 123.761 4.726 . . . . 0.0 123.761 -146.323 . . . . . . . . 4 3 . 1 . 010 nuclear nobuild core ' B' B ' 31' ' ' ASN . . . . . . . . . . . . . 15.6 t-20 -56.29 -52.85 62.98 Favored 'General case' 0 CA--C 1.587 2.37 0 O-C-N 117.513 -3.242 . . . . 0.0 113.452 151.498 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 32' ' ' SER . . . . . 0.472 ' HB2' ' H ' ' B' ' 29' ' ' SER 0.299 71.0 m -49.37 -64.74 0.72 Allowed 'General case' 0 N--CA 1.496 1.849 0 N-CA-C 118.09 2.626 . . . . 0.0 118.09 150.329 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 33' ' ' GLU . . . . . 0.479 ' CB ' ' HB2' ' B' ' 23' ' ' ALA 0.27 4.9 tp10 -62.67 -60.15 3.91 Favored 'General case' 0 N--CA 1.513 2.676 0 CA-C-N 124.064 3.12 . . . . 0.0 114.449 -178.195 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 34' ' ' LEU . . . . . 0.541 HD22 HD21 ' B' ' 19' ' ' LEU 0.63 0.1 OUTLIER -53.57 -36.11 61.54 Favored 'General case' 0 CA--C 1.562 1.409 0 CA-C-O 114.607 -2.616 . . . . 0.0 106.548 -177.855 . . . . . . . . 4 4 . 1 . 010 nuclear nobuild core ' B' B ' 35' ' ' LEU . . . . . 0.457 ' HG ' ' CE1' ' A' ' 9' ' ' PHE . 19.6 mt -66.16 -48.95 69.05 Favored 'General case' 0 C--N 1.37 1.484 0 CA-C-N 125.365 3.711 . . . . 0.0 115.926 167.361 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 36' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.14 -45.72 86.87 Favored 'General case' 0 N--CA 1.487 1.382 0 N-CA-C 114.671 1.36 . . . . 0.0 114.671 177.097 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 37' ' ' ILE . . . . . 0.42 ' HA ' ' HB3' ' B' ' 40' ' ' ASP . 3.0 tp -71.09 -28.46 33.06 Favored 'Isoleucine or valine' 0 CA--C 1.579 2.068 0 N-CA-C 116.851 2.167 . . . . 0.0 116.851 164.914 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 38' ' ' VAL . . . . . 0.433 HG21 HD12 ' B' ' 34' ' ' LEU . 2.8 t -83.75 -47.04 18.16 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.312 0 CA-C-N 124.265 3.211 . . . . 0.0 110.708 -177.923 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 26.1 mt-30 -54.53 -40.87 69.07 Favored 'General case' 0 CA--C 1.566 1.572 0 CA-C-O 118.093 -0.956 . . . . 0.0 112.268 158.038 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 40' ' ' ASP . . . . . 0.42 ' HB3' ' HA ' ' B' ' 37' ' ' ILE 0.315 24.9 t0 -46.75 -57.32 4.97 Favored 'General case' 0 N--CA 1.493 1.692 0 N-CA-C 115.881 1.808 . . . . 0.0 115.881 153.06 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 41' ' ' ALA . . . . . . . . . . . . 0.31 . . -78.83 -31.96 45.98 Favored 'General case' 0 N--CA 1.474 0.737 0 N-CA-C 119.12 3.007 . . . . 0.0 119.12 -155.18 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 42' ' ' LEU . . . . . 0.405 HD13 ' HB3' ' A' ' 18' ' ' LYS . 2.1 pp . . . . . 0 CA--C 1.563 1.474 0 N-CA-C 117.261 2.319 . . . . 0.0 117.261 159.216 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . 0.3 2.5 p30 . . . . . 0 CA--C 1.567 1.614 0 N-CA-C 113.361 0.874 . . . . 0.0 113.361 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 47.8 Cg_endo -81.9 168.26 15.75 Favored 'Trans proline' 0 CA--C 1.567 2.159 0 C-N-CA 123.557 2.838 . . . . 0.0 115.983 176.492 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 65.0 m80 -108.75 144.93 35.91 Favored 'General case' 0 CA--C 1.567 1.607 0 CA-C-N 113.068 -1.878 . . . . 0.0 112.35 -165.438 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . 0.809 ' CZ ' HD12 ' B' ' 34' ' ' LEU . 20.2 p90 -138.46 150.08 46.1 Favored 'General case' 0 CA--C 1.564 1.51 0 O-C-N 120.062 -1.649 . . . . 0.0 111.397 142.63 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 11.7 m120 -71.98 83.48 0.96 Allowed 'General case' 0 N--CA 1.491 1.612 0 O-C-N 120.089 -1.632 . . . . 0.0 111.689 170.083 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . 0.683 ' CD2' HD13 ' B' ' 34' ' ' LEU . 6.1 t80 -64.09 147.19 52.76 Favored 'General case' 0 CA--C 1.55 0.943 0 CA-C-O 125.313 2.482 . . . . 0.0 112.026 167.717 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 2.7 tmm_? -144.27 110.06 5.31 Favored 'General case' 0 C--N 1.304 -1.379 0 CA-C-N 111.166 -2.743 . . . . 0.0 104.974 -152.369 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 1.2 mpp? -116.12 116.2 40.11 Favored Pre-proline 0 CA--C 1.562 1.437 0 CA-C-O 117.64 -1.172 . . . . 0.0 111.764 -170.536 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_exo -41.55 140.35 1.74 Allowed 'Trans proline' 0 CA--C 1.559 1.768 0 C-N-CA 122.958 2.439 . . . . 0.0 115.575 156.411 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . 0.497 ' SD ' ' HG2' ' A' ' 17' ' ' GLU . 25.0 tpp -57.85 -29.04 64.66 Favored 'General case' 0 N--CA 1.496 1.858 0 N-CA-C 118.173 2.657 . . . . 0.0 118.173 -158.87 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -57.43 -52.21 66.29 Favored 'General case' 0 CA--C 1.566 1.594 0 N-CA-C 117.696 2.48 . . . . 0.0 117.696 160.343 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -58.79 -49.45 82.82 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.249 0 CA-C-N 122.087 2.221 . . . . 0.0 112.507 172.207 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . 0.262 1.1 ttt180 -72.39 -37.54 68.7 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-O 115.405 -2.236 . . . . 0.0 115.191 176.959 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 0.497 ' HG2' ' SD ' ' A' ' 13' ' ' MET . 41.8 mm-40 -62.42 -38.56 90.16 Favored 'General case' 0 CA--C 1.559 1.313 0 CA-C-N 124.485 3.311 . . . . 0.0 113.659 164.899 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . 0.576 26.5 pttt -74.72 -36.56 62.67 Favored 'General case' 0 CA--C 1.565 1.543 0 N-CA-C 117.777 2.51 . . . . 0.0 117.777 174.53 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.537 HD21 HD22 ' A' ' 34' ' ' LEU 0.253 11.2 tp -74.41 -34.91 63.38 Favored 'General case' 0 CA--C 1.574 1.891 0 N-CA-C 114.868 1.433 . . . . 0.0 114.868 167.978 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.408 ' HB2' ' SD ' ' A' ' 30' ' ' MET . 2.2 ttpt -91.09 -31.27 16.32 Favored 'General case' 0 CA--C 1.57 1.715 0 O-C-N 120.124 -1.61 . . . . 0.0 113.631 179.908 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 22.7 m-85 -57.41 -68.58 0.22 Allowed 'General case' 0 N--CA 1.496 1.828 0 CA-C-O 113.649 -3.072 . . . . 0.0 110.416 153.977 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . 0.287 30.7 ttt85 -29.4 -43.38 0.03 OUTLIER 'General case' 0 CA--C 1.598 2.81 1 CA-C-N 126.017 4.008 . . . . 0.0 117.676 166.169 . . . . . . . . 3 2 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.477 ' HB2' ' CB ' ' A' ' 33' ' ' GLU 0.289 . . -60.05 -71.36 0.13 Allowed 'General case' 0 CA--C 1.589 2.476 0 O-C-N 118.484 -2.635 . . . . 0.0 116.93 159.508 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 . . . . . 0 N--CA 1.502 2.147 0 N-CA-C 118.477 2.769 . . . . 0.0 118.477 177.371 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.439 ' HE ' ' HG2' ' A' ' 33' ' ' GLU . 1.4 mpp_? . . . . . 0 CA--C 1.575 1.91 0 CA-C-O 122.597 1.189 . . . . 0.0 108.0 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . 0.401 ' H ' ' HB3' ' A' ' 32' ' ' SER . 35.0 t -132.86 112.08 11.62 Favored 'General case' 0 N--CA 1.501 2.104 0 O-C-N 118.602 -2.561 . . . . 0.0 106.921 179.88 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' MET . . . . . 0.408 ' SD ' ' HB2' ' A' ' 20' ' ' LYS . 26.5 mtp -46.12 -31.78 2.56 Favored 'General case' 0 N--CA 1.501 2.105 0 N-CA-C 121.552 3.908 . . . . 0.0 121.552 -138.947 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . 0.275 5.6 t-20 -51.12 -50.91 57.92 Favored 'General case' 0 CA--C 1.59 2.486 0 O-C-N 118.506 -2.622 . . . . 0.0 114.11 160.51 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . 0.401 ' HB3' ' H ' ' A' ' 29' ' ' SER 0.308 22.8 t -44.44 -68.08 0.23 Allowed 'General case' 0 N--CA 1.503 2.211 0 N-CA-C 117.055 2.243 . . . . 0.0 117.055 143.987 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . 0.477 ' CB ' ' HB2' ' A' ' 23' ' ' ALA . 4.9 tm-20 -70.28 -54.79 11.19 Favored 'General case' 0 N--CA 1.505 2.293 0 N-CA-C 118.606 2.817 . . . . 0.0 118.606 -168.157 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.537 HD22 HD21 ' A' ' 19' ' ' LEU 0.589 0.0 OUTLIER -52.2 -34.03 43.55 Favored 'General case' 0 CA--C 1.574 1.87 0 CA-C-O 114.192 -2.813 . . . . 0.0 107.618 168.549 . . . . . . . . 4 4 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 21.7 mt -65.7 -46.1 80.27 Favored 'General case' 0 N--CA 1.495 1.787 1 CA-C-N 126.835 4.379 . . . . 0.0 116.257 164.853 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -60.92 -45.1 96.03 Favored 'General case' 0 N--CA 1.488 1.455 0 N-CA-C 114.779 1.4 . . . . 0.0 114.779 178.606 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . 0.27 2.8 tt -60.56 -46.36 95.68 Favored 'Isoleucine or valine' 0 CA--C 1.566 1.573 0 CA-C-O 114.866 -2.492 . . . . 0.0 116.453 156.553 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.433 HG12 ' CG1' ' B' ' 15' ' ' VAL . 3.3 t -71.26 -44.75 72.89 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.215 0 CA-C-N 123.93 3.059 . . . . 0.0 111.676 -169.747 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 23.8 mt-30 -55.7 -45.61 77.83 Favored 'General case' 0 CA--C 1.565 1.551 0 C-N-CA 124.423 1.089 . . . . 0.0 112.776 158.503 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . 0.475 0.9 OUTLIER -49.52 -34.84 18.29 Favored 'General case' 0 N--CA 1.5 2.055 0 N-CA-C 118.648 2.832 . . . . 0.0 118.648 156.74 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.545 0.771 0 C-N-CA 123.914 0.886 . . . . 0.0 111.113 -166.509 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo . . . . . 0 CA--C 1.549 1.23 0 N-CA-C 113.991 0.727 . . . . 0.0 113.991 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' B' B ' 6' ' ' HIS . . . . . . . . . . . . . 75.0 m80 -82.04 115.24 21.09 Favored 'General case' 0 CA--C 1.567 1.601 0 CA-C-N 114.137 -1.392 . . . . 0.0 111.109 170.833 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 7' ' ' PHE . . . . . 0.489 ' CZ ' HD23 ' A' ' 34' ' ' LEU . 1.1 p90 -118.51 150.23 39.97 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 120.856 -1.153 . . . . 0.0 109.855 159.959 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 8' ' ' ASN . . . . . . . . . . . . . 18.2 m120 -68.94 91.02 0.45 Allowed 'General case' 0 N--CA 1.489 1.492 0 O-C-N 120.472 -1.392 . . . . 0.0 112.512 171.077 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 9' ' ' PHE . . . . . 0.544 ' HD2' HD11 ' B' ' 34' ' ' LEU . 4.4 t80 -77.8 146.42 35.8 Favored 'General case' 0 CA--C 1.564 1.486 0 CA-C-O 125.836 2.732 . . . . 0.0 109.592 153.725 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 177.78 102.75 0.02 OUTLIER 'General case' 0 N--CA 1.487 1.381 0 CA-C-N 112.59 -2.095 . . . . 0.0 106.699 -130.363 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 11' ' ' MET . . . . . 0.499 ' SD ' ' HG3' ' B' ' 16' ' ' ARG . 0.9 OUTLIER -132.73 136.53 27.96 Favored Pre-proline 0 N--CA 1.491 1.623 0 CA-C-O 117.549 -1.215 . . . . 0.0 113.677 -154.486 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 12' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -59.19 154.25 47.34 Favored 'Trans proline' 0 CA--C 1.565 2.041 0 CA-C-N 122.692 1.997 . . . . 0.0 114.087 168.517 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 13' ' ' MET . . . . . 0.431 ' SD ' ' HG3' ' B' ' 17' ' ' GLU . 4.7 tpp -61.77 -37.45 84.35 Favored 'General case' 0 N--CA 1.487 1.422 0 N-CA-C 118.365 2.728 . . . . 0.0 118.365 -146.66 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 -61.81 -40.92 96.93 Favored 'General case' 0 CA--C 1.566 1.566 0 N-CA-C 116.428 2.01 . . . . 0.0 116.428 167.139 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 15' ' ' VAL . . . . . 0.433 ' CG1' HG12 ' A' ' 38' ' ' VAL . 0.2 OUTLIER -63.09 -49.43 83.4 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.08 0 CA-C-N 123.293 2.769 . . . . 0.0 111.921 171.788 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 16' ' ' ARG . . . . . 0.499 ' HG3' ' SD ' ' B' ' 11' ' ' MET 0.296 6.0 ttt180 -70.45 -37.05 74.28 Favored 'General case' 0 N--CA 1.477 0.908 0 CA-C-N 121.729 2.059 . . . . 0.0 115.997 175.341 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 17' ' ' GLU . . . . . 0.431 ' HG3' ' SD ' ' B' ' 13' ' ' MET . 37.6 mt-10 -63.03 -39.44 94.74 Favored 'General case' 0 N--CA 1.491 1.609 0 CA-C-N 123.548 2.886 . . . . 0.0 114.234 163.473 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . 0.257 53.6 mtmt -65.0 -49.09 71.61 Favored 'General case' 0 CA--C 1.563 1.452 0 CA-C-N 121.921 2.146 . . . . 0.0 115.344 170.352 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 19' ' ' LEU . . . . . 0.505 HD21 ' CD2' ' B' ' 34' ' ' LEU 0.263 11.9 tp -65.75 -39.69 91.33 Favored 'General case' 0 CA--C 1.568 1.668 0 CA-C-N 120.759 1.618 . . . . 0.0 114.336 173.791 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 20' ' ' LYS . . . . . . . . . . . . . 12.1 ttpt -84.84 -31.31 23.88 Favored 'General case' 0 CA--C 1.557 1.238 0 C-N-CA 125.244 1.418 . . . . 0.0 114.36 179.621 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 20.0 m-85 -60.91 -74.1 0.08 Allowed 'General case' 0 N--CA 1.49 1.531 0 CA-C-O 112.282 -3.723 . . . . 0.0 110.583 154.711 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . 0.292 8.7 ttt180 -16.84 -57.96 0.01 OUTLIER 'General case' 0 CA--C 1.586 2.347 1 CA-C-N 126.487 4.221 . . . . 0.0 116.699 168.866 . . . . . . . . 3 2 . 1 . 011 nuclear nobuild core ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -53.41 -72.31 0.06 Allowed 'General case' 0 CA--C 1.583 2.242 1 N-CA-C 122.153 4.131 . . . . 0.0 122.153 156.896 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 49.3 mt-10 -66.92 -38.71 86.72 Favored 'General case' 0 N--CA 1.505 2.305 0 N-CA-C 118.138 2.644 . . . . 0.0 118.138 177.144 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 25' ' ' ALA . . . . . . . . . . . . . . . -38.5 -48.47 1.4 Allowed 'General case' 0 CA--C 1.585 2.325 0 N-CA-C 116.493 2.034 . . . . 0.0 116.493 155.883 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 26' ' ' ASN . . . . . 0.415 HD21 ' HB2' ' B' ' 28' ' ' ARG . 0.0 OUTLIER -101.27 -48.01 4.52 Favored 'General case' 0 CA--C 1.578 2.031 0 N-CA-C 116.626 2.084 . . . . 0.0 116.626 -173.748 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 27' ' ' GLY . . . . . . . . . . . . . . . 117.95 39.41 0.76 Allowed Glycine 0 CA--C 1.558 2.754 0 N-CA-C 117.774 1.87 . . . . 0.0 117.774 -157.75 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 28' ' ' ARG . . . . . 0.415 ' HB2' HD21 ' B' ' 26' ' ' ASN . 3.1 mtt85 -138.14 97.97 3.52 Favored 'General case' 0 N--CA 1.492 1.663 0 CA-C-N 119.936 1.868 . . . . 0.0 106.078 174.852 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 29' ' ' SER . . . . . . . . . . . . . 32.2 t -75.82 127.88 33.96 Favored 'General case' 0 N--CA 1.504 2.26 0 O-C-N 117.758 -3.089 . . . . 0.0 107.92 -162.301 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 30' ' ' MET . . . . . . . . . . . . . 25.4 mtp -44.93 -42.7 8.35 Favored 'General case' 0 N--CA 1.503 2.198 0 N-CA-C 118.663 2.838 . . . . 0.0 118.663 -144.973 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 31' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -46.26 -40.7 11.93 Favored 'General case' 0 CA--C 1.595 2.688 0 CA-C-N 125.245 3.657 . . . . 0.0 115.788 165.899 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 32' ' ' SER . . . . . . . . . . . . 0.28 40.4 t -56.4 -66.36 0.45 Allowed 'General case' 0 N--CA 1.498 1.963 0 N-CA-C 119.361 3.097 . . . . 0.0 119.361 148.133 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 8.1 tp10 -66.22 -56.27 12.12 Favored 'General case' 0 N--CA 1.515 2.807 0 CA-C-N 124.007 3.094 . . . . 0.0 114.739 -177.857 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 34' ' ' LEU . . . . . 0.809 HD12 ' CZ ' ' A' ' 7' ' ' PHE . 0.0 OUTLIER -37.64 -52.61 1.23 Allowed 'General case' 0 CA--C 1.546 0.81 0 CA-C-O 115.614 -2.136 . . . . 0.0 109.379 165.935 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 35' ' ' LEU . . . . . 0.417 HD23 ' HA ' ' B' ' 35' ' ' LEU . 9.5 mt -62.37 -53.13 59.42 Favored 'General case' 0 N--CA 1.485 1.321 0 CA-C-N 123.984 3.084 . . . . 0.0 115.306 175.148 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 36' ' ' GLN . . . . . . . . . . . . 0.271 0.5 OUTLIER -63.89 -33.12 74.99 Favored 'General case' 0 CA--C 1.58 2.109 0 N-CA-C 115.963 1.838 . . . . 0.0 115.963 179.644 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 37' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -71.71 -31.05 40.41 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.703 0 CA-C-N 121.058 1.754 . . . . 0.0 115.183 160.905 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 38' ' ' VAL . . . . . 0.429 ' CG1' HD22 ' A' ' 19' ' ' LEU . 2.4 t -80.15 -49.02 19.58 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.262 0 CA-C-N 122.682 2.492 . . . . 0.0 112.328 -179.033 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 32.4 mt-30 -47.01 -41.41 16.39 Favored 'General case' 0 CA--C 1.563 1.448 0 CA-C-O 116.72 -1.61 . . . . 0.0 113.856 149.447 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 40' ' ' ASP . . . . . . . . . . . . 0.447 8.1 t70 -51.32 -55.07 20.33 Favored 'General case' 0 N--CA 1.497 1.899 0 CA-C-N 121.766 2.075 . . . . 0.0 115.936 155.212 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -73.63 -33.31 64.49 Favored 'General case' 0 CA--C 1.552 1.023 0 N-CA-C 116.431 2.012 . . . . 0.0 116.431 -153.467 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.488 1.444 0 N-CA-C 118.691 2.849 . . . . 0.0 118.691 156.273 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 12.1 p-10 . . . . . 0 CA--C 1.57 1.714 0 CA-C-O 118.761 -0.638 . . . . 0.0 110.485 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_exo -98.21 145.95 0.64 Allowed 'Trans proline' 0 C--N 1.364 1.39 0 CA-C-N 123.059 2.128 . . . . 0.0 114.537 -153.793 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 81.0 m80 -75.46 132.85 41.1 Favored 'General case' 0 CA--C 1.563 1.475 0 CA-C-N 113.999 -1.455 . . . . 0.0 112.603 174.569 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . 0.645 ' CZ ' HD23 ' B' ' 34' ' ' LEU . 5.1 p90 -133.28 154.21 50.89 Favored 'General case' 0 CA--C 1.563 1.444 0 O-C-N 120.815 -1.178 . . . . 0.0 110.412 146.843 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 4.2 p-10 -59.77 86.44 0.01 OUTLIER 'General case' 0 CA--C 1.566 1.568 0 N-CA-C 115.744 1.757 . . . . 0.0 115.744 168.193 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . 0.424 ' HD2' HD21 ' A' ' 34' ' ' LEU 0.26 2.6 t80 -82.26 141.51 32.88 Favored 'General case' 0 CA--C 1.564 1.511 0 CA-C-O 126.375 2.988 . . . . 0.0 110.273 162.019 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 23.2 ttt85 -166.56 121.43 1.13 Allowed 'General case' 0 C--N 1.309 -1.174 0 CA-C-N 111.466 -2.607 . . . . 0.0 107.911 -146.482 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 2.3 mpt? -133.63 119.49 15.09 Favored Pre-proline 0 CA--C 1.56 1.336 0 CA-C-O 117.73 -1.129 . . . . 0.0 111.314 -148.498 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_exo -46.59 146.27 5.47 Favored 'Trans proline' 0 CA--C 1.561 1.841 0 C-N-CA 122.68 2.253 . . . . 0.0 114.931 161.61 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.4 tpp -64.83 -27.99 69.25 Favored 'General case' 0 CA--C 1.568 1.672 0 N-CA-C 118.386 2.736 . . . . 0.0 118.386 -151.188 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . 0.25 8.2 pt-20 -64.63 -43.71 92.83 Favored 'General case' 0 CA--C 1.566 1.593 0 N-CA-C 116.654 2.094 . . . . 0.0 116.654 160.609 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -59.7 -48.2 88.38 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.275 0 CA-C-N 123.269 2.759 . . . . 0.0 112.603 173.231 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 2.0 ttt180 -71.36 -40.28 70.76 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-O 116.265 -1.826 . . . . 0.0 115.611 174.486 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -60.85 -38.71 86.45 Favored 'General case' 0 CA--C 1.567 1.62 0 CA-C-N 123.349 2.795 . . . . 0.0 114.007 166.036 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 52.2 mtmt -66.9 -51.1 59.46 Favored 'General case' 0 CA--C 1.562 1.42 0 CA-C-N 121.362 1.892 . . . . 0.0 115.363 170.791 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.626 HD21 HD22 ' A' ' 34' ' ' LEU 0.281 14.1 tp -65.44 -39.76 92.46 Favored 'General case' 0 CA--C 1.566 1.564 0 N-CA-C 115.542 1.682 . . . . 0.0 115.542 173.863 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 18.9 ttpt -88.2 -25.97 22.63 Favored 'General case' 0 CA--C 1.567 1.629 0 C-N-CA 124.923 1.289 . . . . 0.0 113.922 -179.754 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 19.5 m-30 -67.47 -66.72 0.53 Allowed 'General case' 0 N--CA 1.493 1.693 0 CA-C-O 113.929 -2.938 . . . . 0.0 110.812 158.545 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . 0.336 1.6 tmt_? -27.04 -45.99 0.03 OUTLIER 'General case' 0 CA--C 1.602 2.944 0 CA-C-N 125.699 3.863 . . . . 0.0 114.614 164.528 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.498 ' HB2' ' HB3' ' A' ' 33' ' ' GLU . . . -59.73 -74.87 0.06 Allowed 'General case' 0 CA--C 1.585 2.29 0 N-CA-C 117.298 2.333 . . . . 0.0 117.298 159.314 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 . . . . . 0 N--CA 1.502 2.141 0 N-CA-C 118.72 2.859 . . . . 0.0 118.72 -179.023 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 24.5 mtm-85 . . . . . 0 N--CA 1.491 1.594 0 N-CA-C 107.161 -1.422 . . . . 0.0 107.161 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 43.1 t -114.6 113.73 24.77 Favored 'General case' 0 N--CA 1.496 1.845 0 N-CA-C 104.35 -2.463 . . . . 0.0 104.35 -178.082 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 6.2 mtp -38.03 -40.32 0.47 Allowed 'General case' 0 N--CA 1.501 2.084 0 N-CA-C 121.01 3.708 . . . . 0.0 121.01 -152.111 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . 0.253 0.1 OUTLIER -47.87 -46.79 31.71 Favored 'General case' 0 CA--C 1.592 2.56 0 O-C-N 118.575 -2.578 . . . . 0.0 115.446 163.93 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . 0.354 38.4 t -47.4 -76.14 0.02 OUTLIER 'General case' 0 N--CA 1.5 2.064 0 N-CA-C 118.151 2.649 . . . . 0.0 118.151 142.444 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . 0.498 ' HB3' ' HB2' ' A' ' 23' ' ' ALA . 8.5 tp10 -62.87 -56.76 14.42 Favored 'General case' 0 N--CA 1.507 2.39 0 CA-C-N 123.185 2.72 . . . . 0.0 117.261 -170.057 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.734 HD23 ' CZ ' ' B' ' 7' ' ' PHE 0.458 0.4 OUTLIER -47.04 -42.01 17.74 Favored 'General case' 0 CA--C 1.563 1.445 0 CA-C-O 113.274 -3.251 . . . . 0.0 107.313 168.863 . . . . . . . . 4 4 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 12.8 mt -61.09 -48.09 83.32 Favored 'General case' 0 N--CA 1.499 1.996 1 CA-C-N 127.11 4.504 . . . . 0.0 116.529 166.201 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.28 -43.32 99.07 Favored 'General case' 0 N--CA 1.487 1.41 0 N-CA-C 115.544 1.683 . . . . 0.0 115.544 -179.145 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 5.4 tt -67.57 -35.44 73.09 Favored 'Isoleucine or valine' 0 C--O 1.199 -1.597 0 CA-C-O 114.29 -2.767 . . . . 0.0 115.781 160.508 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.417 HG21 HD12 ' A' ' 34' ' ' LEU . 2.1 t -75.04 -47.67 35.51 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.143 0 CA-C-N 124.398 3.272 . . . . 0.0 112.619 -174.527 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 32.9 mt-30 -50.52 -46.71 57.41 Favored 'General case' 0 N--CA 1.486 1.341 0 N-CA-C 113.116 0.784 . . . . 0.0 113.116 156.026 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . 0.807 0.0 OUTLIER -55.83 -34.24 65.2 Favored 'General case' 0 CA--C 1.576 1.972 0 N-CA-C 119.555 3.169 . . . . 0.0 119.555 159.971 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.105 0 N-CA-C 115.142 1.534 . . . . 0.0 115.142 -166.307 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 62.7 Cg_endo . . . . . 0 CA--C 1.566 2.107 0 N-CA-C 116.127 1.549 . . . . 0.0 116.127 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' B' B ' 6' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -153.68 159.95 42.2 Favored 'General case' 0 CA--C 1.552 1.028 0 CA-C-N 113.797 -1.547 . . . . 0.0 114.88 -149.802 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 7' ' ' PHE . . . . . 0.734 ' CZ ' HD23 ' A' ' 34' ' ' LEU . 36.9 p90 -142.29 156.58 45.28 Favored 'General case' 0 CA--C 1.56 1.328 0 CA-C-O 122.499 1.142 . . . . 0.0 109.145 161.01 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 8' ' ' ASN . . . . . . . . . . . . . 91.6 m-20 -76.0 87.27 2.93 Favored 'General case' 0 CA--C 1.566 1.581 0 O-C-N 119.922 -1.736 . . . . 0.0 110.716 172.128 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 9' ' ' PHE . . . . . . . . . . . . . 4.8 t80 -62.7 142.3 58.18 Favored 'General case' 0 CA--C 1.56 1.35 0 CA-C-O 125.323 2.487 . . . . 0.0 111.245 171.001 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -148.05 96.78 2.69 Favored 'General case' 0 N--CA 1.486 1.358 0 CA-C-N 111.657 -2.52 . . . . 0.0 107.986 -147.015 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 11' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -114.23 118.26 42.26 Favored Pre-proline 0 CA--C 1.567 1.607 0 CA-C-O 117.135 -1.412 . . . . 0.0 112.012 -156.053 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 12' ' ' PRO . . . . . . . . . . . . . 80.3 Cg_exo -42.57 140.57 2.67 Favored 'Trans proline' 0 C--N 1.373 1.848 0 C-N-CA 123.389 2.726 . . . . 0.0 116.252 164.544 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 13' ' ' MET . . . . . . . . . . . . . 25.9 tpp -58.71 -26.53 64.0 Favored 'General case' 0 N--CA 1.498 1.931 0 N-CA-C 119.003 2.964 . . . . 0.0 119.003 -157.818 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 14' ' ' GLU . . . . . . . . . . . . 0.297 7.0 pt-20 -61.28 -50.96 70.92 Favored 'General case' 0 CA--C 1.566 1.588 0 N-CA-C 115.905 1.817 . . . . 0.0 115.905 160.161 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -58.8 -52.88 54.87 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.794 0 CA-C-N 122.092 2.224 . . . . 0.0 112.109 174.013 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 16' ' ' ARG . . . . . . . . . . . . 0.261 1.8 ttt180 -69.01 -33.21 73.27 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-N 122.255 2.298 . . . . 0.0 115.857 177.889 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 17' ' ' GLU . . . . . . . . . . . . . 5.4 pt-20 -65.3 -44.73 86.98 Favored 'General case' 0 N--CA 1.487 1.385 0 CA-C-N 123.326 2.784 . . . . 0.0 113.948 164.988 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . 0.296 52.5 mtmt -53.12 -55.86 20.8 Favored 'General case' 0 N--CA 1.487 1.412 0 N-CA-C 115.765 1.765 . . . . 0.0 115.765 166.006 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 19' ' ' LEU . . . . . 0.702 HD13 HD22 ' B' ' 34' ' ' LEU . 0.3 OUTLIER -71.87 -32.91 67.94 Favored 'General case' 0 CA--C 1.566 1.558 0 N-CA-C 116.321 1.971 . . . . 0.0 116.321 -179.984 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 20' ' ' LYS . . . . . 0.409 ' HA ' ' HB3' ' B' ' 23' ' ' ALA . 7.6 ttpt -87.29 -21.62 25.65 Favored 'General case' 0 CA--C 1.57 1.72 0 C-N-CA 124.78 1.232 . . . . 0.0 113.78 173.413 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 21' ' ' PHE . . . . . 0.444 ' O ' ' HB3' ' B' ' 25' ' ' ALA . 10.5 m-85 -66.25 -66.7 0.52 Allowed 'General case' 0 N--CA 1.49 1.53 0 CA-C-N 122.132 2.242 . . . . 0.0 110.635 155.195 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 22' ' ' ARG . . . . . 0.571 ' HE ' HG13 ' B' ' 37' ' ' ILE 0.274 1.8 tpt180 -21.48 -53.27 0.02 OUTLIER 'General case' 0 CA--C 1.596 2.742 0 CA-C-N 124.459 3.299 . . . . 0.0 115.259 160.052 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 23' ' ' ALA . . . . . 0.41 ' HB2' ' HB3' ' B' ' 33' ' ' GLU 0.318 . . -54.18 -77.0 0.03 OUTLIER 'General case' 0 CA--C 1.577 2.0 0 N-CA-C 120.546 3.536 . . . . 0.0 120.546 154.066 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 50.6 mm-40 -74.19 -34.38 63.73 Favored 'General case' 0 CA--C 1.576 1.968 0 N-CA-C 118.766 2.876 . . . . 0.0 118.766 -175.836 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 25' ' ' ALA . . . . . 0.444 ' HB3' ' O ' ' B' ' 21' ' ' PHE . . . -46.2 -52.41 12.45 Favored 'General case' 0 CA--C 1.579 2.083 0 N-CA-C 116.015 1.857 . . . . 0.0 116.015 154.562 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 26' ' ' ASN . . . . . . . . . . . . . 72.0 m-20 -82.5 -56.8 3.66 Favored 'General case' 0 CA--C 1.575 1.935 0 N-CA-C 114.536 1.31 . . . . 0.0 114.536 179.236 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 27' ' ' GLY . . . . . . . . . . . . . . . 128.17 28.28 0.86 Allowed Glycine 0 CA--C 1.561 2.952 0 N-CA-C 119.037 2.375 . . . . 0.0 119.037 -166.703 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 28' ' ' ARG . . . . . . . . . . . . 0.254 8.3 mtm-85 -118.13 166.13 12.94 Favored 'General case' 0 N--CA 1.497 1.92 0 N-CA-C 105.682 -1.97 . . . . 0.0 105.682 159.929 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 29' ' ' SER . . . . . 0.465 ' H ' ' HB3' ' B' ' 32' ' ' SER . 87.4 p -115.85 113.24 23.09 Favored 'General case' 0 N--CA 1.498 1.935 0 O-C-N 118.836 -2.415 . . . . 0.0 105.244 -173.098 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 30' ' ' MET . . . . . 0.475 ' CE ' ' HB3' ' B' ' 19' ' ' LEU . 13.3 mtp -36.76 -39.5 0.22 Allowed 'General case' 0 N--CA 1.502 2.174 0 N-CA-C 121.397 3.851 . . . . 0.0 121.397 -147.87 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 31' ' ' ASN . . . . . . . . . . . . 0.3 0.5 OUTLIER -48.56 -50.47 32.06 Favored 'General case' 0 CA--C 1.587 2.368 0 O-C-N 118.857 -2.402 . . . . 0.0 114.662 162.945 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 32' ' ' SER . . . . . 0.465 ' HB3' ' H ' ' B' ' 29' ' ' SER 0.361 35.4 t -47.6 -69.95 0.11 Allowed 'General case' 0 N--CA 1.497 1.923 0 N-CA-C 118.392 2.738 . . . . 0.0 118.392 144.449 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 33' ' ' GLU . . . . . 0.41 ' HB3' ' HB2' ' B' ' 23' ' ' ALA . 6.6 tm-20 -76.15 -50.06 15.61 Favored 'General case' 0 N--CA 1.51 2.569 0 CA-C-N 123.978 3.081 . . . . 0.0 119.022 -169.496 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 34' ' ' LEU . . . . . 0.702 HD22 HD13 ' B' ' 19' ' ' LEU 0.47 0.3 OUTLIER -47.06 -39.12 12.34 Favored 'General case' 0 CA--C 1.579 2.09 0 CA-C-O 113.679 -3.057 . . . . 0.0 107.226 161.82 . . . . . . . . 4 4 . 1 . 012 nuclear nobuild core ' B' B ' 35' ' ' LEU . . . . . 0.414 ' HG ' ' CE1' ' A' ' 9' ' ' PHE . 16.1 mt -65.19 -53.15 49.19 Favored 'General case' 0 N--CA 1.499 1.975 1 CA-C-N 127.692 4.769 . . . . 0.0 114.795 166.341 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 36' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -60.96 -33.79 73.76 Favored 'General case' 0 N--CA 1.493 1.688 0 N-CA-C 115.911 1.819 . . . . 0.0 115.911 -178.034 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 37' ' ' ILE . . . . . 0.571 HG13 ' HE ' ' B' ' 22' ' ' ARG . 0.4 OUTLIER -72.35 -42.2 65.25 Favored 'Isoleucine or valine' 0 C--O 1.2 -1.516 0 CA-C-O 115.115 -2.374 . . . . 0.0 115.383 159.409 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 38' ' ' VAL . . . . . 0.406 ' CG1' HD22 ' A' ' 19' ' ' LEU . 3.0 t -71.79 -48.71 49.9 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.408 0 CA-C-N 124.532 3.333 . . . . 0.0 113.111 -177.18 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 24.3 mt-30 -47.72 -51.1 23.27 Favored 'General case' 0 N--CA 1.476 0.856 0 CA-C-O 115.518 -2.182 . . . . 0.0 111.336 155.216 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 40' ' ' ASP . . . . . . . . . . . . 0.69 0.0 OUTLIER -44.1 -51.99 7.55 Favored 'General case' 0 N--CA 1.493 1.71 0 N-CA-C 117.274 2.324 . . . . 0.0 117.274 161.873 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 41' ' ' ALA . . . . . . . . . . . . 0.305 . . -80.18 -27.68 38.87 Favored 'General case' 0 CA--C 1.562 1.426 0 N-CA-C 116.507 2.04 . . . . 0.0 116.507 -159.812 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 1.1 pp . . . . . 0 N--CA 1.489 1.523 0 N-CA-C 118.217 2.673 . . . . 0.0 118.217 158.112 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 47.8 t0 . . . . . 0 CA--C 1.571 1.757 0 N-CA-C 108.549 -0.908 . . . . 0.0 108.549 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 2.8 Cg_endo -106.07 149.68 0.12 Allowed 'Trans proline' 0 C--N 1.371 1.722 0 C-N-CA 122.461 2.107 . . . . 0.0 114.643 -164.723 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 74.5 m80 -89.89 138.52 31.42 Favored 'General case' 0 N--CA 1.489 1.485 0 N-CA-C 113.605 0.965 . . . . 0.0 113.605 -178.744 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . 0.781 ' CZ ' HD12 ' B' ' 34' ' ' LEU . 15.8 p90 -128.26 157.35 41.15 Favored 'General case' 0 CA--C 1.566 1.583 0 O-C-N 120.193 -1.567 . . . . 0.0 110.726 144.654 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 85.5 m-20 -71.4 88.02 0.88 Allowed 'General case' 0 N--CA 1.491 1.598 0 O-C-N 119.938 -1.726 . . . . 0.0 111.666 169.956 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . 0.604 ' CD2' HD13 ' B' ' 34' ' ' LEU . 2.2 t80 -66.45 151.33 47.42 Favored 'General case' 0 CA--C 1.556 1.185 0 CA-C-O 125.319 2.485 . . . . 0.0 111.014 157.728 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -166.97 99.87 0.54 Allowed 'General case' 0 N--CA 1.488 1.428 0 CA-C-N 111.666 -2.516 . . . . 0.0 108.074 -142.545 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 1.3 mpt? -125.43 117.4 25.0 Favored Pre-proline 0 CA--C 1.561 1.392 0 CA-C-O 116.727 -1.606 . . . . 0.0 112.831 -151.213 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 82.7 Cg_exo -42.66 145.98 0.9 Allowed 'Trans proline' 0 CA--C 1.561 1.869 0 C-N-CA 123.062 2.508 . . . . 0.0 116.679 166.13 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -52.61 -38.45 60.2 Favored 'General case' 0 N--CA 1.498 1.932 0 N-CA-C 117.43 2.382 . . . . 0.0 117.43 -160.713 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . 0.26 9.9 pt-20 -64.59 -42.54 95.52 Favored 'General case' 0 CA--C 1.563 1.476 0 N-CA-C 116.719 2.118 . . . . 0.0 116.719 167.239 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -60.55 -50.31 80.89 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.191 0 CA-C-N 123.977 3.08 . . . . 0.0 113.005 173.795 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 1.2 ttt180 -68.65 -40.95 80.01 Favored 'General case' 0 C--O 1.215 -0.722 0 CA-C-O 115.983 -1.961 . . . . 0.0 115.467 173.191 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -58.5 -41.41 85.3 Favored 'General case' 0 CA--C 1.565 1.521 0 CA-C-N 123.858 3.026 . . . . 0.0 114.427 164.033 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . 0.277 48.8 mtmt -63.07 -54.67 34.4 Favored 'General case' 0 CA--C 1.562 1.418 0 CA-C-N 121.337 1.88 . . . . 0.0 115.046 169.94 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.728 HD13 HD22 ' A' ' 34' ' ' LEU . 9.0 mt -62.53 -38.16 88.88 Favored 'General case' 0 CA--C 1.57 1.747 0 N-CA-C 116.532 2.049 . . . . 0.0 116.532 172.832 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 14.3 ttpt -89.32 -24.94 21.88 Favored 'General case' 0 CA--C 1.57 1.718 0 C-N-CA 125.202 1.401 . . . . 0.0 113.19 -177.733 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 13.3 m-30 -65.23 -65.29 0.69 Allowed 'General case' 0 N--CA 1.49 1.571 0 CA-C-O 115.374 -2.25 . . . . 0.0 111.051 154.363 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . 0.273 7.3 ttm180 -20.71 -54.59 0.02 OUTLIER 'General case' 0 CA--C 1.587 2.401 0 CA-C-N 124.416 3.28 . . . . 0.0 115.922 158.146 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.437 ' HB2' ' HB3' ' A' ' 33' ' ' GLU 0.287 . . -57.87 -74.33 0.06 Allowed 'General case' 0 CA--C 1.585 2.319 0 N-CA-C 118.512 2.782 . . . . 0.0 118.512 158.919 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 15.6 mm-40 . . . . . 0 N--CA 1.499 1.976 0 N-CA-C 118.814 2.894 . . . . 0.0 118.814 -175.621 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . 0.502 HH11 ' HG3' ' A' ' 28' ' ' ARG 0.305 2.7 mtm-85 . . . . . 0 CA--C 1.576 1.958 0 N-CA-C 105.541 -2.022 . . . . 0.0 105.541 . . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . 0.4 ' H ' ' HB3' ' A' ' 32' ' ' SER . 28.4 t -126.69 112.7 15.75 Favored 'General case' 0 N--CA 1.506 2.346 0 O-C-N 117.359 -3.338 . . . . 0.0 106.59 -173.793 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' MET . . . . . 0.498 ' CE ' ' HB3' ' A' ' 19' ' ' LEU . 14.2 mtp -38.2 -39.03 0.38 Allowed 'General case' 0 N--CA 1.501 2.096 1 N-CA-C 121.854 4.02 . . . . 0.0 121.854 -144.676 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . 0.425 ' O ' ' HB2' ' A' ' 35' ' ' LEU . 11.6 t-20 -47.15 -53.38 13.14 Favored 'General case' 0 CA--C 1.588 2.413 0 O-C-N 118.713 -2.492 . . . . 0.0 114.186 159.985 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . 0.4 ' HB3' ' H ' ' A' ' 29' ' ' SER 0.308 30.2 t -49.17 -61.43 2.08 Favored 'General case' 0 N--CA 1.501 2.076 0 N-CA-C 120.219 3.415 . . . . 0.0 120.219 148.41 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . 0.437 ' HB3' ' HB2' ' A' ' 23' ' ' ALA . 0.0 OUTLIER -84.14 -47.83 10.48 Favored 'General case' 0 N--CA 1.517 2.918 0 CA-C-N 124.0 3.091 . . . . 0.0 117.829 -174.036 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.728 HD22 HD13 ' A' ' 19' ' ' LEU 0.489 0.3 OUTLIER -50.12 -39.27 42.49 Favored 'General case' 0 CA--C 1.584 2.288 0 CA-C-O 113.744 -3.027 . . . . 0.0 106.326 163.0 . . . . . . . . 4 4 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.425 ' HB2' ' O ' ' A' ' 31' ' ' ASN . 13.8 mt -66.26 -57.15 8.16 Favored 'General case' 0 N--CA 1.499 2.014 1 CA-C-N 127.437 4.653 . . . . 0.0 115.014 169.272 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -56.36 -40.52 74.65 Favored 'General case' 0 CA--C 1.557 1.25 0 CA-C-O 115.54 -2.172 . . . . 0.0 113.719 -179.813 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -70.49 -31.04 45.2 Favored 'Isoleucine or valine' 0 C--O 1.201 -1.481 0 CA-C-N 123.156 2.707 . . . . 0.0 116.254 165.144 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.473 HG11 HD11 ' B' ' 19' ' ' LEU . 2.4 t -75.94 -49.83 24.78 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.136 0 CA-C-N 124.084 3.129 . . . . 0.0 112.077 177.076 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 27.1 mt-30 -46.25 -47.21 18.11 Favored 'General case' 0 N--CA 1.486 1.33 0 CA-C-O 116.662 -1.637 . . . . 0.0 113.214 154.09 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . 0.417 24.7 m-20 -47.33 -67.18 0.3 Allowed 'General case' 0 N--CA 1.491 1.593 0 CA-C-N 120.82 1.646 . . . . 0.0 110.509 158.307 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . . . . . . . . 0.348 . . . . . . . 0 CA--C 1.558 1.252 0 N-CA-C 116.975 2.213 . . . . 0.0 116.975 -152.693 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 7.7 Cg_exo . . . . . 0 CA--C 1.55 1.324 0 N-CA-C 114.75 1.019 . . . . 0.0 114.75 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' B' B ' 6' ' ' HIS . . . . . . . . . . . . . 74.2 m80 -79.44 126.74 31.23 Favored 'General case' 0 CA--C 1.565 1.522 0 CA-C-N 113.931 -1.486 . . . . 0.0 111.612 177.107 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 7' ' ' PHE . . . . . 0.52 ' CZ ' HD23 ' A' ' 34' ' ' LEU 0.255 2.3 p90 -131.8 153.44 50.13 Favored 'General case' 0 CA--C 1.561 1.372 0 O-C-N 120.239 -1.538 . . . . 0.0 110.419 146.81 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 8' ' ' ASN . . . . . . . . . . . . . 43.4 p-10 -70.48 77.12 0.57 Allowed 'General case' 0 CA--C 1.569 1.683 0 O-C-N 120.989 -1.069 . . . . 0.0 113.842 172.238 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 9' ' ' PHE . . . . . 0.474 ' HD2' HD11 ' B' ' 34' ' ' LEU . 12.2 t80 -73.52 145.7 45.4 Favored 'General case' 0 CA--C 1.558 1.268 0 CA-C-O 126.666 3.126 . . . . 0.0 110.207 168.262 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 10' ' ' ARG . . . . . . . . . . . . . 1.6 ttp180 -173.74 127.77 0.4 Allowed 'General case' 0 C--N 1.298 -1.652 0 CA-C-N 111.235 -2.711 . . . . 0.0 104.818 -135.847 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 11' ' ' MET . . . . . 0.428 ' HB3' ' HB ' ' B' ' 15' ' ' VAL . 1.3 mpt? -143.04 129.71 10.61 Favored Pre-proline 0 CA--C 1.559 1.307 0 CA-C-O 117.271 -1.347 . . . . 0.0 113.836 -159.896 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 12' ' ' PRO . . . . . . . . . . . . . 85.0 Cg_exo -43.06 146.27 0.98 Allowed 'Trans proline' 0 C--N 1.376 1.987 0 C-N-CA 123.201 2.601 . . . . 0.0 116.005 164.167 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 13' ' ' MET . . . . . . . . . . . . . 1.7 tpt -51.34 -36.41 42.83 Favored 'General case' 0 CA--C 1.57 1.749 0 N-CA-C 117.177 2.288 . . . . 0.0 117.177 -159.868 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 14' ' ' GLU . . . . . . . . . . . . 0.252 7.5 pt-20 -64.04 -51.02 66.13 Favored 'General case' 0 CA--C 1.572 1.799 0 N-CA-C 116.36 1.985 . . . . 0.0 116.36 170.407 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 15' ' ' VAL . . . . . 0.428 ' HB ' ' HB3' ' B' ' 11' ' ' MET . 0.0 OUTLIER -56.03 -49.9 72.87 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.393 0 CA-C-N 123.364 2.802 . . . . 0.0 111.972 171.797 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.4 -24.89 63.02 Favored 'General case' 0 N--CA 1.474 0.758 0 N-CA-C 117.304 2.335 . . . . 0.0 117.304 174.484 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 17' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -68.96 -40.41 78.9 Favored 'General case' 0 N--CA 1.492 1.655 0 CA-C-N 123.273 2.76 . . . . 0.0 113.986 154.632 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . 0.263 53.8 mtmt -71.85 -47.79 50.57 Favored 'General case' 0 CA--C 1.563 1.46 0 CA-C-N 121.534 1.97 . . . . 0.0 115.732 179.157 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 19' ' ' LEU . . . . . 0.547 ' HB3' ' CE ' ' B' ' 30' ' ' MET . 12.6 mt -56.02 -54.55 43.49 Favored 'General case' 0 CA--C 1.566 1.593 0 CA-C-N 120.225 1.375 . . . . 0.0 114.238 158.989 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 20' ' ' LYS . . . . . . . . . . . . . 15.1 ttpt -78.67 -20.84 49.31 Favored 'General case' 0 CA--C 1.572 1.809 0 O-C-N 119.453 -2.029 . . . . 0.0 114.371 -173.191 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 21' ' ' PHE . . . . . 0.465 ' O ' ' HB3' ' B' ' 25' ' ' ALA . 14.2 m-85 -68.62 -68.74 0.37 Allowed 'General case' 0 N--CA 1.489 1.516 0 CA-C-O 113.696 -3.05 . . . . 0.0 111.194 156.218 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . 0.276 13.5 tpp180 -22.97 -49.71 0.02 OUTLIER 'General case' 0 CA--C 1.599 2.86 1 CA-C-N 126.231 4.105 . . . . 0.0 115.554 162.7 . . . . . . . . 3 2 . 1 . 013 nuclear nobuild core ' B' B ' 23' ' ' ALA . . . . . 0.433 ' HB2' ' CB ' ' B' ' 33' ' ' GLU 0.265 . . -60.09 -76.08 0.05 Allowed 'General case' 0 CA--C 1.582 2.176 0 N-CA-C 116.815 2.154 . . . . 0.0 116.815 160.884 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 57.7 mm-40 -71.43 -35.03 70.82 Favored 'General case' 0 N--CA 1.5 2.057 0 N-CA-C 118.921 2.934 . . . . 0.0 118.921 -177.516 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 25' ' ' ALA . . . . . 0.465 ' HB3' ' O ' ' B' ' 21' ' ' PHE . . . -44.69 -50.27 10.02 Favored 'General case' 0 CA--C 1.585 2.32 0 N-CA-C 115.89 1.811 . . . . 0.0 115.89 155.705 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 26' ' ' ASN . . . . . 0.638 HD22 ' HE ' ' B' ' 28' ' ' ARG . 88.4 m-20 -82.74 -43.37 16.88 Favored 'General case' 0 N--CA 1.501 2.124 0 N-CA-C 116.823 2.157 . . . . 0.0 116.823 176.3 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 27' ' ' GLY . . . . . . . . . . . . . . . 106.51 30.29 4.42 Favored Glycine 0 CA--C 1.561 2.936 0 N-CA-C 118.001 1.96 . . . . 0.0 118.001 -152.875 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 28' ' ' ARG . . . . . 0.638 ' HE ' HD22 ' B' ' 26' ' ' ASN . 48.4 mtm180 -114.62 145.39 42.06 Favored 'General case' 0 CA--C 1.57 1.742 0 N-CA-C 104.179 -2.526 . . . . 0.0 104.179 171.852 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 29' ' ' SER . . . . . . . . . . . . . 81.0 p -113.05 115.15 27.91 Favored 'General case' 0 N--CA 1.507 2.419 0 O-C-N 117.964 -2.96 . . . . 0.0 105.896 -170.271 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 30' ' ' MET . . . . . 0.547 ' CE ' ' HB3' ' B' ' 19' ' ' LEU . 32.6 mtp -46.62 -42.18 15.8 Favored 'General case' 0 N--CA 1.498 1.943 0 N-CA-C 118.833 2.901 . . . . 0.0 118.833 -141.566 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 31' ' ' ASN . . . . . . . . . . . . . 6.0 t-20 -45.1 -45.52 11.2 Favored 'General case' 0 CA--C 1.594 2.652 0 CA-C-N 125.974 3.988 . . . . 0.0 115.835 163.225 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 32' ' ' SER . . . . . . . . . . . . 0.274 51.7 m -55.34 -62.73 1.48 Allowed 'General case' 0 N--CA 1.502 2.156 0 N-CA-C 120.47 3.507 . . . . 0.0 120.47 151.963 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 33' ' ' GLU . . . . . 0.433 ' CB ' ' HB2' ' B' ' 23' ' ' ALA . 6.2 tm-20 -58.54 -62.58 1.75 Allowed 'General case' 0 N--CA 1.507 2.42 0 CA-C-N 123.076 2.671 . . . . 0.0 115.675 175.343 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 34' ' ' LEU . . . . . 0.781 HD12 ' CZ ' ' A' ' 7' ' ' PHE . 0.0 OUTLIER -44.23 -52.07 7.74 Favored 'General case' 0 C--O 1.212 -0.894 0 CA-C-O 115.653 -2.118 . . . . 0.0 105.948 178.254 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 35' ' ' LEU . . . . . 0.41 ' HG ' ' CE1' ' A' ' 9' ' ' PHE . 8.3 mt -63.17 -56.12 19.39 Favored 'General case' 0 C--N 1.364 1.237 0 CA-C-N 123.319 2.782 . . . . 0.0 116.839 179.98 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 36' ' ' GLN . . . . . . . . . . . . 0.287 0.7 OUTLIER -59.11 -35.85 74.14 Favored 'General case' 0 CA--C 1.568 1.663 0 CA-C-O 117.599 -1.191 . . . . 0.0 113.875 176.122 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 37' ' ' ILE . . . . . 0.566 HD13 HH22 ' B' ' 28' ' ' ARG . 1.3 tp -73.54 -26.08 21.65 Favored 'Isoleucine or valine' 0 CA--C 1.568 1.672 0 N-CA-C 117.831 2.53 . . . . 0.0 117.831 164.015 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 38' ' ' VAL . . . . . 0.496 ' HA ' ' HB3' ' B' ' 41' ' ' ALA . 2.4 t -80.97 -46.26 20.82 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.091 0 C-N-CA 127.887 2.475 . . . . 0.0 112.285 179.807 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 33.5 mt-30 -46.26 -46.92 18.12 Favored 'General case' 0 CA--C 1.576 1.968 0 C-N-CA 124.094 0.958 . . . . 0.0 113.53 150.023 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 40' ' ' ASP . . . . . . . . . . . . 0.289 1.2 t70 -58.56 -32.36 68.84 Favored 'General case' 0 CA--C 1.575 1.918 0 N-CA-C 118.151 2.648 . . . . 0.0 118.151 159.534 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 41' ' ' ALA . . . . . 0.496 ' HB3' ' HA ' ' B' ' 38' ' ' VAL . . . -78.34 -50.92 10.9 Favored 'General case' 0 N--CA 1.48 1.072 0 N-CA-C 115.811 1.782 . . . . 0.0 115.811 -167.715 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 2.6 pp . . . . . 0 CA--C 1.566 1.564 0 N-CA-C 117.281 2.326 . . . . 0.0 117.281 164.812 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 8.8 p-10 . . . . . 0 CA--C 1.567 1.617 0 N-CA-C 112.049 0.388 . . . . 0.0 112.049 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 64.1 Cg_endo -64.37 148.39 90.86 Favored 'Trans proline' 0 CA--C 1.559 1.752 0 C-N-CA 123.698 2.932 . . . . 0.0 116.486 175.847 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 73.2 m80 -92.44 133.01 36.31 Favored 'General case' 0 CA--C 1.566 1.57 0 CA-C-N 113.301 -1.772 . . . . 0.0 110.956 178.977 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . 0.564 ' CZ ' HD23 ' B' ' 34' ' ' LEU . 2.8 p90 -125.82 151.23 47.07 Favored 'General case' 0 CA--C 1.563 1.479 0 O-C-N 120.423 -1.423 . . . . 0.0 110.28 154.285 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 14.3 m120 -69.25 90.67 0.5 Allowed 'General case' 0 N--CA 1.488 1.445 0 O-C-N 120.434 -1.416 . . . . 0.0 111.465 167.517 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . 0.53 ' HD2' HD11 ' A' ' 34' ' ' LEU . 4.5 t80 -72.57 159.7 33.48 Favored 'General case' 0 CA--C 1.565 1.54 0 CA-C-O 125.207 2.432 . . . . 0.0 109.824 153.723 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 3.1 tmm_? -176.5 114.93 0.11 Allowed 'General case' 0 C--N 1.308 -1.232 0 N-CA-C 104.499 -2.408 . . . . 0.0 104.499 -141.493 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' MET . . . . . 0.489 ' SD ' ' CD2' ' A' ' 9' ' ' PHE . 0.1 OUTLIER -127.18 116.28 21.74 Favored Pre-proline 0 CA--C 1.559 1.311 0 CA-C-O 116.957 -1.497 . . . . 0.0 110.934 -162.488 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 81.5 Cg_exo -40.04 138.13 1.18 Allowed 'Trans proline' 0 CA--C 1.562 1.914 0 CA-C-N 123.798 2.392 . . . . 0.0 116.074 160.488 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . 0.442 ' SD ' ' HG3' ' A' ' 17' ' ' GLU . 15.5 tpp -54.84 -25.83 31.18 Favored 'General case' 0 N--CA 1.496 1.836 0 N-CA-C 119.496 3.147 . . . . 0.0 119.496 -160.323 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -58.31 -57.55 12.41 Favored 'General case' 0 CA--C 1.568 1.655 0 N-CA-C 117.353 2.353 . . . . 0.0 117.353 156.976 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -55.42 -45.88 78.38 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.433 0 CA-C-N 121.887 2.13 . . . . 0.0 113.454 173.731 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -77.42 -27.89 52.42 Favored 'General case' 0 N--CA 1.474 0.75 0 CA-C-O 115.792 -2.052 . . . . 0.0 116.137 175.176 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 0.442 ' HG3' ' SD ' ' A' ' 13' ' ' MET . 38.4 mt-10 -65.0 -41.27 95.53 Favored 'General case' 0 N--CA 1.485 1.29 0 CA-C-N 124.252 3.205 . . . . 0.0 113.345 158.684 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . 0.542 32.5 pttt -77.44 -39.41 46.88 Favored 'General case' 0 CA--C 1.563 1.449 0 N-CA-C 116.989 2.218 . . . . 0.0 116.989 179.768 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.566 HD21 ' HG ' ' A' ' 34' ' ' LEU . 12.9 tp -66.27 -36.99 84.41 Favored 'General case' 0 CA--C 1.569 1.674 0 CA-C-N 120.595 1.543 . . . . 0.0 114.885 163.632 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.412 ' HA ' ' HB3' ' A' ' 23' ' ' ALA . 13.3 ttpt -90.26 -25.22 20.67 Favored 'General case' 0 CA--C 1.574 1.873 0 N-CA-C 114.821 1.415 . . . . 0.0 114.821 -179.825 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 24.1 m-85 -64.98 -69.58 0.28 Allowed 'General case' 0 N--CA 1.494 1.751 0 CA-C-O 113.581 -3.104 . . . . 0.0 110.501 155.974 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . 0.35 2.5 tmt_? -28.84 -44.0 0.03 OUTLIER 'General case' 0 CA--C 1.605 3.074 0 CA-C-N 125.747 3.885 . . . . 0.0 115.272 166.58 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.507 ' HB2' ' CB ' ' A' ' 33' ' ' GLU . . . -57.85 -76.28 0.04 OUTLIER 'General case' 0 CA--C 1.582 2.203 0 N-CA-C 117.445 2.387 . . . . 0.0 117.445 157.727 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 37.6 mt-10 . . . . . 0 N--CA 1.505 2.276 0 N-CA-C 118.092 2.627 . . . . 0.0 118.092 178.026 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 44.4 mtt85 . . . . . 0 CA--C 1.568 1.654 0 N-CA-C 106.762 -1.57 . . . . 0.0 106.762 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 39.2 t -114.14 118.96 35.5 Favored 'General case' 0 N--CA 1.5 2.064 0 N-CA-C 105.194 -2.15 . . . . 0.0 105.194 -178.893 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 15.1 mtp -47.61 -36.95 11.62 Favored 'General case' 0 N--CA 1.5 2.061 0 N-CA-C 119.25 3.056 . . . . 0.0 119.25 -146.599 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . 0.461 HD22 ' HD1' ' B' ' 9' ' ' PHE . 15.8 t-20 -45.53 -45.65 13.49 Favored 'General case' 0 CA--C 1.598 2.827 0 CA-C-N 125.622 3.828 . . . . 0.0 115.715 161.881 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . 0.35 12.8 t -49.12 -73.73 0.04 OUTLIER 'General case' 0 N--CA 1.499 1.982 0 N-CA-C 117.877 2.547 . . . . 0.0 117.877 145.574 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . 0.507 ' CB ' ' HB2' ' A' ' 23' ' ' ALA . 10.1 tp10 -57.92 -57.35 13.18 Favored 'General case' 0 N--CA 1.516 2.834 0 CA-C-N 124.017 3.099 . . . . 0.0 116.523 -174.656 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.834 HD12 ' CZ ' ' B' ' 7' ' ' PHE . 0.1 OUTLIER -42.56 -53.2 4.49 Favored 'General case' 0 CA--C 1.555 1.145 0 CA-C-O 115.476 -2.202 . . . . 0.0 107.183 171.164 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.414 ' HG ' ' CE1' ' B' ' 9' ' ' PHE . 16.0 mt -62.24 -43.85 97.9 Favored 'General case' 0 C--N 1.368 1.388 0 CA-C-N 124.077 3.126 . . . . 0.0 115.954 174.036 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.76 -44.23 93.95 Favored 'General case' 0 N--CA 1.49 1.553 0 N-CA-C 115.37 1.619 . . . . 0.0 115.37 175.106 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . 0.414 ' O ' ' HB2' ' A' ' 41' ' ' ALA . 3.4 tt -75.07 -20.79 16.46 Favored 'Isoleucine or valine' 0 CA--C 1.564 1.493 0 CA-C-O 114.667 -2.587 . . . . 0.0 116.056 165.537 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.518 HG21 HD22 ' A' ' 34' ' ' LEU . 4.1 t -89.91 -48.53 14.33 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.001 0 CA-C-N 123.222 2.737 . . . . 0.0 109.927 -174.915 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 26.6 mt-30 -55.32 -43.67 75.13 Favored 'General case' 0 CA--C 1.565 1.527 0 O-C-N 121.276 -0.89 . . . . 0.0 112.31 156.953 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . . . . . . . . 0.672 0.4 OUTLIER -61.02 -28.02 68.75 Favored 'General case' 0 CA--C 1.571 1.78 0 N-CA-C 118.531 2.789 . . . . 0.0 118.531 157.572 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . 0.417 ' HB3' ' HA ' ' A' ' 38' ' ' VAL . . . . . . . . 0 N--CA 1.494 1.728 0 O-C-N 119.431 -2.043 . . . . 0.0 114.238 -179.766 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 3.3 Cg_exo . . . . . 0 CA--C 1.552 1.408 0 CA-C-O 122.025 0.76 . . . . 0.0 113.683 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' B' B ' 6' ' ' HIS . . . . . . . . . . . . . 78.5 m80 -83.22 128.95 34.94 Favored 'General case' 0 CA--C 1.562 1.44 0 CA-C-N 114.155 -1.384 . . . . 0.0 111.974 -178.171 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 7' ' ' PHE . . . . . 0.834 ' CZ ' HD12 ' A' ' 34' ' ' LEU . 4.2 p90 -129.45 146.53 51.28 Favored 'General case' 0 CA--C 1.562 1.406 0 O-C-N 120.599 -1.313 . . . . 0.0 110.754 154.577 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 8' ' ' ASN . . . . . . . . . . . . . 12.6 m120 -70.26 86.42 0.58 Allowed 'General case' 0 N--CA 1.489 1.509 0 O-C-N 120.552 -1.343 . . . . 0.0 111.261 170.369 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 9' ' ' PHE . . . . . 0.678 ' CD2' HD13 ' A' ' 34' ' ' LEU . 5.9 t80 -70.48 153.12 43.27 Favored 'General case' 0 CA--C 1.551 1.006 0 CA-C-O 124.91 2.29 . . . . 0.0 110.745 161.907 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -162.65 126.15 2.93 Favored 'General case' 0 N--CA 1.481 1.114 0 CA-C-N 112.433 -2.167 . . . . 0.0 108.504 -160.752 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 11' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -127.02 115.44 21.96 Favored Pre-proline 0 CA--C 1.562 1.435 0 CA-C-O 117.253 -1.356 . . . . 0.0 110.605 -156.689 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 12' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_exo -41.96 142.99 1.31 Allowed 'Trans proline' 0 C--N 1.374 1.883 0 C-N-CA 122.99 2.46 . . . . 0.0 115.69 160.371 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 13' ' ' MET . . . . . . . . . . . . . 20.2 tpp -61.74 -35.56 78.46 Favored 'General case' 0 N--CA 1.493 1.69 0 N-CA-C 117.403 2.371 . . . . 0.0 117.403 -149.14 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 8.0 pt-20 -59.07 -41.44 88.0 Favored 'General case' 0 CA--C 1.568 1.645 0 N-CA-C 116.649 2.092 . . . . 0.0 116.649 163.564 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 15' ' ' VAL . . . . . 0.414 ' CG1' HG12 ' A' ' 38' ' ' VAL . 0.4 OUTLIER -59.65 -48.85 85.93 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.146 0 CA-C-N 122.885 2.584 . . . . 0.0 112.594 171.101 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 16' ' ' ARG . . . . . . . . . . . . 0.259 2.8 ttt180 -72.15 -41.23 67.33 Favored 'General case' 0 C--O 1.216 -0.704 0 CA-C-N 120.69 1.586 . . . . 0.0 114.855 176.986 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 17' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -61.52 -34.82 76.18 Favored 'General case' 0 CA--C 1.571 1.781 0 CA-C-N 122.779 2.536 . . . . 0.0 115.043 166.41 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 55.7 mtmt -66.55 -55.61 14.63 Favored 'General case' 0 CA--C 1.563 1.452 0 CA-C-N 121.34 1.882 . . . . 0.0 114.666 165.31 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 19' ' ' LEU . . . . . 0.599 HD21 HD22 ' B' ' 34' ' ' LEU . 11.3 tp -64.71 -37.06 86.31 Favored 'General case' 0 CA--C 1.566 1.572 0 N-CA-C 116.353 1.982 . . . . 0.0 116.353 176.965 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 20' ' ' LYS . . . . . . . . . . . . . 3.8 ttpt -87.22 -25.02 24.21 Favored 'General case' 0 CA--C 1.568 1.655 0 CA-C-O 116.917 -1.516 . . . . 0.0 113.598 176.331 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 13.6 m-30 -65.27 -71.06 0.2 Allowed 'General case' 0 N--CA 1.496 1.85 0 CA-C-O 113.551 -3.118 . . . . 0.0 110.667 158.218 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . 0.273 1.5 tpp180 -13.69 -56.68 0.0 OUTLIER 'General case' 0 CA--C 1.595 2.707 0 CA-C-N 125.263 3.665 . . . . 0.0 115.988 158.273 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 23' ' ' ALA . . . . . 0.551 ' HB2' ' HB3' ' B' ' 33' ' ' GLU 0.261 . . -57.91 -77.65 0.03 OUTLIER 'General case' 0 CA--C 1.589 2.47 0 N-CA-C 117.653 2.464 . . . . 0.0 117.653 160.664 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 54.5 mt-10 -61.13 -42.83 99.26 Favored 'General case' 0 N--CA 1.503 2.216 0 N-CA-C 118.874 2.916 . . . . 0.0 118.874 179.251 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 25' ' ' ALA . . . . . . . . . . . . . . . -39.63 -50.26 2.25 Favored 'General case' 0 CA--C 1.585 2.322 0 N-CA-C 115.882 1.808 . . . . 0.0 115.882 158.45 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 26' ' ' ASN . . . . . . . . . . . . . 71.2 m-20 -82.11 -49.15 10.5 Favored 'General case' 0 N--CA 1.498 1.952 0 N-CA-C 116.293 1.96 . . . . 0.0 116.293 174.79 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 27' ' ' GLY . . . . . . . . . . . . . . . 109.49 15.06 12.86 Favored Glycine 0 CA--C 1.561 2.964 0 N-CA-C 118.756 2.262 . . . . 0.0 118.756 -148.25 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 28' ' ' ARG . . . . . . . . . . . . . 1.7 mtt85 -98.66 156.04 17.02 Favored 'General case' 0 CA--C 1.573 1.829 0 CA-C-N 120.358 2.079 . . . . 0.0 105.59 162.737 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 29' ' ' SER . . . . . 0.536 ' H ' ' HB3' ' B' ' 32' ' ' SER . 38.9 t -122.14 112.22 17.94 Favored 'General case' 0 N--CA 1.503 2.21 0 O-C-N 117.928 -2.983 . . . . 0.0 105.774 -172.228 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 30' ' ' MET . . . . . . . . . . . . . 20.4 mtp -42.88 -32.12 0.58 Allowed 'General case' 0 N--CA 1.505 2.305 0 N-CA-C 121.46 3.874 . . . . 0.0 121.46 -146.133 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 31' ' ' ASN . . . . . . . . . . . . 0.269 12.5 t-20 -50.46 -52.12 40.86 Favored 'General case' 0 CA--C 1.594 2.659 0 O-C-N 118.34 -2.725 . . . . 0.0 114.414 159.002 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 32' ' ' SER . . . . . 0.536 ' HB3' ' H ' ' B' ' 29' ' ' SER 0.321 30.5 t -45.2 -77.54 0.02 OUTLIER 'General case' 0 N--CA 1.501 2.088 0 N-CA-C 116.793 2.145 . . . . 0.0 116.793 145.223 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 33' ' ' GLU . . . . . 0.551 ' HB3' ' HB2' ' B' ' 23' ' ' ALA . 3.3 tp10 -67.83 -52.52 35.91 Favored 'General case' 0 N--CA 1.505 2.282 0 CA-C-N 123.728 2.967 . . . . 0.0 116.198 -168.095 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 34' ' ' LEU . . . . . 0.599 HD22 HD21 ' B' ' 19' ' ' LEU 0.595 0.1 OUTLIER -49.56 -36.76 24.83 Favored 'General case' 0 CA--C 1.569 1.683 0 CA-C-O 114.061 -2.876 . . . . 0.0 107.882 170.833 . . . . . . . . 4 4 . 1 . 014 nuclear nobuild core ' B' B ' 35' ' ' LEU . . . . . 0.413 ' HG ' ' CE1' ' A' ' 9' ' ' PHE . 19.2 mt -65.56 -51.23 61.36 Favored 'General case' 0 N--CA 1.494 1.757 1 CA-C-N 126.493 4.224 . . . . 0.0 115.317 165.829 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 36' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -62.7 -39.12 93.0 Favored 'General case' 0 N--CA 1.477 0.905 0 CA-C-O 116.569 -1.682 . . . . 0.0 114.892 -177.325 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 37' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -69.36 -33.16 56.3 Favored 'Isoleucine or valine' 0 CA--C 1.572 1.802 0 CA-C-O 114.064 -2.874 . . . . 0.0 116.935 158.231 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 38' ' ' VAL . . . . . 0.407 ' CG1' HD22 ' A' ' 19' ' ' LEU . 2.2 t -77.24 -50.68 20.08 Favored 'Isoleucine or valine' 0 N--CA 1.513 2.706 0 CA-C-N 125.453 3.751 . . . . 0.0 112.259 -178.09 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 23.6 mt-30 -47.38 -44.76 24.53 Favored 'General case' 0 CA--C 1.557 1.226 0 CA-C-O 116.935 -1.507 . . . . 0.0 112.072 153.534 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 40' ' ' ASP . . . . . . . . . . . . 0.671 0.0 OUTLIER -48.0 -57.31 5.93 Favored 'General case' 0 N--CA 1.494 1.73 0 N-CA-C 117.051 2.241 . . . . 0.0 117.051 156.03 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -71.01 -44.64 65.48 Favored 'General case' 0 CA--C 1.543 0.684 0 N-CA-C 115.076 1.51 . . . . 0.0 115.076 -151.153 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . 0.312 0.7 OUTLIER . . . . . 0 N--CA 1.49 1.56 0 N-CA-C 118.394 2.738 . . . . 0.0 118.394 157.372 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 52.8 p-10 . . . . . 0 CA--C 1.57 1.714 0 CA-C-O 118.545 -0.74 . . . . 0.0 110.685 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 5.9 Cg_exo -101.12 144.98 0.29 Allowed 'Trans proline' 0 CA--C 1.559 1.733 0 CA-C-N 122.293 1.855 . . . . 0.0 114.619 -156.717 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 75.2 m80 -85.78 129.73 34.75 Favored 'General case' 0 CA--C 1.577 1.985 0 CA-C-N 115.011 -0.995 . . . . 0.0 112.144 179.754 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . 0.791 ' CZ ' HD12 ' B' ' 34' ' ' LEU . 8.3 p90 -129.42 152.95 48.41 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 119.329 -2.107 . . . . 0.0 111.115 147.871 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 14.2 m120 -71.17 87.05 0.78 Allowed 'General case' 0 N--CA 1.491 1.602 0 O-C-N 120.059 -1.651 . . . . 0.0 112.614 172.49 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' PHE . . . . . 0.625 ' CD2' HD13 ' B' ' 34' ' ' LEU . 2.8 t80 -74.19 138.0 43.48 Favored 'General case' 0 CA--C 1.556 1.18 0 CA-C-O 125.573 2.606 . . . . 0.0 110.271 163.075 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -163.29 120.37 1.85 Allowed 'General case' 0 N--CA 1.487 1.422 0 CA-C-N 112.003 -2.362 . . . . 0.0 107.955 -153.002 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 2.5 mpt? -131.27 119.32 17.57 Favored Pre-proline 0 N--CA 1.485 1.278 0 CA-C-O 116.845 -1.55 . . . . 0.0 113.199 -142.162 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 75.5 Cg_exo -42.73 142.78 1.91 Allowed 'Trans proline' 0 C--N 1.372 1.807 0 C-N-CA 123.082 2.521 . . . . 0.0 115.529 165.003 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -57.19 -36.41 70.78 Favored 'General case' 0 N--CA 1.493 1.691 0 N-CA-C 117.227 2.306 . . . . 0.0 117.227 -152.405 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -62.28 -43.58 98.5 Favored 'General case' 0 CA--C 1.565 1.521 0 N-CA-C 116.969 2.211 . . . . 0.0 116.969 165.03 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.407 ' CG1' HG12 ' B' ' 38' ' ' VAL . 0.4 OUTLIER -58.76 -50.64 78.58 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.355 0 CA-C-N 124.087 3.131 . . . . 0.0 113.158 174.584 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -67.37 -41.99 84.14 Favored 'General case' 0 C--O 1.214 -0.767 0 CA-C-O 116.041 -1.933 . . . . 0.0 115.789 171.284 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 51.0 mt-10 -59.04 -36.06 74.36 Favored 'General case' 0 CA--C 1.573 1.831 0 CA-C-N 123.935 3.061 . . . . 0.0 114.132 165.889 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . 0.276 42.3 mtmt -69.86 -54.71 12.25 Favored 'General case' 0 CA--C 1.564 1.492 0 CA-C-N 121.705 2.048 . . . . 0.0 115.138 171.909 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.636 HD13 HD22 ' A' ' 34' ' ' LEU . 10.8 mt -57.99 -45.63 86.51 Favored 'General case' 0 CA--C 1.57 1.723 0 N-CA-C 117.248 2.314 . . . . 0.0 117.248 167.565 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.43 ' HA ' ' HB3' ' A' ' 23' ' ' ALA . 17.1 ttpt -85.91 -24.46 26.61 Favored 'General case' 0 CA--C 1.569 1.681 0 C-N-CA 124.941 1.296 . . . . 0.0 113.486 -176.281 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 16.9 m-30 -67.44 -64.35 0.87 Allowed 'General case' 0 N--CA 1.492 1.662 0 CA-C-O 114.54 -2.647 . . . . 0.0 110.739 159.138 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' ARG . . . . . . . . . . . . 0.305 12.1 tpp180 -25.22 -45.41 0.02 OUTLIER 'General case' 0 CA--C 1.614 3.406 0 CA-C-N 125.294 3.679 . . . . 0.0 116.089 159.086 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.496 ' HB2' ' CB ' ' A' ' 33' ' ' GLU 0.281 . . -64.45 -69.03 0.31 Allowed 'General case' 0 CA--C 1.59 2.492 0 O-C-N 117.618 -3.177 . . . . 0.0 116.265 163.442 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 39.8 mt-10 . . . . . 0 N--CA 1.501 2.075 0 N-CA-C 118.458 2.762 . . . . 0.0 118.458 -179.427 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.573 1.837 0 CA-C-O 122.622 1.201 . . . . 0.0 108.608 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . 0.408 ' H ' ' HB3' ' A' ' 32' ' ' SER . 37.5 t -125.61 116.88 22.42 Favored 'General case' 0 N--CA 1.499 2.018 0 O-C-N 119.413 -2.054 . . . . 0.0 105.91 173.174 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' MET . . . . . 0.484 ' CE ' ' HB3' ' A' ' 19' ' ' LEU . 15.2 mtp -46.3 -30.7 2.16 Favored 'General case' 0 N--CA 1.501 2.109 0 N-CA-C 121.705 3.965 . . . . 0.0 121.705 -146.1 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' ASN . . . . . . . . . . . . 0.251 4.0 t-20 -51.3 -49.68 60.83 Favored 'General case' 0 CA--C 1.584 2.281 0 O-C-N 118.512 -2.618 . . . . 0.0 114.164 160.538 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . 0.408 ' HB3' ' H ' ' A' ' 29' ' ' SER 0.328 29.6 t -45.63 -71.42 0.08 Allowed 'General case' 0 N--CA 1.499 1.985 0 N-CA-C 117.335 2.346 . . . . 0.0 117.335 145.405 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . 0.496 ' CB ' ' HB2' ' A' ' 23' ' ' ALA . 0.0 OUTLIER -66.3 -60.24 2.96 Favored 'General case' 0 N--CA 1.503 2.217 0 CA-C-N 122.977 2.626 . . . . 0.0 114.547 -168.541 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.636 HD22 HD13 ' A' ' 19' ' ' LEU 0.573 0.1 OUTLIER -50.46 -34.25 24.17 Favored 'General case' 0 CA--C 1.575 1.907 0 CA-C-O 113.67 -3.062 . . . . 0.0 106.33 175.059 . . . . . . . . 4 4 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 17.7 mt -66.4 -49.93 65.16 Favored 'General case' 0 C--N 1.378 1.812 1 CA-C-N 127.288 4.585 . . . . 0.0 116.8 164.227 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -58.43 -41.36 84.85 Favored 'General case' 0 N--CA 1.492 1.627 0 N-CA-C 114.983 1.475 . . . . 0.0 114.983 178.393 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . 0.445 ' HA ' ' HB2' ' A' ' 40' ' ' ASP . 2.6 tt -71.8 -31.07 40.03 Favored 'Isoleucine or valine' 0 CA--C 1.567 1.622 0 CA-C-O 114.066 -2.873 . . . . 0.0 116.972 161.398 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.458 ' HA ' ' HB3' ' A' ' 41' ' ' ALA . 3.3 t -77.9 -45.72 27.48 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.291 0 CA-C-N 124.717 3.417 . . . . 0.0 112.156 -179.979 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 23.8 mt-30 -52.74 -43.25 65.6 Favored 'General case' 0 CA--C 1.565 1.54 0 C-N-CA 124.362 1.065 . . . . 0.0 113.14 155.272 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' ASP . . . . . 0.445 ' HB2' ' HA ' ' A' ' 37' ' ' ILE 0.494 2.8 m-20 -57.65 -32.65 67.5 Favored 'General case' 0 N--CA 1.5 2.055 0 N-CA-C 118.938 2.94 . . . . 0.0 118.938 155.089 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' ALA . . . . . 0.458 ' HB3' ' HA ' ' A' ' 38' ' ' VAL . . . . . . . . 0 CA--C 1.551 1.001 0 O-C-N 119.635 -1.916 . . . . 0.0 112.803 -167.372 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo . . . . . 0 CA--C 1.569 2.23 0 N-CA-C 117.207 1.964 . . . . 0.0 117.207 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' B' B ' 6' ' ' HIS . . . . . . . . . . . . . 70.5 m80 -106.6 143.52 34.59 Favored 'General case' 0 CA--C 1.56 1.341 0 CA-C-N 113.555 -1.657 . . . . 0.0 112.402 -167.004 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 7' ' ' PHE . . . . . 0.497 ' CZ ' HD23 ' A' ' 34' ' ' LEU . 8.9 p90 -140.63 155.71 46.46 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 120.411 -1.43 . . . . 0.0 111.1 149.166 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 8' ' ' ASN . . . . . . . . . . . . . 14.7 m120 -71.04 90.04 0.83 Allowed 'General case' 0 N--CA 1.489 1.494 0 O-C-N 120.218 -1.551 . . . . 0.0 111.659 168.537 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 9' ' ' PHE . . . . . . . . . . . . . 6.8 t80 -73.31 149.24 42.81 Favored 'General case' 0 CA--C 1.561 1.397 0 CA-C-O 125.121 2.391 . . . . 0.0 110.428 156.822 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 10' ' ' ARG . . . . . . . . . . . . . 34.0 tpt85 -179.78 93.3 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.651 0 O-C-N 119.718 -1.863 . . . . 0.0 107.869 -123.991 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 11' ' ' MET . . . . . 0.444 ' SD ' ' HG3' ' B' ' 16' ' ' ARG . 1.2 mpt? -130.09 129.88 23.01 Favored Pre-proline 0 CA--C 1.567 1.625 0 CA-C-O 117.302 -1.332 . . . . 0.0 112.805 -153.68 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 12' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_exo -44.89 146.14 2.57 Favored 'Trans proline' 0 CA--C 1.564 2.012 0 C-N-CA 123.082 2.521 . . . . 0.0 116.976 166.867 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 13' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -48.87 -37.53 19.87 Favored 'General case' 0 N--CA 1.496 1.827 0 N-CA-C 118.348 2.721 . . . . 0.0 118.348 -165.554 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 14' ' ' GLU . . . . . . . . . . . . 0.262 8.6 pt-20 -64.29 -48.08 77.05 Favored 'General case' 0 CA--C 1.566 1.572 0 N-CA-C 115.64 1.719 . . . . 0.0 115.64 170.028 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -59.6 -46.97 92.65 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.067 0 CA-C-N 123.408 2.822 . . . . 0.0 112.385 172.052 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 16' ' ' ARG . . . . . 0.444 ' HG3' ' SD ' ' B' ' 11' ' ' MET . 0.0 OUTLIER -74.25 -33.86 63.45 Favored 'General case' 0 N--CA 1.475 0.781 0 N-CA-C 116.455 2.02 . . . . 0.0 116.455 177.184 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 17' ' ' GLU . . . . . . . . . . . . . 74.5 mm-40 -65.32 -41.89 93.54 Favored 'General case' 0 N--CA 1.491 1.623 0 CA-C-N 123.611 2.914 . . . . 0.0 113.896 159.742 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . 0.289 50.9 mtmt -62.56 -45.79 91.3 Favored 'General case' 0 CA--C 1.566 1.561 0 CA-C-N 121.912 2.142 . . . . 0.0 115.361 172.241 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 19' ' ' LEU . . . . . 0.511 HD21 ' CD2' ' B' ' 34' ' ' LEU . 13.9 tp -72.65 -34.94 67.61 Favored 'General case' 0 CA--C 1.569 1.696 0 CA-C-N 120.739 1.608 . . . . 0.0 114.399 176.585 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 20' ' ' LYS . . . . . 0.447 ' HB2' ' SD ' ' B' ' 30' ' ' MET . 8.5 ttpt -88.21 -30.3 19.83 Favored 'General case' 0 CA--C 1.564 1.488 0 C-N-CA 125.635 1.574 . . . . 0.0 114.388 178.468 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 15.1 m-85 -56.82 -73.59 0.06 Allowed 'General case' 0 N--CA 1.491 1.599 0 CA-C-O 113.581 -3.104 . . . . 0.0 110.46 148.915 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 22' ' ' ARG . . . . . . . . . . . . 0.406 4.9 tmm_? -31.34 -41.68 0.04 OUTLIER 'General case' 0 CA--C 1.594 2.655 0 CA-C-N 125.829 3.922 . . . . 0.0 116.869 173.66 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -57.46 -74.48 0.06 Allowed 'General case' 0 CA--C 1.585 2.316 0 N-CA-C 118.856 2.91 . . . . 0.0 118.856 154.357 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -59.92 -45.82 91.37 Favored 'General case' 0 N--CA 1.504 2.274 0 N-CA-C 118.826 2.899 . . . . 0.0 118.826 175.363 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 25' ' ' ALA . . . . . . . . . . . . . . . -38.98 -51.92 1.79 Allowed 'General case' 0 CA--C 1.587 2.378 0 N-CA-C 116.824 2.157 . . . . 0.0 116.824 159.42 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 26' ' ' ASN . . . . . . . . . . . . . 34.8 m-20 -87.53 -51.75 5.74 Favored 'General case' 0 CA--C 1.575 1.936 0 N-CA-C 115.236 1.569 . . . . 0.0 115.236 179.67 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 27' ' ' GLY . . . . . . . . . . . . . . . 128.61 19.76 1.62 Allowed Glycine 0 CA--C 1.56 2.875 0 N-CA-C 119.275 2.47 . . . . 0.0 119.275 -161.054 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 28' ' ' ARG . . . . . . . . . . . . . 80.0 mtt-85 -116.22 166.49 11.97 Favored 'General case' 0 N--CA 1.495 1.778 0 CA-C-N 121.049 2.425 . . . . 0.0 106.957 167.535 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 29' ' ' SER . . . . . . . . . . . . . 91.1 p -121.14 112.55 18.82 Favored 'General case' 0 N--CA 1.5 2.049 0 O-C-N 118.742 -2.474 . . . . 0.0 105.491 -173.115 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 30' ' ' MET . . . . . 0.447 ' SD ' ' HB2' ' B' ' 20' ' ' LYS . 38.3 mtp -41.88 -46.14 3.91 Favored 'General case' 0 N--CA 1.499 2.002 0 N-CA-C 119.438 3.125 . . . . 0.0 119.438 -141.436 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 31' ' ' ASN . . . . . . . . . . . . . 25.2 t-20 -43.43 -44.52 5.83 Favored 'General case' 0 CA--C 1.598 2.796 0 CA-C-N 125.245 3.657 . . . . 0.0 115.712 164.179 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 32' ' ' SER . . . . . . . . . . . . 0.282 62.9 m -58.01 -58.23 9.33 Favored 'General case' 0 N--CA 1.498 1.96 0 N-CA-C 120.914 3.672 . . . . 0.0 120.914 149.688 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -64.9 -61.99 1.83 Allowed 'General case' 0 N--CA 1.515 2.795 0 CA-C-N 123.76 2.982 . . . . 0.0 114.835 177.637 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 34' ' ' LEU . . . . . 0.791 HD12 ' CZ ' ' A' ' 7' ' ' PHE . 0.0 OUTLIER -38.8 -53.96 1.64 Allowed 'General case' 0 CA--C 1.549 0.915 0 CA-C-O 115.004 -2.426 . . . . 0.0 107.934 170.726 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 35' ' ' LEU . . . . . 0.506 ' HG ' ' CE1' ' A' ' 9' ' ' PHE . 11.1 mt -65.09 -60.31 3.16 Favored 'General case' 0 N--CA 1.485 1.293 0 CA-C-N 124.448 3.295 . . . . 0.0 115.665 -178.156 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 36' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -53.0 -41.46 64.66 Favored 'General case' 0 CA--C 1.558 1.253 0 CA-C-O 117.213 -1.375 . . . . 0.0 113.932 175.073 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 37' ' ' ILE . . . . . 0.441 ' HA ' ' HB3' ' B' ' 40' ' ' ASP . 1.6 tp -75.08 -24.91 18.0 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.405 0 N-CA-C 116.37 1.989 . . . . 0.0 116.37 173.165 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 38' ' ' VAL . . . . . 0.521 HG11 HD11 ' A' ' 19' ' ' LEU . 2.2 t -81.15 -49.76 17.65 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.809 0 C-N-CA 127.487 2.315 . . . . 0.0 111.03 175.643 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 9.7 tt0 -44.27 -47.88 9.45 Favored 'General case' 0 CA--C 1.559 1.3 0 C-N-CA 124.771 1.229 . . . . 0.0 113.649 153.814 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 40' ' ' ASP . . . . . 0.441 ' HB3' ' HA ' ' B' ' 37' ' ' ILE 0.582 0.7 OUTLIER -53.09 -59.01 5.09 Favored 'General case' 0 CA--C 1.553 1.081 0 N-CA-C 116.092 1.886 . . . . 0.0 116.092 157.317 . . . . . . . . 4 4 . 1 . 015 nuclear nobuild core ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -67.4 -37.34 82.96 Favored 'General case' 0 CA--C 1.555 1.147 0 N-CA-C 116.591 2.071 . . . . 0.0 116.591 -159.465 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . 0.331 1.2 pp . . . . . 0 N--CA 1.49 1.553 0 N-CA-C 119.321 3.082 . . . . 0.0 119.321 157.418 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.559 1.314 0 N-CA-C 113.757 1.021 . . . . 0.0 113.757 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 22.3 mmt180 -84.6 77.98 9.93 Favored 'General case' 0 N--CA 1.491 1.591 0 N-CA-C 114.502 1.297 . . . . 0.0 114.502 -176.639 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -106.04 23.11 14.54 Favored 'General case' 0 CA--C 1.572 1.792 0 N-CA-C 114.321 1.23 . . . . 0.0 114.321 154.673 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 2.5 p30 -151.86 86.72 4.51 Favored Pre-proline 0 CA--C 1.567 1.606 0 O-C-N 120.367 -1.458 . . . . 0.0 112.074 155.507 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 5.7 Cg_exo -87.89 148.55 7.04 Favored 'Trans proline' 0 CA--C 1.549 1.247 0 C-N-CA 122.486 2.124 . . . . 0.0 114.676 -170.704 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 37.8 m80 -73.57 141.3 46.66 Favored 'General case' 0 CA--C 1.561 1.394 0 CA-C-N 113.384 -1.734 . . . . 0.0 113.355 173.555 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . 0.758 ' CZ ' HD12 ' B' ' 34' ' ' LEU . 24.3 p90 -125.93 163.81 22.15 Favored 'General case' 0 CA--C 1.559 1.317 0 O-C-N 120.035 -1.666 . . . . 0.0 111.2 115.807 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 1.1 p-10 -73.98 91.08 2.0 Favored 'General case' 0 CA--C 1.567 1.604 0 O-C-N 120.106 -1.621 . . . . 0.0 110.398 159.525 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . 0.631 ' CD2' HD13 ' B' ' 34' ' ' LEU . 4.1 t80 -66.99 168.07 10.62 Favored 'General case' 0 CA--C 1.559 1.325 0 CA-C-O 124.049 1.88 . . . . 0.0 110.489 154.274 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 9.6 tpt180 163.28 109.03 0.0 OUTLIER 'General case' 0 N--CA 1.488 1.443 0 O-C-N 119.724 -1.86 . . . . 0.0 106.211 -120.173 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . 0.641 ' SD ' HD23 ' A' ' 19' ' ' LEU . 13.6 mtm -144.73 123.21 6.75 Favored Pre-proline 0 CA--C 1.562 1.438 0 CA-C-N 114.08 -1.418 . . . . 0.0 108.881 -157.228 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_exo -43.66 147.92 0.99 Allowed 'Trans proline' 0 CA--C 1.562 1.9 0 C-N-CA 122.613 2.209 . . . . 0.0 115.952 159.657 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 1.3 tpt -48.99 -40.79 32.02 Favored 'General case' 0 N--CA 1.494 1.749 0 N-CA-C 117.195 2.294 . . . . 0.0 117.195 -166.942 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 1.1 pm0 -56.77 -49.42 75.34 Favored 'General case' 0 CA--C 1.562 1.406 0 N-CA-C 117.774 2.509 . . . . 0.0 117.774 167.092 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -62.33 -45.54 98.53 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.27 0 CA-C-N 122.721 2.51 . . . . 0.0 113.116 173.891 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -78.15 -23.91 47.55 Favored 'General case' 0 CA--C 1.552 1.055 0 N-CA-C 116.51 2.041 . . . . 0.0 116.51 176.532 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 51.0 mt-10 -68.67 -38.52 80.44 Favored 'General case' 0 CA--C 1.559 1.296 0 CA-C-N 121.579 1.99 . . . . 0.0 114.33 154.089 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . 0.608 11.5 pttt -81.39 -35.09 31.19 Favored 'General case' 0 N--CA 1.497 1.907 0 CA-C-N 124.487 3.312 . . . . 0.0 117.142 177.68 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.641 HD23 ' SD ' ' A' ' 11' ' ' MET 0.293 12.6 tp -63.92 -39.13 93.46 Favored 'General case' 0 CA--C 1.567 1.606 0 O-C-N 120.193 -1.567 . . . . 0.0 114.83 159.735 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.576 ' HB2' ' SD ' ' A' ' 30' ' ' MET . 20.0 ttpt -89.08 -20.78 23.91 Favored 'General case' 0 CA--C 1.568 1.656 0 CA-C-O 115.167 -2.349 . . . . 0.0 117.027 175.887 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . 0.96 ' HA ' ' HB2' ' A' ' 25' ' ' ALA . 0.1 OUTLIER -102.83 6.5 39.25 Favored 'General case' 0 N--CA 1.529 3.493 0 N-CA-C 119.987 3.329 . . . . 0.0 119.987 164.358 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.509 ' O ' ' N ' ' A' ' 24' ' ' GLU . 2.2 tpp180 -72.71 -140.46 0.01 OUTLIER 'General case' 0 C--N 1.308 -1.205 0 CA-C-O 115.218 -2.325 . . . . 0.0 111.798 106.984 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.759 ' HB1' ' ND2' ' A' ' 26' ' ' ASN 0.66 . . 39.12 -48.32 0.0 OUTLIER 'General case' 0 CA--C 1.593 2.605 1 CA-C-N 127.101 4.5 . . . . 0.0 120.085 -163.865 . . . . . . . . 4 3 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . 0.647 ' H ' ' HA ' ' A' ' 25' ' ' ALA . 2.5 tt0 -135.74 -64.11 0.64 Allowed 'General case' 0 N--CA 1.496 1.857 1 O-C-N 115.878 -4.264 . . . . 0.0 119.987 121.481 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.96 ' HB2' ' HA ' ' A' ' 21' ' ' PHE 0.613 . . -66.26 114.65 5.5 Favored 'General case' 0 N--CA 1.499 1.994 1 N-CA-C 134.186 8.587 . . . . 0.0 134.186 24.543 . . . . . . . . 4 3 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . 0.759 ' ND2' ' HB1' ' A' ' 23' ' ' ALA 1.171 0.7 OUTLIER 26.72 77.21 0.02 OUTLIER 'General case' 0 CA--C 1.577 2.002 2 N-CA-C 130.262 7.134 . . . . 0.0 130.262 -159.525 . . . . . . . . 5 4 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . 0.567 ' H ' ' HB2' ' A' ' 24' ' ' GLU . . . -108.69 -36.52 2.21 Favored Glycine 0 CA--C 1.558 2.744 0 N-CA-C 117.468 1.747 . . . . 0.0 117.468 148.908 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.424 ' O ' ' HB2' ' A' ' 33' ' ' GLU 0.398 0.0 OUTLIER -118.35 109.67 16.56 Favored 'General case' 0 N--CA 1.487 1.401 0 N-CA-C 105.864 -1.902 . . . . 0.0 105.864 -173.371 . . . . . . . . 4 4 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . 0.528 ' H ' ' HB3' ' A' ' 32' ' ' SER . 32.6 t -102.0 112.55 25.23 Favored 'General case' 0 N--CA 1.488 1.458 0 CA-C-O 115.107 -2.378 . . . . 0.0 106.307 -118.733 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' MET . . . . . 0.576 ' SD ' ' HB2' ' A' ' 20' ' ' LYS . 21.1 mtp -37.45 -41.2 0.42 Allowed 'General case' 0 N--CA 1.506 2.366 0 N-CA-C 120.165 3.394 . . . . 0.0 120.165 -145.811 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 14.5 t-20 -42.1 -51.75 4.49 Favored 'General case' 0 CA--C 1.597 2.771 0 O-C-N 116.867 -3.646 . . . . 0.0 116.142 159.224 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . 0.528 ' HB3' ' H ' ' A' ' 29' ' ' SER 0.37 24.4 t -46.12 -65.63 0.52 Allowed 'General case' 0 N--CA 1.5 2.042 0 N-CA-C 119.738 3.236 . . . . 0.0 119.738 144.598 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . 0.585 ' HB3' ' HB2' ' A' ' 23' ' ' ALA . 0.1 OUTLIER -71.14 -54.54 10.71 Favored 'General case' 0 N--CA 1.512 2.664 0 N-CA-C 119.269 3.063 . . . . 0.0 119.269 -176.789 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.762 HD12 ' CZ ' ' B' ' 7' ' ' PHE . 0.1 OUTLIER -37.46 -52.84 1.16 Allowed 'General case' 0 CA--C 1.55 0.96 0 CA-C-O 115.586 -2.149 . . . . 0.0 108.814 162.855 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.494 ' HG ' ' CE1' ' B' ' 9' ' ' PHE . 12.9 mt -61.96 -51.32 68.57 Favored 'General case' 0 C--N 1.369 1.444 0 CA-C-N 123.036 2.653 . . . . 0.0 115.098 177.091 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . 0.326 0.0 OUTLIER -67.04 -36.67 82.58 Favored 'General case' 0 CA--C 1.575 1.922 0 CA-C-O 116.081 -1.914 . . . . 0.0 115.022 -178.979 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 8.7 tt -61.97 -44.67 99.24 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.254 0 CA-C-N 124.133 3.151 . . . . 0.0 115.533 154.049 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.497 HG23 ' O ' ' A' ' 34' ' ' LEU . 2.7 t -65.25 -48.23 84.27 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.117 0 CA-C-N 123.351 2.796 . . . . 0.0 112.782 -172.66 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 30.4 mt-30 -48.71 -47.76 40.9 Favored 'General case' 0 CA--C 1.567 1.631 0 C-N-CA 125.571 1.549 . . . . 0.0 114.226 155.685 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . 0.458 2.1 m-20 -52.83 -34.96 56.46 Favored 'General case' 0 CA--C 1.578 2.035 0 N-CA-C 118.68 2.844 . . . . 0.0 118.68 157.475 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . 0.425 ' HB3' ' HA ' ' A' ' 38' ' ' VAL . . . -85.26 -57.37 3.11 Favored 'General case' 0 CA--C 1.55 0.965 0 N-CA-C 113.606 0.965 . . . . 0.0 113.606 -161.909 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 2.7 pp -85.23 -2.06 57.62 Favored 'General case' 0 CA--C 1.569 1.674 0 N-CA-C 117.812 2.523 . . . . 0.0 117.812 163.648 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 73.3 m -140.1 42.55 1.94 Allowed 'General case' 0 N--CA 1.496 1.83 0 CA-C-N 122.874 2.579 . . . . 0.0 116.637 173.182 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 8.1 mtpm? -115.28 150.92 45.25 Favored Pre-proline 0 N--CA 1.507 2.394 0 O-C-N 119.927 -1.733 . . . . 0.0 111.667 140.067 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_exo -93.77 165.44 2.21 Favored 'Trans proline' 0 N--CA 1.502 1.974 0 N-CA-C 120.965 3.409 . . . . 0.0 120.965 61.988 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 67.0 m -108.81 120.4 46.22 Favored Pre-proline 0 CA--C 1.576 1.945 0 CA-C-O 117.157 -1.402 . . . . 0.0 108.481 142.881 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 83.4 Cg_exo -50.57 101.86 0.05 OUTLIER 'Trans proline' 0 CA--C 1.575 2.542 0 CA-C-N 124.267 2.56 . . . . 0.0 118.412 179.786 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 4.6 t -25.93 116.5 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.518 2.936 0 N-CA-C 118.51 2.782 . . . . 0.0 118.51 -172.063 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . 0.542 0.5 OUTLIER 66.52 -152.52 0.22 Allowed 'General case' 0 N--CA 1.503 2.206 2 O-C-N 113.072 -6.018 . . . . 0.0 116.603 -12.951 . . . . . . . . 4 3 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -124.64 131.59 7.89 Favored Glycine 0 CA--C 1.563 3.05 0 O-C-N 120.557 -1.339 . . . . 0.0 113.507 135.504 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -154.42 172.9 16.99 Favored 'General case' 0 CA--C 1.587 2.381 2 O-C-N 113.969 -5.43 . . . . 0.0 112.36 -6.02 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 34.3 ttm-85 -94.84 -163.36 1.04 Allowed 'General case' 0 N--CA 1.508 2.472 0 O-C-N 120.104 -1.623 . . . . 0.0 112.818 163.07 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . 0.722 ' HA ' ' HB2' ' A' ' 55' ' ' ALA 0.415 4.7 m120 80.78 -137.34 0.01 OUTLIER 'General case' 0 N--CA 1.512 2.638 0 O-C-N 118.642 -2.536 . . . . 0.0 111.055 -177.554 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . 0.3 21.1 p30 12.44 68.01 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.87 0 N-CA-C 116.243 1.942 . . . . 0.0 116.243 -101.55 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . 0.722 ' HB2' ' HA ' ' A' ' 53' ' ' ASN . . . -84.39 -90.45 0.09 Allowed 'General case' 0 CA--C 1.545 0.77 0 N-CA-C 115.246 1.573 . . . . 0.0 115.246 -153.12 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.459 ' HB2' ' HB3' ' A' ' 55' ' ' ALA . 29.0 mt-10 31.84 -63.58 0.0 OUTLIER 'General case' 0 CA--C 1.563 1.462 1 N-CA-C 122.439 4.237 . . . . 0.0 122.439 82.146 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.577 ' H ' ' N ' ' A' ' 55' ' ' ALA 0.501 1.1 mpt_? -89.71 -44.53 9.95 Favored 'General case' 0 N--CA 1.479 1.016 0 O-C-N 120.153 -1.592 . . . . 0.0 115.057 -178.679 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.558 HD22 ' CD1' ' B' ' 37' ' ' ILE 0.604 33.0 mt -83.44 -1.37 53.38 Favored 'General case' 0 CA--C 1.606 3.111 0 O-C-N 118.567 -2.583 . . . . 0.0 114.063 160.963 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -65.07 -30.97 71.97 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 116.635 -3.791 . . . . 0.0 116.87 141.597 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.432 ' HA ' ' HB2' ' A' ' 63' ' ' SER . 0.5 OUTLIER -64.44 -19.28 65.44 Favored 'General case' 0 CA--C 1.571 1.787 0 N-CA-C 117.018 2.229 . . . . 0.0 117.018 154.897 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.413 ' H ' ' HA ' ' A' ' 58' ' ' LEU 0.406 0.1 OUTLIER -55.83 -51.18 68.41 Favored 'General case' 0 N--CA 1.491 1.587 0 CA-C-O 116.492 -1.718 . . . . 0.0 112.174 151.947 . . . . . . . . 4 4 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . 0.414 HE21 ' HA ' ' A' ' 62' ' ' GLN . 0.0 OUTLIER -52.46 -63.36 1.17 Allowed 'General case' 0 CA--C 1.56 1.341 0 CA-C-N 121.74 2.064 . . . . 0.0 112.537 170.674 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . 0.432 ' HB2' ' HA ' ' A' ' 60' ' ' ASP . 28.1 m -21.03 -54.81 0.02 OUTLIER 'General case' 0 N--CA 1.508 2.466 0 N-CA-C 121.634 3.938 . . . . 0.0 121.634 163.039 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . 0.365 51.1 mt-10 -81.26 -9.66 59.73 Favored 'General case' 0 CA--C 1.586 2.352 0 N-CA-C 113.846 1.054 . . . . 0.0 113.846 -179.769 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -103.56 25.19 10.0 Favored 'General case' 0 CA--C 1.607 3.151 0 C-N-CA 126.597 1.959 . . . . 0.0 114.261 151.7 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.416 ' CG1' ' HA ' ' A' ' 63' ' ' SER . 1.3 t . . . . . 0 N--CA 1.524 3.251 0 O-C-N 119.965 -1.709 . . . . 0.0 113.14 -166.309 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.566 1.562 0 N-CA-C 117.967 2.58 . . . . 0.0 117.967 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 2' ' ' ARG . . . . . . . . . . . . 0.286 3.5 mmp_? 63.46 37.87 10.32 Favored 'General case' 0 N--CA 1.506 2.334 0 N-CA-C 118.231 2.678 . . . . 0.0 118.231 173.156 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -160.02 -41.98 0.05 Allowed 'General case' 0 N--CA 1.491 1.609 0 C-N-CA 124.898 1.279 . . . . 0.0 112.046 164.47 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 4' ' ' ASP . . . . . . . . . . . . . 2.1 p30 -139.06 78.82 28.25 Favored Pre-proline 0 CA--C 1.569 1.695 0 O-C-N 120.859 -1.151 . . . . 0.0 111.209 156.01 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -69.75 136.73 33.77 Favored 'Trans proline' 0 CA--C 1.555 1.543 0 C-N-CA 123.478 2.785 . . . . 0.0 116.891 -179.974 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 6' ' ' HIS . . . . . . . . . . . . . 71.9 m80 -77.14 136.67 38.61 Favored 'General case' 0 CA--C 1.577 2.0 0 CA-C-N 113.615 -1.63 . . . . 0.0 111.859 164.222 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 7' ' ' PHE . . . . . 0.762 ' CZ ' HD12 ' A' ' 34' ' ' LEU . 1.2 p90 -136.28 158.1 45.22 Favored 'General case' 0 CA--C 1.57 1.746 0 O-C-N 119.869 -1.769 . . . . 0.0 111.87 150.036 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 8' ' ' ASN . . . . . . . . . . . . . 80.8 m-20 -69.35 103.87 2.11 Favored 'General case' 0 CA--C 1.571 1.773 0 O-C-N 120.374 -1.454 . . . . 0.0 113.033 174.622 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 9' ' ' PHE . . . . . 0.636 ' CG ' HD13 ' A' ' 34' ' ' LEU . 6.8 t80 -120.65 104.81 10.22 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 124.31 1.044 . . . . 0.0 108.318 160.334 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 10' ' ' ARG . . . . . . . . . . . . 0.438 0.1 OUTLIER 91.75 86.9 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.737 1 O-C-N 113.503 -5.748 . . . . 0.0 111.2 -9.779 . . . . . . . . 4 3 . 1 . 001 nuclear nobuild full ' B' B ' 11' ' ' MET . . . . . 0.461 ' HE2' ' CD2' ' B' ' 9' ' ' PHE . 16.4 mtm -155.93 126.7 3.5 Favored Pre-proline 0 CA--C 1.572 1.808 0 CA-C-O 116.894 -1.527 . . . . 0.0 110.241 -154.777 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 12' ' ' PRO . . . . . . . . . . . . . 87.0 Cg_exo -42.55 147.55 0.56 Allowed 'Trans proline' 0 C--N 1.373 1.828 0 C-N-CA 123.788 2.992 . . . . 0.0 117.751 168.941 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 13' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -44.33 -53.17 6.99 Favored 'General case' 0 N--CA 1.493 1.723 0 N-CA-C 118.105 2.632 . . . . 0.0 118.105 -162.851 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -62.1 -39.26 91.89 Favored 'General case' 0 CA--C 1.561 1.375 0 N-CA-C 116.793 2.145 . . . . 0.0 116.793 173.034 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -59.98 -52.25 63.34 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.181 0 CA-C-N 123.509 2.868 . . . . 0.0 111.604 170.423 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -72.14 -30.04 64.64 Favored 'General case' 0 CA--C 1.553 1.07 0 N-CA-C 116.364 1.987 . . . . 0.0 116.364 179.152 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 17' ' ' GLU . . . . . . . . . . . . . 38.3 mt-10 -61.54 -49.25 77.45 Favored 'General case' 0 N--CA 1.492 1.674 0 CA-C-N 122.4 2.364 . . . . 0.0 114.086 155.333 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . 0.255 51.0 mtmt -58.48 -49.54 76.98 Favored 'General case' 0 N--CA 1.489 1.492 0 CA-C-N 122.055 2.207 . . . . 0.0 115.748 174.026 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 19' ' ' LEU . . . . . 0.519 ' HB3' ' CE ' ' B' ' 30' ' ' MET 0.266 0.5 OUTLIER -66.21 -35.82 81.44 Favored 'General case' 0 CA--C 1.571 1.761 0 C-N-CA 125.574 1.55 . . . . 0.0 114.766 174.218 . . . . . . . . 4 4 . 1 . 001 nuclear nobuild full ' B' B ' 20' ' ' LYS . . . . . . . . . . . . . 15.9 ttpt -87.33 -31.2 20.3 Favored 'General case' 0 CA--C 1.564 1.492 0 N-CA-C 114.502 1.297 . . . . 0.0 114.502 178.201 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 13.8 m-85 -59.05 -72.29 0.1 Allowed 'General case' 0 N--CA 1.487 1.409 0 CA-C-O 114.855 -2.498 . . . . 0.0 110.956 155.014 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 22' ' ' ARG . . . . . 0.445 HH21 HD13 ' A' ' 58' ' ' LEU 0.299 13.2 ttt85 -23.83 -50.28 0.02 OUTLIER 'General case' 0 CA--C 1.59 2.496 0 CA-C-N 125.098 3.59 . . . . 0.0 117.043 166.514 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 23' ' ' ALA . . . . . 0.448 ' HB2' ' CB ' ' B' ' 33' ' ' GLU 0.272 . . -53.78 -76.23 0.03 OUTLIER 'General case' 0 CA--C 1.587 2.383 0 N-CA-C 119.332 3.086 . . . . 0.0 119.332 154.849 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 51.1 mm-40 -71.11 -39.29 72.16 Favored 'General case' 0 CA--C 1.578 2.027 0 N-CA-C 119.229 3.048 . . . . 0.0 119.229 -178.351 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 25' ' ' ALA . . . . . . . . . . . . . . . -40.72 -49.87 3.08 Favored 'General case' 0 CA--C 1.578 2.053 0 N-CA-C 117.304 2.335 . . . . 0.0 117.304 154.938 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 26' ' ' ASN . . . . . 0.411 ' HB3' ' O ' ' B' ' 22' ' ' ARG 0.303 0.0 OUTLIER -117.3 -36.71 3.68 Favored 'General case' 0 CA--C 1.578 2.028 0 N-CA-C 115.454 1.65 . . . . 0.0 115.454 -156.386 . . . . . . . . 4 4 . 1 . 001 nuclear nobuild full ' B' B ' 27' ' ' GLY . . . . . . . . . . . . . . . 131.64 31.75 0.5 Allowed Glycine 0 N--CA 1.496 2.674 0 N-CA-C 119.041 2.377 . . . . 0.0 119.041 172.825 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 28' ' ' ARG . . . . . 0.646 ' HE ' ' HB3' ' B' ' 36' ' ' GLN 0.343 3.2 mtm-85 -131.09 164.19 25.99 Favored 'General case' 0 CA--C 1.585 2.299 0 N-CA-C 103.647 -2.723 . . . . 0.0 103.647 168.177 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 29' ' ' SER . . . . . . . . . . . . . 89.9 p -127.41 107.59 10.09 Favored 'General case' 0 N--CA 1.511 2.623 1 O-C-N 116.064 -4.148 . . . . 0.0 108.2 -168.053 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 30' ' ' MET . . . . . 0.519 ' CE ' ' HB3' ' B' ' 19' ' ' LEU . 24.2 mtp -42.88 -42.81 3.81 Favored 'General case' 0 N--CA 1.498 1.972 0 N-CA-C 119.476 3.139 . . . . 0.0 119.476 -133.339 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 31' ' ' ASN . . . . . . . . . . . . 0.274 0.1 OUTLIER -49.28 -43.1 42.83 Favored 'General case' 0 CA--C 1.593 2.608 0 O-C-N 116.712 -3.742 . . . . 0.0 114.966 165.383 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 32' ' ' SER . . . . . . . . . . . . 0.29 27.2 t -50.47 -73.38 0.04 OUTLIER 'General case' 0 N--CA 1.501 2.124 0 N-CA-C 117.54 2.422 . . . . 0.0 117.54 141.927 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 33' ' ' GLU . . . . . 0.448 ' CB ' ' HB2' ' B' ' 23' ' ' ALA . 5.2 tm-20 -65.05 -49.0 71.8 Favored 'General case' 0 N--CA 1.506 2.346 0 N-CA-C 119.598 3.184 . . . . 0.0 119.598 -171.274 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 34' ' ' LEU . . . . . 0.758 HD12 ' CZ ' ' A' ' 7' ' ' PHE . 0.1 OUTLIER -41.51 -57.01 2.36 Favored 'General case' 0 CA--C 1.556 1.198 0 CA-C-O 115.495 -2.193 . . . . 0.0 108.628 158.926 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 35' ' ' LEU . . . . . . . . . . . . . 11.9 mt -60.93 -48.34 82.29 Favored 'General case' 0 N--CA 1.491 1.596 0 CA-C-N 124.44 3.291 . . . . 0.0 116.392 179.058 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 36' ' ' GLN . . . . . 0.646 ' HB3' ' HE ' ' B' ' 28' ' ' ARG . 0.0 OUTLIER -68.46 -34.56 76.16 Favored 'General case' 0 N--CA 1.478 0.964 0 CA-C-O 116.748 -1.596 . . . . 0.0 114.023 178.726 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 37' ' ' ILE . . . . . 0.558 ' CD1' HD22 ' A' ' 58' ' ' LEU . 2.0 tp -70.84 -27.94 32.12 Favored 'Isoleucine or valine' 0 CA--C 1.567 1.602 0 CA-C-O 115.836 -2.031 . . . . 0.0 115.363 163.191 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 38' ' ' VAL . . . . . 0.474 HG21 HD22 ' B' ' 34' ' ' LEU . 2.6 t -86.38 -52.96 11.26 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.194 0 C-N-CA 127.812 2.445 . . . . 0.0 110.917 -174.55 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 33.9 mt-30 -52.96 -37.67 61.36 Favored 'General case' 0 CA--C 1.562 1.427 0 CA-C-O 117.922 -1.037 . . . . 0.0 112.901 156.401 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 40' ' ' ASP . . . . . . . . . . . . 0.322 54.0 t0 -55.78 -54.63 42.13 Favored 'General case' 0 N--CA 1.49 1.548 0 N-CA-C 117.567 2.432 . . . . 0.0 117.567 154.516 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 41' ' ' ALA . . . . . . . . . . . . 0.315 . . -64.17 -40.43 96.11 Favored 'General case' 0 CA--C 1.558 1.253 0 N-CA-C 116.215 1.932 . . . . 0.0 116.215 -167.747 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 42' ' ' LEU . . . . . 0.495 ' HB3' HH21 ' A' ' 22' ' ' ARG . 2.6 pp -118.28 -1.99 11.22 Favored 'General case' 0 N--CA 1.49 1.549 0 N-CA-C 118.176 2.658 . . . . 0.0 118.176 171.65 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 43' ' ' SER . . . . . . . . . . . . . 64.1 p -123.78 6.38 8.76 Favored 'General case' 0 N--CA 1.496 1.865 0 N-CA-C 117.076 2.25 . . . . 0.0 117.076 163.421 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 44' ' ' LYS . . . . . . . . . . . . 0.51 96.4 mttt 71.23 -102.69 0.0 OUTLIER Pre-proline 0 CA--C 1.591 2.531 0 N-CA-C 117.412 2.375 . . . . 0.0 117.412 149.197 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 70.7 Cg_endo -79.81 116.14 3.43 Favored 'Trans proline' 0 CA--C 1.568 2.218 0 CA-C-N 126.948 3.517 . . . . 0.0 118.51 -163.694 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 46' ' ' SER . . . . . . . . . . . . . 36.5 m -74.54 125.95 89.2 Favored Pre-proline 0 CA--C 1.582 2.178 0 CA-C-O 117.874 -1.06 . . . . 0.0 110.141 135.438 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -74.47 95.64 0.95 Allowed 'Trans proline' 0 CA--C 1.569 2.254 0 CA-C-N 123.028 2.117 . . . . 0.0 116.98 -160.764 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 48' ' ' VAL . . . . . . . . . . . . 0.285 97.0 t -85.58 -59.47 2.75 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.098 0 N-CA-C 113.194 0.813 . . . . 0.0 113.194 170.821 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 49' ' ' THR . . . . . . . . . . . . . 11.5 m -131.93 85.43 2.25 Favored 'General case' 0 CA--C 1.572 1.807 2 O-C-N 112.199 -6.563 . . . . 0.0 110.057 -2.922 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 50' ' ' GLY . . . . . . . . . . . . . . . -94.87 61.97 1.61 Allowed Glycine 0 N--CA 1.503 3.116 0 O-C-N 120.15 -1.594 . . . . 0.0 113.858 159.067 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 51' ' ' TYR . . . . . . . . . . . . . 22.3 m-30 -135.34 85.86 2.2 Favored 'General case' 0 CA--C 1.569 1.71 0 CA-C-O 121.46 0.647 . . . . 0.0 109.676 -166.268 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 52' ' ' ARG . . . . . 0.554 ' HE ' ' H ' ' B' ' 53' ' ' ASN . 8.0 tpm_? -141.72 127.03 18.66 Favored 'General case' 0 N--CA 1.503 2.214 0 O-C-N 120.61 -1.306 . . . . 0.0 112.201 160.347 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 53' ' ' ASN . . . . . 0.554 ' H ' ' HE ' ' B' ' 52' ' ' ARG . 0.1 OUTLIER -178.09 176.21 1.16 Allowed 'General case' 0 N--CA 1.501 2.078 0 N-CA-C 118.034 2.605 . . . . 0.0 118.034 -147.227 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 54' ' ' ASP . . . . . 0.608 ' O ' ' HB3' ' B' ' 57' ' ' ARG 0.484 0.0 OUTLIER -89.81 42.7 1.11 Allowed 'General case' 0 CA--C 1.563 1.475 0 CA-C-O 127.799 3.666 . . . . 0.0 116.868 172.519 . . . . . . . . 4 4 . 1 . 001 nuclear nobuild full ' B' B ' 55' ' ' ALA . . . . . . . . . . . . 0.302 . . -67.32 -23.42 65.63 Favored 'General case' 0 CA--C 1.587 2.382 0 O-C-N 116.713 -3.742 . . . . 0.0 118.58 117.319 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 56' ' ' GLU . . . . . 0.442 ' C ' ' HB3' ' B' ' 59' ' ' ALA . 10.8 tp10 -50.22 5.93 0.0 OUTLIER 'General case' 0 CA--C 1.598 2.808 0 N-CA-C 120.371 3.471 . . . . 0.0 120.371 137.144 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 57' ' ' ARG . . . . . 0.608 ' HB3' ' O ' ' B' ' 54' ' ' ASP . 35.7 ttp180 -104.81 -49.79 3.43 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 119.311 -2.118 . . . . 0.0 114.433 163.894 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 58' ' ' LEU . . . . . . . . . . . . 0.558 0.0 OUTLIER -56.9 -26.18 58.6 Favored 'General case' 0 CA--C 1.586 2.339 0 CA-C-N 121.726 2.057 . . . . 0.0 114.043 169.577 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 59' ' ' ALA . . . . . 0.442 ' HB3' ' C ' ' B' ' 56' ' ' GLU . . . -36.51 -96.19 0.0 OUTLIER 'General case' 0 CA--C 1.569 1.707 0 N-CA-C 121.701 3.963 . . . . 0.0 121.701 131.304 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -77.8 -4.88 48.72 Favored 'General case' 0 N--CA 1.483 1.221 0 N-CA-C 117.189 2.292 . . . . 0.0 117.189 -163.008 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 61' ' ' GLU . . . . . . . . . . . . 0.322 0.6 OUTLIER -99.64 -15.98 18.38 Favored 'General case' 0 CA--C 1.557 1.232 0 CA-C-O 114.202 -2.808 . . . . 0.0 114.834 161.392 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 62' ' ' GLN . . . . . . . . . . . . 0.327 0.0 OUTLIER -80.61 -18.94 46.65 Favored 'General case' 0 CA--C 1.583 2.214 1 CA-C-N 127.502 4.683 . . . . 0.0 113.349 161.792 . . . . . . . . 4 3 . 1 . 001 nuclear nobuild full ' B' B ' 63' ' ' SER . . . . . 0.702 ' CA ' HG22 ' B' ' 66' ' ' VAL 1.287 7.9 t -139.87 -8.67 1.21 Allowed 'General case' 0 CA--C 1.58 2.122 0 C-N-CA 129.794 3.238 . . . . 0.0 117.77 -159.849 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 64' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -114.53 51.07 0.91 Allowed 'General case' 0 CA--C 1.576 1.951 0 O-C-N 119.408 -2.058 . . . . 0.0 112.127 119.953 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 65' ' ' LEU . . . . . . . . . . . . 0.352 20.4 mt -113.48 -60.63 1.86 Allowed 'General case' 0 N--CA 1.514 2.763 0 O-C-N 118.663 -2.523 . . . . 0.0 112.692 127.246 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 66' ' ' VAL . . . . . 0.702 HG22 ' CA ' ' B' ' 63' ' ' SER 0.379 0.1 OUTLIER . . . . . 0 N--CA 1.513 2.711 0 N-CA-C 121.459 3.874 . . . . 0.0 121.459 161.642 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.566 1.57 0 N-CA-C 117.64 2.459 . . . . 0.0 117.64 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . 0.275 15.2 mmp_? 57.69 44.31 20.8 Favored 'General case' 0 N--CA 1.504 2.244 0 N-CA-C 117.738 2.496 . . . . 0.0 117.738 170.406 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 6.8 p-10 -139.59 65.84 1.42 Allowed 'General case' 0 CA--C 1.564 1.501 0 N-CA-C 107.296 -1.372 . . . . 0.0 107.296 173.344 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 1.8 p30 -167.29 84.81 0.82 Allowed Pre-proline 0 CA--C 1.567 1.601 0 O-C-N 120.771 -1.205 . . . . 0.0 112.178 -161.092 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_exo -97.31 136.84 0.43 Allowed 'Trans proline' 0 CA--C 1.552 1.411 0 CA-C-N 122.296 1.856 . . . . 0.0 113.256 -161.995 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 75.2 m80 -81.1 122.01 26.81 Favored 'General case' 0 CA--C 1.573 1.841 0 CA-C-N 114.263 -1.335 . . . . 0.0 110.571 174.539 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . 0.781 ' CZ ' HD12 ' B' ' 34' ' ' LEU . 1.5 p90 -125.56 157.82 36.14 Favored 'General case' 0 CA--C 1.567 1.631 0 O-C-N 119.984 -1.698 . . . . 0.0 112.184 159.408 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 83.9 m-20 -68.96 103.45 1.83 Allowed 'General case' 0 CA--C 1.57 1.723 0 O-C-N 120.893 -1.129 . . . . 0.0 112.613 176.034 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . 0.622 ' CG ' HD13 ' B' ' 34' ' ' LEU . 5.6 t80 -124.47 104.95 9.03 Favored 'General case' 0 CA--C 1.537 0.48 0 N-CA-C 107.328 -1.36 . . . . 0.0 107.328 162.337 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . 0.478 0.1 OUTLIER 93.93 85.55 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.781 1 O-C-N 113.686 -5.634 . . . . 0.0 110.843 -12.54 . . . . . . . . 4 3 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . 0.482 ' HG2' HD21 ' B' ' 35' ' ' LEU . 15.7 mtt -157.14 134.33 6.74 Favored Pre-proline 0 CA--C 1.57 1.738 0 CA-C-O 117.777 -1.106 . . . . 0.0 111.813 -154.715 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 67.8 Cg_exo -49.4 156.35 2.76 Favored 'Trans proline' 0 CA--C 1.564 2.022 0 C-N-CA 123.106 2.537 . . . . 0.0 118.277 167.191 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 9.0 tpp -62.7 -41.65 99.24 Favored 'General case' 0 N--CA 1.488 1.443 0 N-CA-C 116.793 2.146 . . . . 0.0 116.793 -161.579 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 -61.23 -38.72 87.64 Favored 'General case' 0 CA--C 1.565 1.54 0 N-CA-C 115.991 1.848 . . . . 0.0 115.991 165.635 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.457 ' CG1' HG12 ' B' ' 38' ' ' VAL . 1.5 t -58.46 -43.85 87.64 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.077 0 CA-C-N 122.267 2.303 . . . . 0.0 114.983 175.943 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . 0.535 0.1 OUTLIER -117.73 22.25 12.44 Favored 'General case' 0 N--CA 1.483 1.205 0 N-CA-C 119.35 3.093 . . . . 0.0 119.35 171.922 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -66.75 -45.62 77.99 Favored 'General case' 0 CA--C 1.565 1.537 0 O-C-N 118.54 -2.6 . . . . 0.0 113.278 121.201 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . 0.256 46.2 mtmt -63.8 -52.6 59.54 Favored 'General case' 0 N--CA 1.489 1.494 0 CA-C-N 122.535 2.425 . . . . 0.0 116.079 177.454 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.538 HD21 ' CD2' ' A' ' 34' ' ' LEU . 11.7 tp -68.36 -35.55 77.9 Favored 'General case' 0 CA--C 1.564 1.494 0 C-N-CA 124.945 1.298 . . . . 0.0 113.556 173.078 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 2.3 ttpt -87.02 -24.02 24.79 Favored 'General case' 0 CA--C 1.572 1.813 0 CA-C-N 121.309 1.868 . . . . 0.0 114.31 178.667 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . 0.404 ' O ' ' HB3' ' A' ' 25' ' ' ALA . 13.9 m-85 -65.34 -68.87 0.33 Allowed 'General case' 0 N--CA 1.488 1.456 0 CA-C-O 114.365 -2.731 . . . . 0.0 111.15 154.887 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . 0.291 24.4 ttt180 -25.46 -48.53 0.02 OUTLIER 'General case' 0 CA--C 1.591 2.528 0 CA-C-N 125.363 3.71 . . . . 0.0 115.94 165.521 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -57.58 -76.56 0.04 OUTLIER 'General case' 0 CA--C 1.589 2.476 0 N-CA-C 117.523 2.416 . . . . 0.0 117.523 157.446 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 36.7 mt-10 -60.45 -49.48 77.38 Favored 'General case' 0 N--CA 1.507 2.378 0 N-CA-C 118.512 2.782 . . . . 0.0 118.512 178.201 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.404 ' HB3' ' O ' ' A' ' 21' ' ' PHE . . . -40.74 -51.14 3.11 Favored 'General case' 0 CA--C 1.588 2.439 0 N-CA-C 116.777 2.14 . . . . 0.0 116.777 162.103 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 86.1 m-20 -83.36 -46.69 12.28 Favored 'General case' 0 N--CA 1.501 2.087 0 N-CA-C 116.108 1.892 . . . . 0.0 116.108 177.201 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 116.61 31.03 1.88 Allowed Glycine 0 CA--C 1.561 2.957 0 N-CA-C 118.08 1.992 . . . . 0.0 118.08 -157.066 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 37.5 mtm-85 -120.13 162.77 18.76 Favored 'General case' 0 CA--C 1.572 1.797 0 N-CA-C 106.546 -1.649 . . . . 0.0 106.546 168.881 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . 0.434 ' H ' ' HB2' ' A' ' 32' ' ' SER . 33.5 m -122.77 113.34 19.05 Favored 'General case' 0 N--CA 1.503 2.206 0 O-C-N 118.457 -2.652 . . . . 0.0 104.835 -176.478 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' MET . . . . . 0.402 ' HE3' ' HB3' ' A' ' 19' ' ' LEU . 24.4 mtp -44.54 -41.27 6.31 Favored 'General case' 0 N--CA 1.501 2.105 0 N-CA-C 119.486 3.143 . . . . 0.0 119.486 -143.408 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -48.0 -41.53 25.63 Favored 'General case' 0 CA--C 1.595 2.682 0 CA-C-N 124.794 3.452 . . . . 0.0 115.071 165.226 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . 0.434 ' HB2' ' H ' ' A' ' 29' ' ' SER 0.291 67.3 m -55.31 -61.34 2.4 Favored 'General case' 0 N--CA 1.503 2.201 0 N-CA-C 120.686 3.587 . . . . 0.0 120.686 145.98 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 11.5 tp10 -62.78 -60.56 3.33 Favored 'General case' 0 N--CA 1.523 3.217 0 CA-C-N 125.096 3.589 . . . . 0.0 115.731 178.709 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.733 HD12 ' CZ ' ' B' ' 7' ' ' PHE . 0.1 OUTLIER -41.16 -55.29 2.68 Favored 'General case' 0 CA--C 1.546 0.816 0 CA-C-O 115.587 -2.149 . . . . 0.0 108.214 170.473 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 15.9 mt -61.66 -51.19 69.46 Favored 'General case' 0 C--N 1.37 1.489 0 CA-C-N 123.074 2.67 . . . . 0.0 114.412 176.528 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . 0.424 ' C ' HE21 ' A' ' 36' ' ' GLN . 0.0 OUTLIER -54.49 -42.28 70.56 Favored 'General case' 0 CA--C 1.567 1.632 0 N-CA-C 115.675 1.732 . . . . 0.0 115.675 175.68 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 5.3 tp -72.92 -29.16 28.46 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.958 0 CA-C-N 122.301 2.319 . . . . 0.0 116.636 166.484 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.495 ' HA ' ' HB3' ' A' ' 41' ' ' ALA . 8.1 t -80.01 -50.11 18.15 Favored 'Isoleucine or valine' 0 CA--C 1.58 2.118 0 C-N-CA 126.683 1.993 . . . . 0.0 110.042 -178.238 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 26.0 mt-30 -48.09 -40.96 24.96 Favored 'General case' 0 N--CA 1.488 1.429 0 N-CA-C 114.476 1.287 . . . . 0.0 114.476 153.836 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . 0.335 79.2 m-20 -50.5 -62.73 1.42 Allowed 'General case' 0 N--CA 1.491 1.595 0 CA-C-N 120.415 1.461 . . . . 0.0 114.142 154.029 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . 0.495 ' HB3' ' HA ' ' A' ' 38' ' ' VAL 0.285 . . -52.82 -33.03 47.3 Favored 'General case' 0 CA--C 1.562 1.409 0 N-CA-C 119.184 3.031 . . . . 0.0 119.184 -171.326 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.59 HD11 ' HB2' ' B' ' 19' ' ' LEU . 10.7 mt -95.71 -36.92 11.01 Favored 'General case' 0 CA--C 1.571 1.77 0 C-N-CA 125.887 1.675 . . . . 0.0 114.587 174.626 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 6.0 t -92.16 4.78 52.48 Favored 'General case' 0 N--CA 1.497 1.908 0 N-CA-C 119.233 3.049 . . . . 0.0 119.233 -177.306 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . 0.716 0.7 OUTLIER 80.22 -106.59 0.0 OUTLIER Pre-proline 0 CA--C 1.599 2.853 0 N-CA-C 120.548 3.536 . . . . 0.0 120.548 147.465 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 24.3 Cg_endo -70.54 136.16 30.29 Favored 'Trans proline' 0 C--N 1.375 1.957 0 CA-C-N 127.648 3.767 . . . . 0.0 118.654 -160.845 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 8.7 t -70.68 149.74 95.33 Favored Pre-proline 0 CA--C 1.575 1.924 0 CA-C-N 114.255 -1.339 . . . . 0.0 113.004 145.269 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 85.0 Cg_endo -75.09 81.78 2.16 Favored 'Trans proline' 0 CA--C 1.571 2.33 0 CA-C-N 123.732 2.369 . . . . 0.0 112.818 167.379 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . 0.57 ' H ' HG23 ' A' ' 49' ' ' THR 0.394 59.2 t -127.48 -96.5 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.506 2.326 0 CA-C-O 117.908 -1.044 . . . . 0.0 110.866 -176.56 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . 0.57 HG23 ' H ' ' A' ' 48' ' ' VAL . 1.4 p -142.07 86.15 1.96 Allowed 'General case' 0 N--CA 1.496 1.87 2 O-C-N 110.386 -7.696 . . . . 0.0 111.684 5.022 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -79.36 -23.32 63.22 Favored Glycine 0 N--CA 1.502 3.07 0 N-CA-C 117.724 1.85 . . . . 0.0 117.724 143.329 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 29.6 m-85 -58.61 116.99 4.05 Favored 'General case' 0 CA--C 1.582 2.202 0 CA-C-N 119.054 1.427 . . . . 0.0 111.586 148.48 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 76.6 mtp180 -132.43 94.78 3.49 Favored 'General case' 0 N--CA 1.509 2.486 0 CA-C-N 120.451 1.478 . . . . 0.0 113.385 170.258 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . 0.417 ' HB2' ' H ' ' A' ' 55' ' ' ALA 0.532 0.9 OUTLIER -47.77 119.46 2.82 Favored 'General case' 0 N--CA 1.494 1.751 0 N-CA-C 115.631 1.715 . . . . 0.0 115.631 -164.216 . . . . . . . . 4 4 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . 0.45 ' H ' ' HG2' ' A' ' 56' ' ' GLU 1.313 4.6 p30 68.59 3.49 3.87 Favored 'General case' 0 N--CA 1.495 1.815 2 N-CA-C 123.055 4.465 . . . . 0.0 123.055 12.766 . . . . . . . . 4 3 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . 0.594 ' HB1' ' HB2' ' A' ' 58' ' ' LEU 0.579 . . -116.16 12.19 15.43 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 117.367 -3.333 . . . . 0.0 119.982 124.347 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.45 ' HG2' ' H ' ' A' ' 54' ' ' ASP 0.297 9.2 tt0 -34.58 -13.12 0.0 OUTLIER 'General case' 0 CA--C 1.606 3.101 1 N-CA-C 124.01 4.819 . . . . 0.0 124.01 99.557 . . . . . . . . 4 3 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.569 ' H ' ' HA ' ' A' ' 55' ' ' ALA . 3.1 tmt_? -115.35 -35.95 4.47 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 118.616 -2.553 . . . . 0.0 113.777 170.148 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.594 ' HB2' ' HB1' ' A' ' 55' ' ' ALA . 0.8 OUTLIER -51.11 -35.09 33.58 Favored 'General case' 0 N--CA 1.514 2.758 0 CA-C-N 122.618 2.463 . . . . 0.0 115.131 148.363 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . 0.424 ' HB3' ' C ' ' A' ' 56' ' ' GLU . . . -46.01 -80.66 0.01 OUTLIER 'General case' 0 N--CA 1.481 1.12 0 CA-C-O 115.616 -2.135 . . . . 0.0 114.071 148.0 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -63.73 -11.71 28.59 Favored 'General case' 0 N--CA 1.493 1.719 0 CA-C-N 124.132 3.151 . . . . 0.0 117.752 -169.207 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . 0.298 23.8 tt0 -70.67 -55.04 9.62 Favored 'General case' 0 CA--C 1.553 1.095 0 CA-C-O 117.042 -1.456 . . . . 0.0 113.268 162.367 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . 0.682 ' O ' HG13 ' A' ' 66' ' ' VAL 0.378 2.4 mm-40 -82.44 -56.35 3.94 Favored 'General case' 0 N--CA 1.495 1.798 0 CA-C-N 123.011 2.641 . . . . 0.0 112.706 170.616 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . 0.457 0.3 OUTLIER -52.79 -10.32 0.16 Allowed 'General case' 0 CA--C 1.578 2.046 0 N-CA-C 121.613 3.931 . . . . 0.0 121.613 168.277 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 12.5 tt0 -95.49 -37.76 10.75 Favored 'General case' 0 N--CA 1.499 1.986 0 CA-C-N 124.145 3.157 . . . . 0.0 114.513 151.13 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 15.2 mt -90.84 12.97 17.69 Favored 'General case' 0 N--CA 1.504 2.246 0 CA-C-N 121.322 1.874 . . . . 0.0 115.923 -175.018 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.682 HG13 ' O ' ' A' ' 62' ' ' GLN . 6.8 m . . . . . 0 N--CA 1.503 2.186 0 C-N-CA 126.043 1.737 . . . . 0.0 111.941 177.602 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.564 1.517 0 N-CA-C 114.635 1.346 . . . . 0.0 114.635 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 2' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -97.83 66.38 1.9 Allowed 'General case' 0 N--CA 1.498 1.946 1 O-C-N 113.684 -5.635 . . . . 0.0 111.718 -9.404 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -126.8 79.56 1.88 Allowed 'General case' 0 N--CA 1.491 1.592 0 O-C-N 120.78 -1.2 . . . . 0.0 107.927 -179.732 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 4' ' ' ASP . . . . . . . . . . . . . 2.2 p30 -141.25 78.54 18.75 Favored Pre-proline 0 N--CA 1.487 1.422 0 O-C-N 121.223 -0.923 . . . . 0.0 112.169 171.294 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 4.8 Cg_exo -96.84 160.51 1.1 Allowed 'Trans proline' 0 CA--C 1.553 1.461 0 C-N-CA 121.955 1.77 . . . . 0.0 113.123 -160.01 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 6' ' ' HIS . . . . . . . . . . . . . 76.3 m80 -76.7 141.14 41.02 Favored 'General case' 0 CA--C 1.56 1.347 0 CA-C-N 113.517 -1.674 . . . . 0.0 113.184 -178.157 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 7' ' ' PHE . . . . . 0.733 ' CZ ' HD12 ' A' ' 34' ' ' LEU 0.266 27.7 p90 -121.29 167.54 12.62 Favored 'General case' 0 CA--C 1.564 1.497 0 O-C-N 119.838 -1.789 . . . . 0.0 110.285 116.972 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 8' ' ' ASN . . . . . . . . . . . . . 16.7 m120 -84.39 94.01 8.4 Favored 'General case' 0 N--CA 1.486 1.354 0 O-C-N 119.479 -2.013 . . . . 0.0 108.062 164.211 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 9' ' ' PHE . . . . . 0.642 ' CD2' HD13 ' A' ' 34' ' ' LEU . 5.7 t80 -68.41 162.73 24.79 Favored 'General case' 0 CA--C 1.557 1.229 0 CA-C-O 124.486 2.089 . . . . 0.0 110.824 158.957 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 10' ' ' ARG . . . . . . . . . . . . . 28.1 tpt85 177.08 97.93 0.01 OUTLIER 'General case' 0 N--CA 1.486 1.374 0 CA-C-N 113.385 -1.734 . . . . 0.0 106.713 -126.463 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 11' ' ' MET . . . . . 0.517 ' SD ' ' CD2' ' B' ' 9' ' ' PHE . 0.7 OUTLIER -122.64 120.51 27.81 Favored Pre-proline 0 CA--C 1.563 1.47 0 CA-C-O 117.049 -1.453 . . . . 0.0 110.864 -161.269 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 12' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_exo -44.91 149.78 1.08 Allowed 'Trans proline' 0 CA--C 1.566 2.123 0 CA-C-N 123.702 2.358 . . . . 0.0 116.051 159.942 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 13' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -54.14 -41.96 68.98 Favored 'General case' 0 N--CA 1.498 1.964 0 N-CA-C 117.374 2.361 . . . . 0.0 117.374 -157.501 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 9.1 pt-20 -63.46 -39.26 93.99 Favored 'General case' 0 CA--C 1.564 1.508 0 N-CA-C 116.54 2.052 . . . . 0.0 116.54 168.747 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 15' ' ' VAL . . . . . 0.437 ' CG1' HG12 ' A' ' 38' ' ' VAL . 0.8 OUTLIER -61.16 -46.38 96.75 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.091 0 CA-C-N 123.04 2.655 . . . . 0.0 113.421 172.259 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 2.1 ttt180 -74.7 -39.99 61.62 Favored 'General case' 0 C--O 1.218 -0.592 0 CA-C-O 116.353 -1.784 . . . . 0.0 115.027 174.419 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 17' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -58.91 -38.13 78.21 Favored 'General case' 0 CA--C 1.566 1.585 0 CA-C-N 123.386 2.812 . . . . 0.0 114.371 163.604 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 18' ' ' LYS . . . . . 0.433 ' HB2' HD13 ' A' ' 42' ' ' LEU 0.309 50.5 mtmt -67.93 -50.04 58.37 Favored 'General case' 0 CA--C 1.566 1.591 0 CA-C-N 121.6 2.0 . . . . 0.0 115.227 170.347 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 19' ' ' LEU . . . . . 0.639 ' HG ' ' SD ' ' B' ' 30' ' ' MET 0.322 13.3 tp -67.82 -37.77 82.39 Favored 'General case' 0 CA--C 1.574 1.872 0 CA-C-N 121.024 1.738 . . . . 0.0 114.336 174.458 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 20' ' ' LYS . . . . . . . . . . . . . 29.2 ttpt -88.5 -27.02 21.74 Favored 'General case' 0 CA--C 1.566 1.595 0 O-C-N 120.466 -1.396 . . . . 0.0 113.996 -179.988 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 19.9 m-30 -62.59 -70.5 0.2 Allowed 'General case' 0 N--CA 1.493 1.684 0 CA-C-O 113.607 -3.092 . . . . 0.0 110.27 155.326 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . 0.288 53.5 ttt180 -20.5 -53.07 0.01 OUTLIER 'General case' 0 CA--C 1.593 2.624 0 CA-C-N 125.751 3.887 . . . . 0.0 116.882 165.016 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 23' ' ' ALA . . . . . 0.491 ' HB2' ' CB ' ' B' ' 33' ' ' GLU . . . -54.22 -75.74 0.03 OUTLIER 'General case' 0 CA--C 1.589 2.475 0 N-CA-C 119.06 2.985 . . . . 0.0 119.06 157.091 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 -68.95 -39.13 79.69 Favored 'General case' 0 N--CA 1.502 2.137 0 N-CA-C 118.897 2.925 . . . . 0.0 118.897 -179.55 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 25' ' ' ALA . . . . . . . . . . . . . . . -38.97 -48.96 1.66 Allowed 'General case' 0 CA--C 1.581 2.137 0 N-CA-C 116.92 2.193 . . . . 0.0 116.92 156.08 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 26' ' ' ASN . . . . . . . . . . . . 0.299 0.0 OUTLIER -112.19 -47.8 3.08 Favored 'General case' 0 CA--C 1.578 2.047 0 N-CA-C 115.066 1.506 . . . . 0.0 115.066 -163.036 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 27' ' ' GLY . . . . . . . . . . . . . . . 148.66 44.65 0.03 OUTLIER Glycine 0 N--CA 1.5 2.926 0 N-CA-C 118.189 2.036 . . . . 0.0 118.189 176.472 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 28' ' ' ARG . . . . . 0.429 ' HE ' ' HG2' ' B' ' 33' ' ' GLU 0.334 1.1 ptt180 -156.92 153.44 28.12 Favored 'General case' 0 N--CA 1.495 1.797 0 N-CA-C 105.586 -2.005 . . . . 0.0 105.586 -173.115 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 29' ' ' SER . . . . . . . . . . . . . 75.1 p -119.77 110.5 16.86 Favored 'General case' 0 N--CA 1.502 2.126 0 O-C-N 118.312 -2.743 . . . . 0.0 105.638 -168.547 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 30' ' ' MET . . . . . 0.639 ' SD ' ' HG ' ' B' ' 19' ' ' LEU . 0.0 OUTLIER -39.85 -43.96 1.55 Allowed 'General case' 0 N--CA 1.493 1.703 0 N-CA-C 120.651 3.574 . . . . 0.0 120.651 -143.557 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 31' ' ' ASN . . . . . 0.405 ' O ' ' HB2' ' B' ' 35' ' ' LEU . 12.1 t-20 -44.4 -45.77 9.13 Favored 'General case' 0 CA--C 1.594 2.639 0 CA-C-N 124.029 3.104 . . . . 0.0 114.699 164.42 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 32' ' ' SER . . . . . . . . . . . . 0.326 30.9 t -50.61 -68.54 0.16 Allowed 'General case' 0 N--CA 1.5 2.044 0 N-CA-C 119.591 3.182 . . . . 0.0 119.591 144.561 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 33' ' ' GLU . . . . . 0.491 ' CB ' ' HB2' ' B' ' 23' ' ' ALA . 10.5 tm-20 -60.93 -58.44 8.41 Favored 'General case' 0 N--CA 1.515 2.793 0 N-CA-C 118.508 2.781 . . . . 0.0 118.508 -177.186 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 34' ' ' LEU . . . . . 0.781 HD12 ' CZ ' ' A' ' 7' ' ' PHE . 0.1 OUTLIER -39.91 -54.16 2.22 Favored 'General case' 0 CA--C 1.563 1.448 0 CA-C-O 116.46 -1.733 . . . . 0.0 107.305 166.2 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 35' ' ' LEU . . . . . 0.484 ' HG ' ' CE1' ' A' ' 9' ' ' PHE . 9.3 mt -63.26 -61.79 2.12 Favored 'General case' 0 C--N 1.371 1.53 0 CA-C-N 123.563 2.892 . . . . 0.0 115.977 -174.627 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 36' ' ' GLN . . . . . . . . . . . . 0.489 0.0 OUTLIER -60.76 -25.08 66.23 Favored 'General case' 0 CA--C 1.571 1.757 0 N-CA-C 115.352 1.612 . . . . 0.0 115.352 177.917 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 37' ' ' ILE . . . . . . . . . . . . . 1.9 tp -77.62 -32.57 18.34 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.788 0 CA-C-N 121.788 2.085 . . . . 0.0 116.24 163.833 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 38' ' ' VAL . . . . . 0.623 HG21 HD22 ' B' ' 34' ' ' LEU . 4.3 t -74.38 -50.38 27.45 Favored 'Isoleucine or valine' 0 CA--C 1.572 1.79 0 C-N-CA 127.942 2.497 . . . . 0.0 110.94 178.494 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 30.2 mt-30 -40.1 -49.23 2.57 Favored 'General case' 0 CA--C 1.567 1.601 0 N-CA-C 114.97 1.47 . . . . 0.0 114.97 149.798 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 40' ' ' ASP . . . . . . . . . . . . 0.339 1.5 t0 -57.45 -38.63 74.77 Favored 'General case' 0 CA--C 1.572 1.815 0 N-CA-C 118.241 2.682 . . . . 0.0 118.241 160.903 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 41' ' ' ALA . . . . . 0.555 ' HB3' ' HA ' ' B' ' 38' ' ' VAL . . . -72.99 -34.63 66.54 Favored 'General case' 0 CA--C 1.564 1.515 0 N-CA-C 116.914 2.19 . . . . 0.0 116.914 -176.83 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 42' ' ' LEU . . . . . 0.425 HD11 ' HB2' ' A' ' 19' ' ' LEU . 12.8 mt -89.94 -46.97 8.16 Favored 'General case' 0 CA--C 1.56 1.334 0 C-N-CA 126.086 1.754 . . . . 0.0 113.185 176.776 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 43' ' ' SER . . . . . . . . . . . . . 8.6 t -71.12 -35.85 71.91 Favored 'General case' 0 N--CA 1.494 1.733 0 N-CA-C 116.24 1.941 . . . . 0.0 116.24 175.151 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 44' ' ' LYS . . . . . . . . . . . . 0.504 37.8 mtmm 63.46 -128.72 0.0 OUTLIER Pre-proline 0 CA--C 1.594 2.643 0 CA-C-O 114.013 -2.898 . . . . 0.0 113.406 176.844 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 76.7 Cg_endo -86.31 111.59 1.06 Allowed 'Trans proline' 0 CA--C 1.568 2.221 1 CA-C-N 128.641 4.122 . . . . 0.0 118.405 -170.155 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 46' ' ' SER . . . . . . . . . . . . . 67.5 m -75.69 124.54 88.81 Favored Pre-proline 0 CA--C 1.584 2.265 0 CA-C-O 117.225 -1.369 . . . . 0.0 110.462 131.576 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 87.8 Cg_exo -55.07 95.4 0.05 OUTLIER 'Trans proline' 0 CA--C 1.573 2.448 0 N-CA-C 119.176 2.721 . . . . 0.0 119.176 -177.333 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 48' ' ' VAL . . . . . . . . . . . . . 4.3 p -107.01 -9.43 10.66 Favored 'Isoleucine or valine' 0 N--CA 1.518 2.946 0 N-CA-C 117.772 2.508 . . . . 0.0 117.772 -176.003 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 49' ' ' THR . . . . . . . . . . . . . 3.0 t -123.25 142.75 50.6 Favored 'General case' 0 N--CA 1.494 1.752 0 N-CA-C 116.55 2.055 . . . . 0.0 116.55 -113.055 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 50' ' ' GLY . . . . . . . . . . . . . . . -106.19 31.55 8.23 Favored Glycine 0 N--CA 1.501 3.028 0 N-CA-C 118.589 2.195 . . . . 0.0 118.589 159.503 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 51' ' ' TYR . . . . . . . . . . . . 0.379 0.0 OUTLIER -164.52 -34.09 0.03 OUTLIER 'General case' 0 N--CA 1.507 2.403 0 N-CA-C 116.496 2.035 . . . . 0.0 116.496 -172.858 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 52' ' ' ARG . . . . . . . . . . . . . 1.4 tmt_? 64.53 115.83 0.02 OUTLIER 'General case' 0 N--CA 1.507 2.376 0 C-N-CA 125.934 1.693 . . . . 0.0 114.659 177.419 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 53' ' ' ASN . . . . . 0.431 ' HA ' ' HA ' ' B' ' 54' ' ' ASP 0.391 0.1 OUTLIER -63.12 115.24 4.29 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 119.356 -2.09 . . . . 0.0 109.669 173.251 . . . . . . . . 4 4 . 1 . 002 nuclear nobuild full ' B' B ' 54' ' ' ASP . . . . . 0.491 ' C ' ' H ' ' B' ' 57' ' ' ARG 1.631 0.6 OUTLIER 47.95 13.52 0.04 OUTLIER 'General case' 0 CA--C 1.597 2.769 2 O-C-N 114.553 -5.092 . . . . 0.0 123.969 14.226 . . . . . . . . 5 4 . 1 . 002 nuclear nobuild full ' B' B ' 55' ' ' ALA . . . . . 0.463 ' CB ' ' HB2' ' A' ' 55' ' ' ALA 0.278 . . -126.06 -0.58 7.17 Favored 'General case' 0 CA--C 1.561 1.404 1 O-C-N 116.031 -4.168 . . . . 0.0 118.087 143.152 . . . . . . . . 4 3 . 1 . 002 nuclear nobuild full ' B' B ' 56' ' ' GLU . . . . . 0.483 ' HA ' ' HB3' ' B' ' 59' ' ' ALA 0.29 9.5 tp10 -16.66 -30.12 0.0 OUTLIER 'General case' 0 CA--C 1.614 3.404 1 N-CA-C 125.705 5.446 . . . . 0.0 125.705 89.444 . . . . . . . . 4 3 . 1 . 002 nuclear nobuild full ' B' B ' 57' ' ' ARG . . . . . 0.491 ' H ' ' C ' ' B' ' 54' ' ' ASP . 2.1 ttp180 -77.65 -57.87 3.58 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 118.255 -2.778 . . . . 0.0 112.81 158.241 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 58' ' ' LEU . . . . . 0.441 ' H ' HD13 ' B' ' 58' ' ' LEU 0.536 0.0 OUTLIER -63.37 -28.62 70.12 Favored 'General case' 0 N--CA 1.506 2.355 0 CA-C-N 121.372 1.896 . . . . 0.0 115.975 175.782 . . . . . . . . 4 4 . 1 . 002 nuclear nobuild full ' B' B ' 59' ' ' ALA . . . . . 0.483 ' HB3' ' HA ' ' B' ' 56' ' ' GLU . . . -37.57 -60.09 0.73 Allowed 'General case' 0 N--CA 1.49 1.556 0 N-CA-C 117.762 2.504 . . . . 0.0 117.762 144.286 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -78.99 3.88 15.93 Favored 'General case' 0 CA--C 1.555 1.172 0 N-CA-C 116.849 2.166 . . . . 0.0 116.849 172.119 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 38.4 tt0 -65.01 -75.99 0.08 Allowed 'General case' 0 N--CA 1.477 0.905 0 CA-C-O 116.216 -1.849 . . . . 0.0 109.009 153.143 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 62' ' ' GLN . . . . . 0.6 ' O ' HG13 ' B' ' 66' ' ' VAL 0.368 0.0 OUTLIER -69.08 -55.73 9.86 Favored 'General case' 0 N--CA 1.482 1.173 0 CA-C-N 122.6 2.455 . . . . 0.0 113.177 -176.848 . . . . . . . . 4 4 . 1 . 002 nuclear nobuild full ' B' B ' 63' ' ' SER . . . . . . . . . . . . 0.349 48.2 t -86.01 41.28 0.91 Allowed 'General case' 0 CA--C 1.571 1.754 0 N-CA-C 118.25 2.685 . . . . 0.0 118.25 171.474 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 64' ' ' GLU . . . . . . . . . . . . . 27.4 tt0 -97.44 -45.03 6.6 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 119.457 -2.027 . . . . 0.0 111.676 121.565 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 13.9 mt -64.05 -24.67 67.79 Favored 'General case' 0 CA--C 1.579 2.083 0 N-CA-C 117.008 2.225 . . . . 0.0 117.008 -178.498 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 66' ' ' VAL . . . . . 0.6 HG13 ' O ' ' B' ' 62' ' ' GLN . 1.5 m . . . . . 0 N--CA 1.505 2.317 0 N-CA-C 116.764 2.135 . . . . 0.0 116.764 174.766 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.566 1.564 0 N-CA-C 115.767 1.766 . . . . 0.0 115.767 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . 0.417 ' O ' ' SD ' ' B' ' 13' ' ' MET 0.352 55.4 ptt85 46.17 41.72 9.01 Favored 'General case' 0 N--CA 1.503 2.201 0 N-CA-C 120.324 3.453 . . . . 0.0 120.324 -177.897 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 3.8 p-10 -117.8 133.31 56.07 Favored 'General case' 0 CA--C 1.554 1.103 0 N-CA-C 104.622 -2.362 . . . . 0.0 104.622 169.371 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 21.7 p-10 -153.8 94.51 2.91 Favored Pre-proline 0 CA--C 1.572 1.823 1 O-C-N 113.459 -5.775 . . . . 0.0 111.241 39.967 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 23.6 Cg_exo -84.03 154.75 13.0 Favored 'Trans proline' 0 CA--C 1.557 1.633 0 CA-C-N 122.4 1.893 . . . . 0.0 116.374 -159.661 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 77.1 m80 -86.37 137.08 32.85 Favored 'General case' 0 CA--C 1.561 1.386 0 CA-C-N 114.04 -1.436 . . . . 0.0 113.568 -175.138 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . 0.711 ' CZ ' HD12 ' B' ' 34' ' ' LEU . 1.6 p90 -139.28 140.45 37.65 Favored 'General case' 0 N--CA 1.485 1.293 0 O-C-N 120.751 -1.218 . . . . 0.0 108.409 137.583 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 39.9 m-20 -73.92 100.86 3.63 Favored 'General case' 0 CA--C 1.563 1.458 0 O-C-N 120.434 -1.416 . . . . 0.0 111.469 -178.424 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . 0.69 ' HD2' HD11 ' A' ' 34' ' ' LEU . 5.3 t80 -79.65 77.0 6.28 Favored 'General case' 0 CA--C 1.576 1.953 0 CA-C-O 127.683 3.611 . . . . 0.0 111.216 169.593 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . 0.283 28.8 ptt180 -47.04 138.65 6.43 Favored 'General case' 0 N--CA 1.478 0.936 0 CA-C-N 109.577 -3.465 . . . . 0.0 118.011 130.238 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . 0.439 ' HB2' ' HB2' ' A' ' 16' ' ' ARG . 9.1 mtt -147.75 138.07 12.7 Favored Pre-proline 0 CA--C 1.572 1.791 0 CA-C-N 112.928 -1.942 . . . . 0.0 110.204 -176.326 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 87.1 Cg_exo -41.46 142.61 1.08 Allowed 'Trans proline' 0 C--N 1.375 1.944 0 C-N-CA 123.627 2.885 . . . . 0.0 116.497 167.588 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 1.7 tpt -44.3 -38.03 3.64 Favored 'General case' 0 CA--C 1.569 1.711 0 N-CA-C 119.675 3.213 . . . . 0.0 119.675 -167.001 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -61.96 -47.13 86.25 Favored 'General case' 0 N--CA 1.486 1.342 0 N-CA-C 117.548 2.425 . . . . 0.0 117.548 167.734 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.459 HG21 HD22 ' B' ' 35' ' ' LEU . 0.1 OUTLIER -67.37 -42.44 87.43 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.911 0 CA-C-N 122.949 2.613 . . . . 0.0 112.509 173.262 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . 0.439 ' HB2' ' HB2' ' A' ' 11' ' ' MET 0.318 0.0 OUTLIER -79.15 -29.24 42.95 Favored 'General case' 0 N--CA 1.486 1.329 0 CA-C-N 123.078 2.672 . . . . 0.0 116.313 176.083 . . . . . . . . 4 4 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -67.42 -44.76 77.98 Favored 'General case' 0 N--CA 1.49 1.533 0 CA-C-N 123.38 2.809 . . . . 0.0 113.254 156.926 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . 0.552 8.8 pttt -74.02 -31.73 63.05 Favored 'General case' 0 N--CA 1.484 1.25 0 N-CA-C 116.643 2.09 . . . . 0.0 116.643 179.366 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.507 ' HB3' ' CE ' ' A' ' 30' ' ' MET 0.294 0.9 OUTLIER -69.07 -43.79 73.87 Favored 'General case' 0 N--CA 1.492 1.634 0 CA-C-N 122.764 2.529 . . . . 0.0 113.624 162.004 . . . . . . . . 4 4 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 1.5 ttpt -77.38 -38.92 49.01 Favored 'General case' 0 CA--C 1.562 1.428 0 N-CA-C 115.158 1.54 . . . . 0.0 115.158 -177.919 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 29.4 m-85 -55.86 -77.71 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.573 0 CA-C-O 113.408 -3.187 . . . . 0.0 110.832 154.557 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.441 HH21 HD13 ' B' ' 58' ' ' LEU 0.331 0.0 OUTLIER -28.72 -48.73 0.06 Allowed 'General case' 0 CA--C 1.589 2.463 1 CA-C-N 126.117 4.053 . . . . 0.0 117.113 176.053 . . . . . . . . 5 4 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.48 ' HB2' ' HB3' ' A' ' 33' ' ' GLU . . . -47.54 -77.65 0.02 OUTLIER 'General case' 0 CA--C 1.586 2.334 0 N-CA-C 120.54 3.533 . . . . 0.0 120.54 152.254 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 54.2 mm-40 -64.58 -40.26 95.23 Favored 'General case' 0 N--CA 1.499 2.005 0 N-CA-C 118.603 2.816 . . . . 0.0 118.603 179.188 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -38.22 -48.35 1.27 Allowed 'General case' 0 CA--C 1.575 1.942 0 N-CA-C 117.961 2.578 . . . . 0.0 117.961 154.628 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . 0.259 0.0 OUTLIER -105.6 -42.86 5.08 Favored 'General case' 0 CA--C 1.575 1.92 0 N-CA-C 116.38 1.993 . . . . 0.0 116.38 -167.177 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 130.95 16.56 1.58 Allowed Glycine 0 N--CA 1.497 2.705 0 N-CA-C 119.649 2.62 . . . . 0.0 119.649 -172.559 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.566 ' HE ' ' HB3' ' A' ' 36' ' ' GLN 0.288 18.3 mtm-85 -121.4 143.07 49.42 Favored 'General case' 0 N--CA 1.5 2.034 0 N-CA-C 102.688 -3.079 . . . . 0.0 102.688 166.526 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 23.2 t -115.92 112.71 22.27 Favored 'General case' 0 N--CA 1.509 2.492 0 O-C-N 116.617 -3.802 . . . . 0.0 108.818 -164.8 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' MET . . . . . 0.507 ' CE ' ' HB3' ' A' ' 19' ' ' LEU . 25.6 mtp -42.62 -45.29 4.56 Favored 'General case' 0 N--CA 1.501 2.077 0 N-CA-C 119.474 3.139 . . . . 0.0 119.474 -134.707 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 18.7 t-20 -47.15 -43.56 21.08 Favored 'General case' 0 CA--C 1.6 2.888 1 O-C-N 115.928 -4.233 . . . . 0.0 114.816 165.088 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . 0.291 13.6 t -53.18 -72.24 0.06 Allowed 'General case' 0 N--CA 1.502 2.161 0 N-CA-C 117.306 2.336 . . . . 0.0 117.306 143.384 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . 0.48 ' HB3' ' HB2' ' A' ' 23' ' ' ALA . 4.5 tm-20 -68.41 -45.62 72.13 Favored 'General case' 0 N--CA 1.504 2.256 0 CA-C-N 124.471 3.305 . . . . 0.0 119.338 -171.994 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.846 HD12 ' CZ ' ' B' ' 7' ' ' PHE . 0.1 OUTLIER -41.43 -55.99 2.64 Favored 'General case' 0 CA--C 1.557 1.245 0 CA-C-O 114.866 -2.492 . . . . 0.0 108.39 156.762 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 11.8 mt -62.21 -45.94 91.11 Favored 'General case' 0 N--CA 1.493 1.706 0 CA-C-N 125.7 3.864 . . . . 0.0 116.762 177.493 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . 0.566 ' HB3' ' HE ' ' A' ' 28' ' ' ARG . 0.1 OUTLIER -70.97 -40.88 71.69 Favored 'General case' 0 N--CA 1.483 1.184 0 CA-C-O 116.705 -1.617 . . . . 0.0 113.48 178.955 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . 0.458 ' O ' ' HB2' ' A' ' 41' ' ' ALA . 1.3 tt -61.67 -31.7 51.58 Favored 'Isoleucine or valine' 0 C--O 1.199 -1.593 0 CA-C-O 114.329 -2.748 . . . . 0.0 115.178 160.474 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.457 HG21 HD22 ' A' ' 34' ' ' LEU . 2.6 t -84.38 -51.84 13.4 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.096 0 CA-C-N 123.698 2.954 . . . . 0.0 110.884 -173.57 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 33.9 mt-30 -48.76 -41.57 32.76 Favored 'General case' 0 CA--C 1.568 1.643 0 C-N-CA 124.208 1.003 . . . . 0.0 113.656 155.014 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . 0.352 17.4 t0 -50.31 -57.91 6.83 Favored 'General case' 0 N--CA 1.49 1.526 0 N-CA-C 116.916 2.191 . . . . 0.0 116.916 153.981 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . 0.458 ' HB2' ' O ' ' A' ' 37' ' ' ILE . . . -74.96 -33.16 61.87 Favored 'General case' 0 CA--C 1.551 0.995 0 N-CA-C 116.733 2.124 . . . . 0.0 116.733 -157.496 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 2.3 pp -96.74 -19.31 19.04 Favored 'General case' 0 CA--C 1.562 1.436 0 N-CA-C 118.5 2.778 . . . . 0.0 118.5 159.245 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 94.8 p -138.26 38.91 2.29 Favored 'General case' 0 N--CA 1.493 1.706 0 CA-C-N 122.268 2.304 . . . . 0.0 116.576 -173.842 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 69.2 mmtt -120.42 129.04 25.52 Favored Pre-proline 0 N--CA 1.502 2.158 0 CA-C-N 120.249 1.386 . . . . 0.0 112.584 159.456 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 67.3 Cg_endo -96.96 173.79 0.73 Allowed 'Trans proline' 0 CA--C 1.564 2.014 0 N-CA-C 117.482 2.07 . . . . 0.0 117.482 47.987 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . 0.292 66.1 m -112.99 -124.92 0.0 OUTLIER Pre-proline 0 CA--C 1.583 2.235 0 CA-C-O 115.941 -1.98 . . . . 0.0 107.603 154.439 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 78.0 Cg_exo -67.69 67.72 0.81 Allowed 'Trans proline' 0 CA--C 1.573 2.437 0 CA-C-N 126.502 3.358 . . . . 0.0 118.111 164.441 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 14.9 p -153.37 106.95 0.23 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.889 0 C-N-CA 123.902 0.881 . . . . 0.0 110.314 172.17 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 73.1 p -123.01 53.26 1.3 Allowed 'General case' 0 N--CA 1.507 2.387 0 CA-C-O 122.807 1.289 . . . . 0.0 113.918 173.763 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -168.93 73.81 0.13 Allowed Glycine 0 CA--C 1.555 2.545 0 CA-C-N 114.748 -1.114 . . . . 0.0 112.101 158.355 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . 0.413 0.3 OUTLIER 61.85 -162.68 0.27 Allowed 'General case' 0 CA--C 1.584 2.269 2 O-C-N 114.96 -4.847 . . . . 0.0 115.052 3.209 . . . . . . . . 4 3 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . 0.633 ' HE ' ' H ' ' A' ' 53' ' ' ASN 0.317 6.7 tpm_? 75.66 136.51 0.06 Allowed 'General case' 0 N--CA 1.506 2.332 0 N-CA-C 115.113 1.523 . . . . 0.0 115.113 -172.755 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . 0.633 ' H ' ' HE ' ' A' ' 52' ' ' ARG . 0.6 OUTLIER 121.36 141.62 0.0 OUTLIER 'General case' 0 N--CA 1.505 2.312 0 CA-C-O 125.03 2.347 . . . . 0.0 106.423 -148.137 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . 0.472 ' CB ' ' HD2' ' A' ' 57' ' ' ARG 1.351 0.0 OUTLIER 57.17 19.3 4.74 Favored 'General case' 0 N--CA 1.483 1.183 1 N-CA-C 123.018 4.451 . . . . 0.0 123.018 98.336 . . . . . . . . 5 4 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . 1.291 . . -90.73 19.24 5.61 Favored 'General case' 0 CA--C 1.577 1.986 1 O-C-N 115.663 -4.398 . . . . 0.0 121.784 111.451 . . . . . . . . 3 2 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.844 ' O ' ' HB3' ' A' ' 59' ' ' ALA . 34.7 mt-10 -47.88 -19.48 0.24 Allowed 'General case' 0 CA--C 1.602 2.945 0 N-CA-C 121.118 3.747 . . . . 0.0 121.118 112.076 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.472 ' HD2' ' CB ' ' A' ' 54' ' ' ASP . 0.0 OUTLIER -98.8 -23.14 15.51 Favored 'General case' 0 N--CA 1.49 1.529 1 O-C-N 115.728 -4.358 . . . . 0.0 114.428 169.657 . . . . . . . . 4 4 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.539 ' HA ' ' H ' ' A' ' 61' ' ' GLU 0.815 0.4 OUTLIER -73.57 -0.93 16.71 Favored 'General case' 0 CA--C 1.626 3.883 0 O-C-N 118.694 -2.504 . . . . 0.0 114.75 143.791 . . . . . . . . 4 4 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . 0.844 ' HB3' ' O ' ' A' ' 56' ' ' GLU 0.284 . . -55.39 -36.16 66.09 Favored 'General case' 0 N--CA 1.517 2.878 1 O-C-N 114.656 -5.028 . . . . 0.0 117.229 136.054 . . . . . . . . 4 3 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -66.14 -14.57 62.04 Favored 'General case' 0 CA--C 1.58 2.099 0 N-CA-C 118.164 2.653 . . . . 0.0 118.164 159.276 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.539 ' H ' ' HA ' ' A' ' 58' ' ' LEU 0.436 0.0 OUTLIER -52.6 -52.26 56.12 Favored 'General case' 0 N--CA 1.513 2.693 0 O-C-N 119.296 -2.127 . . . . 0.0 112.457 145.586 . . . . . . . . 4 4 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . 0.581 ' O ' HG13 ' A' ' 66' ' ' VAL 0.373 3.0 tp60 -55.19 -37.97 67.76 Favored 'General case' 0 CA--C 1.586 2.353 0 CA-C-O 114.586 -2.626 . . . . 0.0 116.968 162.925 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 26.3 m -36.56 -50.51 0.8 Allowed 'General case' 0 N--CA 1.53 3.535 1 CA-C-N 126.117 4.053 . . . . 0.0 115.91 159.278 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . 0.45 1.0 OUTLIER -91.86 12.64 20.87 Favored 'General case' 0 CA--C 1.573 1.841 0 N-CA-C 115.769 1.766 . . . . 0.0 115.769 179.94 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.432 HD13 ' O ' ' A' ' 61' ' ' GLU . 5.0 mp -91.98 -52.06 4.9 Favored 'General case' 0 CA--C 1.588 2.41 0 C-N-CA 126.285 1.834 . . . . 0.0 114.278 141.118 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.581 HG13 ' O ' ' A' ' 62' ' ' GLN 0.338 34.4 m . . . . . 0 N--CA 1.517 2.878 0 N-CA-C 120.615 3.561 . . . . 0.0 120.615 -149.412 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.559 1.307 0 CA-C-O 121.96 0.885 . . . . 0.0 113.301 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 2' ' ' ARG . . . . . . . . . . . . . 8.6 ptm180 -87.22 91.7 8.81 Favored 'General case' 0 CA--C 1.564 1.496 0 CA-C-O 121.745 0.783 . . . . 0.0 112.737 174.114 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 28.0 m-20 -131.18 -0.69 4.08 Favored 'General case' 0 CA--C 1.57 1.734 0 N-CA-C 115.523 1.675 . . . . 0.0 115.523 164.754 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 4' ' ' ASP . . . . . . . . . . . . 0.251 8.3 p-10 -136.73 71.21 57.98 Favored Pre-proline 0 CA--C 1.573 1.85 0 O-C-N 119.871 -1.768 . . . . 0.0 111.903 139.484 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 90.0 Cg_endo -66.54 152.51 80.62 Favored 'Trans proline' 0 CA--C 1.557 1.636 0 C-N-CA 123.424 2.749 . . . . 0.0 115.945 174.38 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 6' ' ' HIS . . . . . . . . . . . . . 54.9 m80 -75.19 154.21 37.75 Favored 'General case' 0 CA--C 1.557 1.231 0 CA-C-N 113.8 -1.546 . . . . 0.0 114.597 174.656 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 7' ' ' PHE . . . . . 0.846 ' CZ ' HD12 ' A' ' 34' ' ' LEU . 17.8 p90 -131.19 162.66 29.45 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 120.197 -1.564 . . . . 0.0 112.395 120.026 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 8' ' ' ASN . . . . . . . . . . . . . 6.1 p-10 -61.73 92.47 0.04 OUTLIER 'General case' 0 CA--C 1.567 1.628 0 N-CA-C 114.422 1.267 . . . . 0.0 114.422 165.403 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 9' ' ' PHE . . . . . 0.65 ' CD2' HD13 ' A' ' 34' ' ' LEU 0.263 0.8 OUTLIER -79.53 164.77 23.62 Favored 'General case' 0 CA--C 1.563 1.476 0 CA-C-O 125.543 2.592 . . . . 0.0 109.511 153.905 . . . . . . . . 4 4 . 1 . 003 nuclear nobuild full ' B' B ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 162.63 103.33 0.0 OUTLIER 'General case' 0 C--N 1.308 -1.231 0 CA-C-N 111.819 -2.446 . . . . 0.0 104.658 -123.846 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 11' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -139.96 128.75 13.37 Favored Pre-proline 0 CA--C 1.567 1.631 0 CA-C-O 117.669 -1.158 . . . . 0.0 110.88 -158.883 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 12' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -59.46 153.42 54.52 Favored 'Trans proline' 0 CA--C 1.562 1.905 0 CA-C-N 123.779 2.385 . . . . 0.0 114.116 169.445 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 13' ' ' MET . . . . . 0.417 ' SD ' ' O ' ' A' ' 2' ' ' ARG . 0.0 OUTLIER -57.84 -36.55 72.44 Favored 'General case' 0 N--CA 1.495 1.821 0 N-CA-C 117.026 2.232 . . . . 0.0 117.026 -155.03 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -60.13 -44.23 95.07 Favored 'General case' 0 CA--C 1.563 1.458 0 N-CA-C 117.146 2.276 . . . . 0.0 117.146 165.705 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 15' ' ' VAL . . . . . 0.406 ' CG1' HG12 ' A' ' 38' ' ' VAL . 0.3 OUTLIER -63.06 -46.33 96.46 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.131 0 CA-C-N 123.57 2.896 . . . . 0.0 112.612 172.921 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 16' ' ' ARG . . . . . . . . . . . . 0.255 0.0 OUTLIER -76.63 -27.87 55.87 Favored 'General case' 0 N--CA 1.479 1.009 0 N-CA-C 116.261 1.949 . . . . 0.0 116.261 177.297 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 17' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -67.44 -44.46 78.65 Favored 'General case' 0 N--CA 1.49 1.573 0 CA-C-N 122.833 2.56 . . . . 0.0 113.699 156.925 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 55.4 mtmt -58.5 -54.89 41.9 Favored 'General case' 0 N--CA 1.49 1.561 0 CA-C-N 122.378 2.354 . . . . 0.0 114.93 171.316 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 19' ' ' LEU . . . . . 0.496 HD21 ' HG ' ' B' ' 34' ' ' LEU . 12.9 tp -63.57 -35.63 81.13 Favored 'General case' 0 CA--C 1.562 1.44 0 N-CA-C 115.124 1.527 . . . . 0.0 115.124 176.453 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 20' ' ' LYS . . . . . 0.444 ' HA ' ' HB3' ' B' ' 23' ' ' ALA . 11.8 ttpt -87.82 -23.0 24.17 Favored 'General case' 0 CA--C 1.572 1.803 0 N-CA-C 114.314 1.228 . . . . 0.0 114.314 176.185 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 21' ' ' PHE . . . . . 0.41 ' O ' ' HB3' ' B' ' 25' ' ' ALA . 11.2 m-85 -64.53 -71.71 0.17 Allowed 'General case' 0 N--CA 1.491 1.62 0 CA-C-O 115.167 -2.349 . . . . 0.0 110.635 154.678 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . 0.369 0.0 OUTLIER -18.58 -52.28 0.01 OUTLIER 'General case' 0 CA--C 1.597 2.754 0 CA-C-N 124.616 3.371 . . . . 0.0 115.106 159.794 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 23' ' ' ALA . . . . . 0.444 ' HB3' ' HA ' ' B' ' 20' ' ' LYS 0.331 . . -55.67 -77.96 0.02 OUTLIER 'General case' 0 CA--C 1.586 2.338 0 N-CA-C 120.202 3.408 . . . . 0.0 120.202 154.182 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 12.6 mm-40 -68.93 -36.59 78.16 Favored 'General case' 0 N--CA 1.502 2.16 0 N-CA-C 119.323 3.083 . . . . 0.0 119.323 -178.719 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 25' ' ' ALA . . . . . 0.41 ' HB3' ' O ' ' B' ' 21' ' ' PHE . . . -42.79 -49.82 5.69 Favored 'General case' 0 CA--C 1.58 2.127 0 N-CA-C 116.496 2.036 . . . . 0.0 116.496 154.413 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 26' ' ' ASN . . . . . . . . . . . . . 6.8 m-20 -82.23 -54.61 5.11 Favored 'General case' 0 CA--C 1.572 1.789 0 N-CA-C 114.275 1.213 . . . . 0.0 114.275 179.131 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 27' ' ' GLY . . . . . . . . . . . . . . . 116.67 23.94 3.86 Favored Glycine 0 N--CA 1.498 2.793 0 N-CA-C 117.835 1.894 . . . . 0.0 117.835 -152.661 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 28' ' ' ARG . . . . . . . . . . . . 0.291 81.7 mtm180 -119.09 155.61 31.22 Favored 'General case' 0 CA--C 1.58 2.106 0 N-CA-C 103.738 -2.69 . . . . 0.0 103.738 170.927 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 29' ' ' SER . . . . . . . . . . . . . 87.5 p -122.98 108.13 12.59 Favored 'General case' 0 N--CA 1.507 2.387 0 O-C-N 116.852 -3.655 . . . . 0.0 107.576 -166.47 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 30' ' ' MET . . . . . . . . . . . . . 23.4 mtp -40.6 -45.93 2.43 Favored 'General case' 0 N--CA 1.5 2.033 0 N-CA-C 119.15 3.019 . . . . 0.0 119.15 -137.592 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 31' ' ' ASN . . . . . . . . . . . . 0.286 0.1 OUTLIER -48.56 -43.65 35.85 Favored 'General case' 0 CA--C 1.601 2.926 0 CA-C-N 125.178 3.626 . . . . 0.0 114.707 167.08 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 32' ' ' SER . . . . . . . . . . . . 0.296 70.0 m -53.04 -63.19 1.23 Allowed 'General case' 0 N--CA 1.508 2.473 0 N-CA-C 119.902 3.297 . . . . 0.0 119.902 145.527 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 33' ' ' GLU . . . . . 0.441 ' HB3' ' HB2' ' B' ' 23' ' ' ALA . 8.5 tm-20 -70.28 -54.76 11.31 Favored 'General case' 0 N--CA 1.504 2.234 0 CA-C-N 123.668 2.94 . . . . 0.0 118.901 -178.707 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 34' ' ' LEU . . . . . 0.711 HD12 ' CZ ' ' A' ' 7' ' ' PHE . 0.1 OUTLIER -36.39 -52.23 0.83 Allowed 'General case' 0 CA--C 1.554 1.111 0 CA-C-O 115.829 -2.034 . . . . 0.0 108.74 161.119 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 35' ' ' LEU . . . . . 0.459 HD22 HG21 ' A' ' 15' ' ' VAL . 19.7 mt -62.67 -47.64 82.78 Favored 'General case' 0 C--N 1.369 1.416 0 CA-C-N 123.689 2.949 . . . . 0.0 116.351 174.075 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 36' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -69.07 -31.42 70.16 Favored 'General case' 0 N--CA 1.49 1.557 0 N-CA-C 116.305 1.965 . . . . 0.0 116.305 179.491 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 37' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -73.38 -34.53 43.56 Favored 'Isoleucine or valine' 0 C--O 1.2 -1.519 0 CA-C-O 114.978 -2.439 . . . . 0.0 113.908 159.526 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 38' ' ' VAL . . . . . 0.402 ' HA ' ' HB3' ' B' ' 41' ' ' ALA . 2.6 t -76.05 -49.31 26.02 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.314 0 CA-C-N 123.969 3.077 . . . . 0.0 112.448 -176.639 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 31.5 mt-30 -55.06 -38.76 68.44 Favored 'General case' 0 CA--C 1.57 1.749 0 CA-C-O 117.631 -1.176 . . . . 0.0 112.908 156.43 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 40' ' ' ASP . . . . . . . . . . . . 0.42 7.1 t0 -52.41 -45.32 65.85 Favored 'General case' 0 N--CA 1.504 2.255 0 N-CA-C 116.737 2.125 . . . . 0.0 116.737 154.485 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 41' ' ' ALA . . . . . 0.402 ' HB3' ' HA ' ' B' ' 38' ' ' VAL 0.296 . . -84.16 -53.78 5.28 Favored 'General case' 0 CA--C 1.553 1.068 0 N-CA-C 115.807 1.78 . . . . 0.0 115.807 -161.136 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . 0.316 1.5 pp -82.48 -24.4 34.21 Favored 'General case' 0 N--CA 1.494 1.754 0 N-CA-C 117.286 2.328 . . . . 0.0 117.286 160.951 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 43' ' ' SER . . . . . . . . . . . . . 25.1 t -110.92 12.69 22.2 Favored 'General case' 0 N--CA 1.494 1.77 0 CA-C-N 122.875 2.579 . . . . 0.0 116.541 -178.893 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 44' ' ' LYS . . . . . . . . . . . . 0.434 26.4 mtmm 71.07 -99.04 0.0 OUTLIER Pre-proline 0 CA--C 1.579 2.093 0 CA-C-N 121.754 2.07 . . . . 0.0 111.426 167.51 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 71.4 Cg_endo -82.27 108.3 1.75 Allowed 'Trans proline' 0 CA--C 1.569 2.226 0 CA-C-N 126.145 3.23 . . . . 0.0 115.686 165.281 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 46' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -80.6 -158.93 0.01 OUTLIER Pre-proline 0 CA--C 1.592 2.579 0 O-C-N 121.238 -0.913 . . . . 0.0 110.949 145.27 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -64.54 83.18 0.16 Allowed 'Trans proline' 0 CA--C 1.569 2.259 0 CA-C-N 124.228 2.546 . . . . 0.0 114.182 159.553 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 48' ' ' VAL . . . . . . . . . . . . 0.288 29.8 m -130.76 -38.48 0.61 Allowed 'Isoleucine or valine' 0 N--CA 1.499 2.011 0 N-CA-C 117.516 2.413 . . . . 0.0 117.516 -169.239 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 49' ' ' THR . . . . . . . . . . . . . 6.9 m -130.97 131.52 44.46 Favored 'General case' 0 CA--C 1.578 2.049 2 O-C-N 111.806 -6.809 . . . . 0.0 112.237 2.366 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 50' ' ' GLY . . . . . . . . . . . . . . . 72.33 69.4 1.4 Allowed Glycine 0 N--CA 1.505 3.253 0 N-CA-C 118.593 2.197 . . . . 0.0 118.593 165.515 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 51' ' ' TYR . . . . . . . . . . . . 0.273 0.5 OUTLIER -144.46 -57.54 0.36 Allowed 'General case' 0 CA--C 1.578 2.023 0 N-CA-C 117.075 2.25 . . . . 0.0 117.075 -143.169 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 52' ' ' ARG . . . . . . . . . . . . 0.484 12.5 ttt180 110.2 -155.52 0.0 OUTLIER 'General case' 0 N--CA 1.534 3.731 0 N-CA-C 117.963 2.579 . . . . 0.0 117.963 -178.529 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 53' ' ' ASN . . . . . 0.439 HD22 ' ND2' ' A' ' 53' ' ' ASN . 10.5 t-20 60.94 160.18 0.05 Allowed 'General case' 0 N--CA 1.518 2.93 0 O-C-N 118.73 -2.481 . . . . 0.0 114.338 -163.901 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 54' ' ' ASP . . . . . 0.42 ' HA ' ' CG ' ' B' ' 53' ' ' ASN . 37.9 m-20 -74.89 95.06 2.89 Favored 'General case' 0 N--CA 1.477 0.923 2 O-C-N 110.787 -7.446 . . . . 0.0 109.737 -14.845 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 55' ' ' ALA . . . . . . . . . . . . . . . -94.94 -89.92 0.23 Allowed 'General case' 0 CA--C 1.566 1.575 0 CA-C-O 122.619 1.2 . . . . 0.0 113.322 -157.923 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 56' ' ' GLU . . . . . 0.802 ' O ' ' HB3' ' B' ' 59' ' ' ALA . 18.4 tt0 3.43 -60.37 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.913 0 N-CA-C 121.449 3.87 . . . . 0.0 121.449 110.631 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 57' ' ' ARG . . . . . . . . . . . . 0.526 23.0 ttm-85 -84.1 -27.84 27.93 Favored 'General case' 0 CA--C 1.574 1.896 0 O-C-N 120.039 -1.663 . . . . 0.0 112.621 -169.255 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 58' ' ' LEU . . . . . 0.658 ' HA ' ' H ' ' B' ' 61' ' ' GLU 0.601 34.5 mt -84.98 1.01 49.4 Favored 'General case' 0 CA--C 1.6 2.868 0 O-C-N 118.122 -2.861 . . . . 0.0 115.133 156.638 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 59' ' ' ALA . . . . . 0.802 ' HB3' ' O ' ' B' ' 56' ' ' GLU . . . -56.48 -41.81 77.22 Favored 'General case' 0 N--CA 1.5 2.059 1 O-C-N 116.249 -4.032 . . . . 0.0 116.592 135.86 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -66.09 -7.11 15.64 Favored 'General case' 0 N--CA 1.507 2.384 0 N-CA-C 118.528 2.788 . . . . 0.0 118.528 156.795 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 61' ' ' GLU . . . . . 0.658 ' H ' ' HA ' ' B' ' 58' ' ' LEU 0.338 0.0 OUTLIER -58.12 -52.49 65.31 Favored 'General case' 0 N--CA 1.503 2.215 0 O-C-N 118.928 -2.358 . . . . 0.0 112.306 151.809 . . . . . . . . 4 4 . 1 . 003 nuclear nobuild full ' B' B ' 62' ' ' GLN . . . . . 0.648 ' O ' HG13 ' B' ' 66' ' ' VAL 0.264 4.4 tp60 -52.04 -47.83 64.87 Favored 'General case' 0 CA--C 1.568 1.657 0 CA-C-O 116.409 -1.758 . . . . 0.0 115.159 168.6 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 25.4 m -35.81 -56.89 0.68 Allowed 'General case' 0 N--CA 1.513 2.699 0 N-CA-C 119.261 3.06 . . . . 0.0 119.261 161.825 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 64' ' ' GLU . . . . . . . . . . . . 0.408 26.2 mt-10 -77.61 0.84 21.63 Favored 'General case' 0 CA--C 1.583 2.249 0 CA-C-N 114.636 -1.165 . . . . 0.0 113.616 -177.035 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 65' ' ' LEU . . . . . . . . . . . . 0.299 0.2 OUTLIER -101.63 -40.34 7.05 Favored 'General case' 0 CA--C 1.576 1.955 0 C-N-CA 126.92 2.088 . . . . 0.0 115.386 158.396 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 66' ' ' VAL . . . . . 0.648 HG13 ' O ' ' B' ' 62' ' ' GLN 0.332 21.9 m . . . . . 0 N--CA 1.513 2.691 0 N-CA-C 117.467 2.395 . . . . 0.0 117.467 -167.288 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.559 1.289 0 N-CA-C 114.034 1.124 . . . . 0.0 114.034 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 12.5 ptm180 -90.09 102.38 15.09 Favored 'General case' 0 N--CA 1.488 1.429 0 CA-C-O 122.284 1.04 . . . . 0.0 111.147 161.232 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 12.3 m-20 -98.0 68.81 2.02 Favored 'General case' 0 CA--C 1.564 1.51 0 O-C-N 121.065 -1.022 . . . . 0.0 108.572 160.612 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 7.4 p-10 -158.39 75.92 3.58 Favored Pre-proline 0 CA--C 1.57 1.737 0 C-N-CA 123.725 0.81 . . . . 0.0 112.478 179.738 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 4.4 Cg_exo -99.07 154.01 0.63 Allowed 'Trans proline' 0 C--N 1.362 1.281 0 CA-C-N 121.936 1.727 . . . . 0.0 113.889 -157.743 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 61.7 m80 -72.34 138.42 47.3 Favored 'General case' 0 CA--C 1.562 1.413 0 CA-C-N 113.546 -1.661 . . . . 0.0 113.633 177.356 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . 0.806 ' CZ ' HD12 ' B' ' 34' ' ' LEU 0.268 35.5 p90 -116.43 170.97 8.15 Favored 'General case' 0 CA--C 1.565 1.549 0 O-C-N 120.065 -1.647 . . . . 0.0 110.438 113.902 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 93.1 m-20 -89.13 94.53 9.97 Favored 'General case' 0 N--CA 1.485 1.319 0 O-C-N 119.764 -1.835 . . . . 0.0 107.556 162.364 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . 0.635 ' CG ' HD13 ' B' ' 34' ' ' LEU . 8.9 t80 -66.9 162.83 20.92 Favored 'General case' 0 CA--C 1.556 1.202 0 CA-C-O 124.344 2.021 . . . . 0.0 111.345 160.904 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 38.3 tpt85 170.96 103.35 0.01 OUTLIER 'General case' 0 N--CA 1.486 1.346 0 O-C-N 119.785 -1.822 . . . . 0.0 106.881 -119.19 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . 0.595 ' SD ' HD23 ' A' ' 19' ' ' LEU . 11.6 mtm -138.85 122.9 11.3 Favored Pre-proline 0 CA--C 1.561 1.375 0 CA-C-O 117.296 -1.335 . . . . 0.0 110.872 -153.763 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 75.1 Cg_exo -43.0 143.11 1.96 Allowed 'Trans proline' 0 CA--C 1.562 1.923 0 C-N-CA 122.952 2.435 . . . . 0.0 116.013 163.32 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . 0.403 ' SD ' ' HG3' ' A' ' 17' ' ' GLU . 9.5 tpp -55.34 -28.68 55.35 Favored 'General case' 0 N--CA 1.491 1.609 0 N-CA-C 119.533 3.16 . . . . 0.0 119.533 -163.987 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . 0.268 9.2 pt-20 -62.7 -48.63 78.43 Favored 'General case' 0 CA--C 1.566 1.586 0 N-CA-C 116.411 2.004 . . . . 0.0 116.411 160.959 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -60.13 -44.19 94.61 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.288 0 CA-C-N 123.114 2.688 . . . . 0.0 113.438 174.345 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -80.84 -21.28 40.9 Favored 'General case' 0 CA--C 1.556 1.181 0 N-CA-C 116.63 2.085 . . . . 0.0 116.63 175.759 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.403 ' HG3' ' SD ' ' A' ' 13' ' ' MET . 38.9 mt-10 -67.34 -47.61 69.97 Favored 'General case' 0 N--CA 1.49 1.555 0 CA-C-N 123.183 2.719 . . . . 0.0 113.766 151.946 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 46.7 mtmt -57.6 -57.04 14.44 Favored 'General case' 0 N--CA 1.485 1.307 0 CA-C-N 121.609 2.004 . . . . 0.0 114.353 174.157 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.595 HD23 ' SD ' ' A' ' 11' ' ' MET 0.267 12.0 tp -64.18 -40.0 95.18 Favored 'General case' 0 CA--C 1.563 1.445 0 C-N-CA 124.812 1.245 . . . . 0.0 113.499 176.081 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 10.6 ttpt -80.26 -25.12 39.65 Favored 'General case' 0 CA--C 1.569 1.705 0 CA-C-N 120.537 1.517 . . . . 0.0 114.947 176.201 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . 0.407 ' O ' ' HB3' ' A' ' 25' ' ' ALA . 18.7 m-30 -70.43 -71.48 0.24 Allowed 'General case' 0 N--CA 1.488 1.468 0 CA-C-O 114.074 -2.869 . . . . 0.0 110.764 162.23 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.644 HH21 HD11 ' A' ' 37' ' ' ILE 0.261 7.3 tpt180 -14.09 -56.26 0.0 OUTLIER 'General case' 0 CA--C 1.595 2.683 0 CA-C-N 125.92 3.964 . . . . 0.0 116.042 159.515 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.512 ' HB2' ' CB ' ' A' ' 33' ' ' GLU . . . -55.77 -79.42 0.02 OUTLIER 'General case' 0 CA--C 1.586 2.329 0 N-CA-C 118.421 2.748 . . . . 0.0 118.421 157.921 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 66.5 mm-40 -74.9 -29.3 60.95 Favored 'General case' 0 CA--C 1.574 1.904 0 N-CA-C 119.34 3.089 . . . . 0.0 119.34 -175.437 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.407 ' HB3' ' O ' ' A' ' 21' ' ' PHE . . . -43.22 -50.94 6.35 Favored 'General case' 0 CA--C 1.577 1.994 0 N-CA-C 116.081 1.882 . . . . 0.0 116.081 152.129 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . 0.313 0.1 OUTLIER -112.67 -46.74 3.12 Favored 'General case' 0 CA--C 1.578 2.032 0 N-CA-C 114.967 1.469 . . . . 0.0 114.967 -158.77 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 153.9 22.32 0.04 OUTLIER Glycine 0 N--CA 1.501 3.029 0 N-CA-C 119.377 2.511 . . . . 0.0 119.377 179.211 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.511 HH12 HD13 ' A' ' 37' ' ' ILE . 84.4 mtm180 -132.91 163.66 28.66 Favored 'General case' 0 CA--C 1.576 1.961 0 N-CA-C 104.748 -2.315 . . . . 0.0 104.748 -177.645 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 9.4 t -137.76 115.15 11.1 Favored 'General case' 0 N--CA 1.503 2.219 0 O-C-N 117.157 -3.465 . . . . 0.0 107.071 -171.766 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 19.9 mtp -53.05 -40.7 64.17 Favored 'General case' 0 N--CA 1.491 1.62 0 N-CA-C 118.224 2.676 . . . . 0.0 118.224 -126.724 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 13.0 t-20 -45.58 -43.58 12.24 Favored 'General case' 0 CA--C 1.598 2.793 0 CA-C-N 125.505 3.775 . . . . 0.0 114.857 165.151 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . 0.416 89.1 p -56.95 -58.29 8.79 Favored 'General case' 0 N--CA 1.503 2.214 0 N-CA-C 120.348 3.462 . . . . 0.0 120.348 149.555 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . 0.512 ' CB ' ' HB2' ' A' ' 23' ' ' ALA . 10.5 tm-20 -64.82 -61.14 2.36 Favored 'General case' 0 N--CA 1.507 2.389 0 CA-C-N 123.127 2.694 . . . . 0.0 117.761 176.804 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.819 HD12 ' CZ ' ' B' ' 7' ' ' PHE . 0.0 OUTLIER -38.23 -53.44 1.45 Allowed 'General case' 0 CA--C 1.545 0.77 0 CA-C-O 115.748 -2.072 . . . . 0.0 108.126 169.019 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.495 ' HG ' ' CE1' ' B' ' 9' ' ' PHE . 11.9 mt -63.99 -56.29 16.17 Favored 'General case' 0 C--N 1.367 1.343 0 CA-C-N 123.03 2.65 . . . . 0.0 115.171 178.848 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . 0.424 ' C ' HE21 ' A' ' 36' ' ' GLN 0.276 0.0 OUTLIER -58.56 -31.1 67.68 Favored 'General case' 0 CA--C 1.57 1.727 0 CA-C-O 116.612 -1.661 . . . . 0.0 114.626 176.874 . . . . . . . . 4 4 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . 0.644 HD11 HH21 ' A' ' 22' ' ' ARG . 2.8 tp -79.28 -31.7 14.58 Favored 'Isoleucine or valine' 0 CA--C 1.567 1.62 0 CA-C-N 122.318 2.327 . . . . 0.0 116.414 164.393 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.433 HG21 HD22 ' A' ' 34' ' ' LEU . 3.1 t -77.19 -48.72 24.29 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.911 0 CA-C-N 122.285 2.311 . . . . 0.0 110.934 178.821 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 29.6 mt-30 -51.36 -46.21 62.66 Favored 'General case' 0 CA--C 1.551 0.987 0 CA-C-O 116.198 -1.858 . . . . 0.0 113.005 155.824 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . 0.407 ' HB3' ' HA ' ' A' ' 37' ' ' ILE 0.297 42.0 t0 -44.51 -55.24 5.26 Favored 'General case' 0 N--CA 1.502 2.157 0 CA-C-N 121.763 2.074 . . . . 0.0 113.644 158.497 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . 0.283 . . -76.44 -17.98 59.04 Favored 'General case' 0 CA--C 1.544 0.721 0 N-CA-C 119.324 3.083 . . . . 0.0 119.324 -161.678 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.419 HD13 ' HE ' ' B' ' 22' ' ' ARG 0.251 1.3 pt? -131.1 26.22 4.9 Favored 'General case' 0 CA--C 1.563 1.464 0 N-CA-C 117.358 2.355 . . . . 0.0 117.358 158.042 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 94.9 p -151.91 -52.94 0.12 Allowed 'General case' 0 N--CA 1.492 1.633 0 N-CA-C 116.023 1.86 . . . . 0.0 116.023 161.895 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 44.0 tttm -60.94 96.95 0.09 OUTLIER Pre-proline 0 N--CA 1.527 3.406 0 N-CA-C 120.742 3.608 . . . . 0.0 120.742 -105.373 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 27.5 Cg_endo -89.24 64.68 2.52 Favored 'Trans proline' 0 CA--C 1.563 1.967 0 CA-C-N 124.538 2.657 . . . . 0.0 115.904 172.989 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 48.2 t -152.02 80.23 6.07 Favored Pre-proline 0 CA--C 1.574 1.893 0 N-CA-C 116.052 1.871 . . . . 0.0 116.052 -164.971 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_endo -98.66 87.34 0.08 OUTLIER 'Cis proline' 0 CA--C 1.571 2.347 0 CA-C-N 122.484 1.923 . . . . 0.0 110.963 -23.598 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 12.2 p -154.34 -51.62 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.506 2.352 0 O-C-N 120.691 -1.256 . . . . 0.0 113.162 -156.766 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . 0.374 13.1 p 88.6 126.62 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.622 0 C-N-CA 125.696 1.598 . . . . 0.0 110.008 -171.172 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -118.98 70.01 0.33 Allowed Glycine 0 CA--C 1.546 1.982 0 N-CA-C 114.635 0.614 . . . . 0.0 114.635 167.401 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -130.56 24.33 5.1 Favored 'General case' 0 N--CA 1.506 2.366 2 O-C-N 114.415 -5.168 . . . . 0.0 115.626 -10.285 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . 0.29 40.3 mmt180 58.62 -39.91 0.06 Allowed 'General case' 0 N--CA 1.509 2.514 0 N-CA-C 115.863 1.801 . . . . 0.0 115.863 -128.912 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . 0.534 ' HA ' ' HB2' ' A' ' 55' ' ' ALA . 8.9 m120 -69.05 -152.44 0.02 OUTLIER 'General case' 0 CA--C 1.589 2.449 0 O-C-N 120.388 -1.445 . . . . 0.0 113.863 158.029 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . 0.539 ' H ' HD13 ' B' ' 58' ' ' LEU 0.469 0.5 OUTLIER 84.56 -93.64 0.01 OUTLIER 'General case' 0 N--CA 1.485 1.293 0 O-C-N 117.869 -3.019 . . . . 0.0 104.274 -98.81 . . . . . . . . 4 4 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . 0.534 ' HB2' ' HA ' ' A' ' 53' ' ' ASN 0.499 . . -91.87 -106.31 0.11 Allowed 'General case' 0 CA--C 1.569 1.698 2 O-C-N 114.137 -5.352 . . . . 0.0 113.99 9.208 . . . . . . . . 4 3 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.587 ' C ' ' HB3' ' A' ' 59' ' ' ALA 0.32 15.1 mm-40 -9.05 1.82 0.0 OUTLIER 'General case' 0 C--N 1.265 -3.101 1 N-CA-C 125.24 5.274 . . . . 0.0 125.24 100.13 . . . . . . . . 4 3 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.46 ' HB2' ' O ' ' A' ' 54' ' ' ASP 0.271 1.1 mpt_? -148.65 -22.79 0.32 Allowed 'General case' 0 N--CA 1.494 1.753 0 N-CA-C 118.914 2.931 . . . . 0.0 118.914 -162.813 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . 0.294 0.7 OUTLIER -66.05 -31.41 72.28 Favored 'General case' 0 N--CA 1.503 2.178 0 C-N-CA 117.243 -1.783 . . . . 0.0 115.124 126.995 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . 0.587 ' HB3' ' C ' ' A' ' 56' ' ' GLU . . . -48.33 -62.85 1.28 Allowed 'General case' 0 N--CA 1.49 1.559 0 N-CA-C 116.158 1.911 . . . . 0.0 116.158 159.587 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -98.65 -7.06 28.56 Favored 'General case' 0 CA--C 1.543 0.679 0 N-CA-C 114.071 1.137 . . . . 0.0 114.071 -167.307 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . 0.313 43.4 tp10 -67.38 -52.57 38.4 Favored 'General case' 0 CA--C 1.551 1.004 0 CA-C-O 115.147 -2.359 . . . . 0.0 112.151 149.584 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . 0.457 ' O ' HG13 ' A' ' 66' ' ' VAL 0.28 7.2 tp60 -72.73 -63.15 1.22 Allowed 'General case' 0 C--N 1.37 1.488 0 CA-C-N 124.884 3.493 . . . . 0.0 111.801 178.909 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 22.8 t -99.85 56.66 0.97 Allowed 'General case' 0 CA--C 1.56 1.348 0 N-CA-C 116.727 2.121 . . . . 0.0 116.727 170.882 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 8.0 tt0 -87.14 -49.52 7.24 Favored 'General case' 0 CA--C 1.57 1.737 0 O-C-N 119.311 -2.118 . . . . 0.0 112.466 101.39 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . 0.294 2.3 mp -90.64 27.31 1.78 Allowed 'General case' 0 N--CA 1.505 2.28 0 N-CA-C 117.137 2.273 . . . . 0.0 117.137 -162.491 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.457 HG13 ' O ' ' A' ' 62' ' ' GLN . 24.7 m . . . . . 0 N--CA 1.503 2.178 0 C-N-CA 126.259 1.824 . . . . 0.0 113.313 161.762 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.563 1.472 0 N-CA-C 114.433 1.271 . . . . 0.0 114.433 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 2' ' ' ARG . . . . . . . . . . . . 0.502 47.5 mtp180 71.61 -147.97 0.07 Allowed 'General case' 0 N--CA 1.499 2.019 1 O-C-N 113.662 -5.649 . . . . 0.0 114.213 -10.43 . . . . . . . . 3 2 . 1 . 004 nuclear nobuild full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . 0.321 25.9 t70 76.99 102.65 0.07 Allowed 'General case' 0 CA--C 1.571 1.766 0 C-N-CA 124.511 1.124 . . . . 0.0 113.364 -171.957 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 4' ' ' ASP . . . . . . . . . . . . 0.419 2.9 p30 50.72 76.61 0.53 Allowed Pre-proline 0 CA--C 1.576 1.979 0 N-CA-C 120.517 3.525 . . . . 0.0 120.517 168.282 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 4.5 Cg_exo -107.83 149.36 0.08 OUTLIER 'Trans proline' 0 CA--C 1.557 1.669 0 C-N-CA 122.457 2.105 . . . . 0.0 114.011 -165.39 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 6' ' ' HIS . . . . . . . . . . . . . 77.5 m80 -85.82 135.28 33.78 Favored 'General case' 0 CA--C 1.579 2.059 0 CA-C-N 114.959 -1.019 . . . . 0.0 112.117 174.647 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 7' ' ' PHE . . . . . 0.819 ' CZ ' HD12 ' A' ' 34' ' ' LEU . 3.0 p90 -135.94 161.7 34.9 Favored 'General case' 0 CA--C 1.571 1.778 0 O-C-N 119.896 -1.752 . . . . 0.0 112.345 151.058 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 8' ' ' ASN . . . . . . . . . . . . . 7.8 p-10 -62.32 102.75 0.33 Allowed 'General case' 0 CA--C 1.575 1.909 0 N-CA-C 116.001 1.852 . . . . 0.0 116.001 171.782 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 9' ' ' PHE . . . . . 0.622 ' CG ' HD13 ' A' ' 34' ' ' LEU . 4.9 t80 -126.81 105.99 9.04 Favored 'General case' 0 CA--C 1.538 0.516 0 N-CA-C 107.661 -1.237 . . . . 0.0 107.661 159.662 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 10' ' ' ARG . . . . . . . . . . . . 0.469 0.0 OUTLIER 92.79 87.45 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.566 1 O-C-N 114.162 -5.337 . . . . 0.0 109.339 -11.415 . . . . . . . . 4 3 . 1 . 004 nuclear nobuild full ' B' B ' 11' ' ' MET . . . . . 0.633 ' SD ' HD23 ' B' ' 19' ' ' LEU . 8.4 mtm -148.87 126.29 5.6 Favored Pre-proline 0 CA--C 1.566 1.565 0 CA-C-O 117.045 -1.455 . . . . 0.0 110.371 -160.261 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 12' ' ' PRO . . . . . . . . . . . . . 76.9 Cg_exo -42.55 140.47 2.68 Favored 'Trans proline' 0 C--N 1.371 1.72 0 C-N-CA 123.242 2.628 . . . . 0.0 116.261 161.944 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 13' ' ' MET . . . . . 0.452 ' SD ' ' HG3' ' B' ' 17' ' ' GLU . 23.4 tpp -54.76 -29.19 53.29 Favored 'General case' 0 N--CA 1.495 1.78 0 N-CA-C 119.006 2.965 . . . . 0.0 119.006 -163.886 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 12.0 pt-20 -61.95 -48.25 81.22 Favored 'General case' 0 N--CA 1.492 1.672 0 N-CA-C 117.008 2.225 . . . . 0.0 117.008 163.972 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -58.92 -50.58 79.08 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.138 0 CA-C-N 121.163 1.801 . . . . 0.0 113.001 172.123 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -73.83 -26.09 60.41 Favored 'General case' 0 CA--C 1.545 0.759 0 N-CA-C 116.7 2.111 . . . . 0.0 116.7 175.826 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 17' ' ' GLU . . . . . 0.452 ' HG3' ' SD ' ' B' ' 13' ' ' MET . 43.2 mt-10 -64.13 -48.2 76.98 Favored 'General case' 0 N--CA 1.49 1.565 0 CA-C-N 123.908 3.049 . . . . 0.0 112.959 156.883 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . 0.615 23.5 pttt -67.26 -40.28 86.19 Favored 'General case' 0 N--CA 1.488 1.442 0 N-CA-C 117.415 2.376 . . . . 0.0 117.415 178.963 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 19' ' ' LEU . . . . . 0.633 HD23 ' SD ' ' B' ' 11' ' ' MET . 12.5 tp -69.75 -35.88 75.33 Favored 'General case' 0 CA--C 1.565 1.52 0 N-CA-C 115.081 1.512 . . . . 0.0 115.081 168.234 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 20' ' ' LYS . . . . . . . . . . . . . 14.3 ttpt -86.57 -30.74 21.64 Favored 'General case' 0 CA--C 1.567 1.627 0 N-CA-C 114.721 1.378 . . . . 0.0 114.721 178.814 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 21' ' ' PHE . . . . . 0.438 ' O ' ' HB3' ' B' ' 25' ' ' ALA . 24.5 m-85 -59.66 -68.56 0.27 Allowed 'General case' 0 N--CA 1.492 1.629 0 CA-C-O 114.188 -2.815 . . . . 0.0 111.514 155.23 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 22' ' ' ARG . . . . . 0.419 ' HE ' HD13 ' A' ' 42' ' ' LEU 0.306 13.9 ttm-85 -25.68 -47.79 0.02 OUTLIER 'General case' 0 CA--C 1.597 2.788 0 CA-C-N 125.583 3.811 . . . . 0.0 116.979 163.411 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -61.36 -61.78 2.3 Favored 'General case' 0 CA--C 1.581 2.148 0 N-CA-C 119.936 3.31 . . . . 0.0 119.936 160.668 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 49.4 mt-10 -68.04 -51.34 47.96 Favored 'General case' 0 N--CA 1.502 2.128 0 N-CA-C 116.743 2.127 . . . . 0.0 116.743 175.041 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 25' ' ' ALA . . . . . 0.438 ' HB3' ' O ' ' B' ' 21' ' ' PHE . . . -40.92 -46.57 2.81 Favored 'General case' 0 CA--C 1.586 2.357 0 N-CA-C 117.455 2.391 . . . . 0.0 117.455 162.953 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 26' ' ' ASN . . . . . . . . . . . . . 77.8 m-20 -86.07 -42.23 14.11 Favored 'General case' 0 N--CA 1.503 2.224 0 N-CA-C 117.168 2.284 . . . . 0.0 117.168 170.896 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 27' ' ' GLY . . . . . . . . . . . . . . . 99.53 57.0 0.95 Allowed Glycine 0 N--CA 1.493 2.455 0 N-CA-C 116.174 1.23 . . . . 0.0 116.174 -159.878 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 28' ' ' ARG . . . . . . . . . . . . . 10.7 ptt-85 -156.33 100.48 1.99 Allowed 'General case' 0 N--CA 1.493 1.688 0 N-CA-C 106.683 -1.599 . . . . 0.0 106.683 176.936 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 29' ' ' SER . . . . . . . . . . . . . 31.6 t -79.92 133.38 36.21 Favored 'General case' 0 N--CA 1.5 2.026 0 O-C-N 119.259 -2.151 . . . . 0.0 108.381 -156.322 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 30' ' ' MET . . . . . . . . . . . . . 25.1 mtp -47.21 -41.01 17.47 Favored 'General case' 0 N--CA 1.501 2.111 0 N-CA-C 119.089 2.996 . . . . 0.0 119.089 -143.371 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 31' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -47.91 -40.72 22.68 Favored 'General case' 0 CA--C 1.593 2.609 0 CA-C-N 125.318 3.69 . . . . 0.0 115.392 166.006 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 32' ' ' SER . . . . . . . . . . . . 0.37 37.4 t -54.25 -72.51 0.06 Allowed 'General case' 0 CA--C 1.576 1.946 0 N-CA-C 118.255 2.687 . . . . 0.0 118.255 145.57 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -57.3 -57.2 13.68 Favored 'General case' 0 N--CA 1.522 3.165 0 CA-C-N 125.382 3.719 . . . . 0.0 116.926 -177.693 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 34' ' ' LEU . . . . . 0.806 HD12 ' CZ ' ' A' ' 7' ' ' PHE . 0.1 OUTLIER -40.59 -55.77 2.25 Favored 'General case' 0 CA--C 1.547 0.833 0 CA-C-O 115.698 -2.096 . . . . 0.0 108.382 169.054 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 35' ' ' LEU . . . . . 0.415 HD23 ' HA ' ' B' ' 35' ' ' LEU . 12.8 mt -59.78 -45.83 91.09 Favored 'General case' 0 C--N 1.367 1.365 0 CA-C-N 122.922 2.601 . . . . 0.0 116.135 175.575 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 36' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -56.12 -56.57 19.29 Favored 'General case' 0 CA--C 1.547 0.834 0 CA-C-O 117.534 -1.222 . . . . 0.0 113.276 175.27 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 37' ' ' ILE . . . . . . . . . . . . . 2.9 tp -63.8 -25.14 37.52 Favored 'Isoleucine or valine' 0 CA--C 1.563 1.461 0 CA-C-O 115.006 -2.426 . . . . 0.0 117.379 169.517 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 38' ' ' VAL . . . . . 0.492 HG21 HD22 ' B' ' 34' ' ' LEU . 3.5 t -83.29 -49.56 16.49 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.069 0 C-N-CA 127.311 2.244 . . . . 0.0 111.335 -177.018 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 26.6 mt-30 -49.66 -45.98 49.23 Favored 'General case' 0 CA--C 1.565 1.54 0 CA-C-O 118.286 -0.864 . . . . 0.0 112.214 154.614 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 40' ' ' ASP . . . . . . . . . . . . 0.343 0.2 OUTLIER -53.25 -41.28 65.31 Favored 'General case' 0 N--CA 1.492 1.636 0 N-CA-C 119.029 2.974 . . . . 0.0 119.029 157.759 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -68.3 -47.37 67.78 Favored 'General case' 0 N--CA 1.486 1.35 0 N-CA-C 114.715 1.376 . . . . 0.0 114.715 -165.646 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 1.4 pp -100.95 -12.34 19.0 Favored 'General case' 0 CA--C 1.567 1.63 0 N-CA-C 117.794 2.516 . . . . 0.0 117.794 171.708 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 43' ' ' SER . . . . . . . . . . . . . 6.6 m -75.19 -37.39 61.22 Favored 'General case' 0 N--CA 1.502 2.138 0 CA-C-N 122.5 2.409 . . . . 0.0 114.793 159.251 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 44' ' ' LYS . . . . . . . . . . . . 0.425 9.3 pttm 64.7 164.39 0.12 Allowed Pre-proline 0 CA--C 1.595 2.706 0 N-CA-C 117.265 2.32 . . . . 0.0 117.265 173.095 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 45' ' ' PRO . . . . . 0.419 ' HB2' HG11 ' B' ' 48' ' ' VAL . 20.3 Cg_endo -68.23 105.6 1.24 Allowed 'Trans proline' 0 CA--C 1.568 2.195 0 N-CA-C 118.415 2.429 . . . . 0.0 118.415 -173.335 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 46' ' ' SER . . . . . . . . . . . . . 61.6 m -105.37 -70.78 0.03 OUTLIER Pre-proline 0 CA--C 1.577 1.998 0 CA-C-O 115.607 -2.139 . . . . 0.0 112.093 165.147 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 70.6 Cg_endo -77.11 56.44 5.43 Favored 'Trans proline' 0 CA--C 1.574 2.491 0 CA-C-N 126.155 3.234 . . . . 0.0 116.952 171.495 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 48' ' ' VAL . . . . . 0.419 HG11 ' HB2' ' B' ' 45' ' ' PRO . 3.3 p -99.01 -35.06 4.68 Favored 'Isoleucine or valine' 0 CA--C 1.576 1.957 0 C-N-CA 125.361 1.464 . . . . 0.0 114.621 -178.051 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 49' ' ' THR . . . . . . . . . . . . 0.467 1.9 t 69.58 70.72 0.25 Allowed 'General case' 0 N--CA 1.499 2.008 0 N-CA-C 116.462 2.023 . . . . 0.0 116.462 151.021 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 50' ' ' GLY . . . . . . . . . . . . . . . 115.95 -63.96 0.34 Allowed Glycine 0 N--CA 1.497 2.722 0 CA-C-O 122.442 1.023 . . . . 0.0 112.288 -178.503 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 51' ' ' TYR . . . . . . . . . . . . . 57.9 m-85 -32.98 73.22 0.0 OUTLIER 'General case' 0 CA--C 1.596 2.734 0 N-CA-C 120.814 3.635 . . . . 0.0 120.814 148.8 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 52' ' ' ARG . . . . . . . . . . . . . 96.8 mtt-85 -151.03 115.06 5.01 Favored 'General case' 0 N--CA 1.51 2.551 0 O-C-N 118.355 -2.716 . . . . 0.0 115.346 -170.356 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 53' ' ' ASN . . . . . 0.445 HD21 ' HB2' ' A' ' 57' ' ' ARG 0.614 0.1 OUTLIER 80.71 145.77 0.08 Allowed 'General case' 0 CA--C 1.568 1.636 2 O-C-N 112.816 -6.178 . . . . 0.0 117.572 -16.249 . . . . . . . . 5 4 . 1 . 004 nuclear nobuild full ' B' B ' 54' ' ' ASP . . . . . 0.51 ' HB3' ' HB2' ' B' ' 57' ' ' ARG 1.141 0.0 OUTLIER 107.85 24.77 0.0 OUTLIER 'General case' 0 N--CA 1.519 2.983 2 O-C-N 114.102 -5.374 . . . . 0.0 123.808 -6.143 . . . . . . . . 5 4 . 1 . 004 nuclear nobuild full ' B' B ' 55' ' ' ALA . . . . . . . . . . . . 0.622 . . -87.97 5.36 41.09 Favored 'General case' 0 CA--C 1.568 1.65 1 O-C-N 114.666 -5.021 . . . . 0.0 118.73 116.94 . . . . . . . . 3 2 . 1 . 004 nuclear nobuild full ' B' B ' 56' ' ' GLU . . . . . 0.425 ' HB3' ' HA ' ' B' ' 54' ' ' ASP . 9.6 tp10 -53.05 -8.34 0.1 Allowed 'General case' 0 CA--C 1.585 2.289 0 N-CA-C 119.981 3.326 . . . . 0.0 119.981 123.511 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 57' ' ' ARG . . . . . 0.51 ' HB2' ' HB3' ' B' ' 54' ' ' ASP . 0.1 OUTLIER -94.71 -45.57 7.29 Favored 'General case' 0 N--CA 1.475 0.793 0 O-C-N 119.674 -1.891 . . . . 0.0 113.471 163.126 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 58' ' ' LEU . . . . . 0.539 HD13 ' H ' ' A' ' 54' ' ' ASP . 7.8 mp -43.55 -53.73 5.39 Favored 'General case' 0 N--CA 1.527 3.424 0 CA-C-N 123.026 2.648 . . . . 0.0 117.5 166.875 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 59' ' ' ALA . . . . . 0.42 ' HB3' ' C ' ' B' ' 56' ' ' GLU 0.41 . . -13.6 -86.53 0.0 OUTLIER 'General case' 0 CA--C 1.555 1.14 1 N-CA-C 123.01 4.448 . . . . 0.0 123.01 132.982 . . . . . . . . 4 3 . 1 . 004 nuclear nobuild full ' B' B ' 60' ' ' ASP . . . . . 0.404 ' HA ' ' N ' ' B' ' 65' ' ' LEU . 2.1 m-20 -68.59 0.12 4.5 Favored 'General case' 0 CA--C 1.559 1.315 0 N-CA-C 119.845 3.276 . . . . 0.0 119.845 -175.396 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 61' ' ' GLU . . . . . . . . . . . . 0.268 0.3 OUTLIER -59.56 -92.01 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.873 0 CA-C-O 115.377 -2.249 . . . . 0.0 106.62 138.137 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 62' ' ' GLN . . . . . 0.535 ' O ' HG13 ' B' ' 66' ' ' VAL 0.517 14.0 mm-40 -88.15 88.47 7.65 Favored 'General case' 0 N--CA 1.488 1.441 0 CA-C-O 127.108 3.337 . . . . 0.0 112.028 -178.523 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 63' ' ' SER . . . . . 0.79 ' H ' ' H ' ' B' ' 65' ' ' LEU 2.11 4.6 t -123.88 8.69 8.75 Favored 'General case' 0 CA--C 1.598 2.805 2 O-C-N 114.609 -5.057 . . . . 0.0 122.063 69.084 . . . . . . . . 4 3 . 1 . 004 nuclear nobuild full ' B' B ' 64' ' ' GLU . . . . . . . . . . . . 2.413 23.9 tt0 84.83 -34.74 0.05 Allowed 'General case' 0 CA--C 1.583 2.224 1 O-C-N 116.154 -4.091 . . . . 0.0 110.474 -114.587 . . . . . . . . 3 2 . 1 . 004 nuclear nobuild full ' B' B ' 65' ' ' LEU . . . . . 0.79 ' H ' ' H ' ' B' ' 63' ' ' SER . 4.4 mt -171.64 -62.95 0.02 OUTLIER 'General case' 0 N--CA 1.518 2.936 0 N-CA-C 121.324 3.824 . . . . 0.0 121.324 -112.642 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 66' ' ' VAL . . . . . 0.777 ' H ' ' HA ' ' B' ' 63' ' ' SER 0.582 0.1 OUTLIER . . . . . 0 N--CA 1.491 1.593 0 N-CA-C 121.411 3.856 . . . . 0.0 121.411 -160.885 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.563 1.471 0 N-CA-C 114.863 1.431 . . . . 0.0 114.863 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . 0.4 0.0 OUTLIER 72.26 -154.36 0.08 Allowed 'General case' 0 N--CA 1.499 2.002 1 O-C-N 113.68 -5.638 . . . . 0.0 114.335 -8.864 . . . . . . . . 4 3 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -115.65 62.4 0.7 Allowed 'General case' 0 CA--C 1.565 1.531 0 C-N-CA 125.011 1.325 . . . . 0.0 107.881 167.785 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 2.1 p30 -161.95 75.94 2.24 Favored Pre-proline 0 CA--C 1.568 1.64 0 O-C-N 121.285 -0.885 . . . . 0.0 112.969 -178.656 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 6.0 Cg_exo -100.2 155.35 0.5 Allowed 'Trans proline' 0 CA--C 1.553 1.472 0 C-N-CA 121.974 1.783 . . . . 0.0 113.835 -159.382 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 77.5 m80 -76.37 138.31 40.34 Favored 'General case' 0 CA--C 1.56 1.361 0 CA-C-N 113.664 -1.607 . . . . 0.0 113.479 -178.093 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . 0.809 ' CZ ' HD12 ' B' ' 34' ' ' LEU 0.274 36.2 p90 -116.03 164.56 14.26 Favored 'General case' 0 CA--C 1.561 1.381 0 CA-C-O 123.927 1.822 . . . . 0.0 110.244 117.003 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 26.6 p-10 -82.1 89.34 6.45 Favored 'General case' 0 CA--C 1.564 1.515 0 O-C-N 119.72 -1.863 . . . . 0.0 109.385 161.803 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . 0.598 ' CG ' HD13 ' B' ' 34' ' ' LEU . 9.0 t80 -66.39 167.93 9.75 Favored 'General case' 0 CA--C 1.557 1.24 0 CA-C-O 123.96 1.838 . . . . 0.0 110.334 159.243 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 38.8 tpt85 159.85 110.03 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.482 0 O-C-N 119.411 -2.056 . . . . 0.0 106.128 -116.23 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 2.2 mpt? -119.26 -168.66 0.13 Allowed Pre-proline 0 CA--C 1.576 1.949 0 C-N-CA 120.0 -0.68 . . . . 0.0 112.711 -168.048 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -98.11 161.57 0.81 Allowed 'Trans proline' 0 CA--C 1.566 2.09 0 CA-C-O 123.393 1.331 . . . . 0.0 114.119 133.098 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . 0.441 ' SD ' ' HG3' ' A' ' 17' ' ' GLU . 22.3 tpp -58.86 -33.81 70.89 Favored 'General case' 0 N--CA 1.497 1.911 0 N-CA-C 117.432 2.382 . . . . 0.0 117.432 -162.235 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . 0.25 9.1 pt-20 -62.26 -42.35 99.25 Favored 'General case' 0 N--CA 1.49 1.551 0 N-CA-C 116.39 1.996 . . . . 0.0 116.39 166.043 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.427 ' CG1' HG12 ' B' ' 38' ' ' VAL . 0.4 OUTLIER -61.0 -48.84 87.26 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.211 0 CA-C-N 122.566 2.439 . . . . 0.0 112.872 173.358 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 4.8 ttt180 -71.7 -33.76 69.05 Favored 'General case' 0 CA--C 1.547 0.85 0 CA-C-O 116.153 -1.88 . . . . 0.0 115.635 174.185 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.441 ' HG3' ' SD ' ' A' ' 13' ' ' MET . 40.7 mt-10 -59.44 -42.92 93.02 Favored 'General case' 0 N--CA 1.492 1.628 0 CA-C-N 123.986 3.085 . . . . 0.0 114.671 159.997 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . 0.271 39.9 mtmt -63.95 -49.57 72.05 Favored 'General case' 0 CA--C 1.566 1.582 0 CA-C-N 120.724 1.602 . . . . 0.0 115.142 172.054 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.644 ' HG ' ' SD ' ' A' ' 30' ' ' MET 0.303 13.3 tp -67.35 -38.84 85.47 Favored 'General case' 0 CA--C 1.57 1.745 0 C-N-CA 125.824 1.65 . . . . 0.0 114.616 173.173 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 31.9 ttpt -88.0 -25.97 22.86 Favored 'General case' 0 CA--C 1.561 1.403 0 CA-C-O 117.261 -1.352 . . . . 0.0 113.663 -179.743 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 19.1 m-85 -64.04 -74.48 0.1 Allowed 'General case' 0 N--CA 1.489 1.492 0 CA-C-O 112.211 -3.756 . . . . 0.0 109.822 154.104 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . 0.275 6.0 tpp180 -14.31 -60.17 0.01 OUTLIER 'General case' 0 CA--C 1.589 2.468 1 CA-C-N 126.402 4.183 . . . . 0.0 115.473 165.754 . . . . . . . . 3 2 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.513 ' HB2' ' HB3' ' A' ' 33' ' ' GLU . . . -50.38 -78.95 0.02 OUTLIER 'General case' 0 CA--C 1.584 2.257 0 N-CA-C 120.375 3.472 . . . . 0.0 120.375 156.592 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 30.4 mt-10 -67.92 -34.47 76.67 Favored 'General case' 0 N--CA 1.503 2.201 0 N-CA-C 118.969 2.951 . . . . 0.0 118.969 -179.277 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -39.23 -47.79 1.7 Allowed 'General case' 0 CA--C 1.584 2.266 0 N-CA-C 116.119 1.896 . . . . 0.0 116.119 152.607 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . 0.402 ' CG ' HD22 ' B' ' 65' ' ' LEU . 0.1 OUTLIER -95.32 -51.99 4.36 Favored 'General case' 0 CA--C 1.577 2.015 0 N-CA-C 116.757 2.132 . . . . 0.0 116.757 -176.145 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 132.99 -13.3 5.0 Favored Glycine 0 CA--C 1.561 2.929 0 N-CA-C 120.445 2.938 . . . . 0.0 120.445 -150.089 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.47 ' HD3' ' HB3' ' B' ' 64' ' ' GLU . 75.8 mtm180 -90.61 151.32 21.34 Favored 'General case' 0 N--CA 1.497 1.907 0 CA-C-N 121.605 2.702 . . . . 0.0 105.608 172.195 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 35.3 t -121.64 106.01 10.95 Favored 'General case' 0 N--CA 1.502 2.143 0 O-C-N 118.14 -2.85 . . . . 0.0 106.477 -168.346 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' MET . . . . . 0.644 ' SD ' ' HG ' ' A' ' 19' ' ' LEU . 0.0 OUTLIER -38.85 -44.89 1.09 Allowed 'General case' 0 N--CA 1.494 1.729 0 N-CA-C 120.785 3.624 . . . . 0.0 120.785 -140.156 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 6.5 t-20 -45.96 -47.05 16.57 Favored 'General case' 0 CA--C 1.599 2.854 0 O-C-N 117.459 -3.276 . . . . 0.0 114.3 165.552 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . 0.332 31.2 t -47.35 -73.43 0.04 OUTLIER 'General case' 0 N--CA 1.504 2.245 0 N-CA-C 118.069 2.618 . . . . 0.0 118.069 142.929 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . 0.513 ' HB3' ' HB2' ' A' ' 23' ' ' ALA . 8.4 tm-20 -64.17 -55.23 23.24 Favored 'General case' 0 N--CA 1.501 2.103 0 N-CA-C 119.347 3.092 . . . . 0.0 119.347 -172.913 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.752 HD12 ' CZ ' ' B' ' 7' ' ' PHE . 0.2 OUTLIER -36.88 -52.8 0.94 Allowed 'General case' 0 CA--C 1.554 1.116 0 CA-C-O 115.764 -2.065 . . . . 0.0 107.341 163.691 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.471 HD22 HG21 ' B' ' 15' ' ' VAL . 14.0 mt -62.58 -51.99 65.18 Favored 'General case' 0 C--N 1.372 1.561 0 CA-C-N 122.925 2.602 . . . . 0.0 115.896 177.534 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -63.7 -36.05 82.57 Favored 'General case' 0 N--CA 1.484 1.257 0 N-CA-C 114.5 1.296 . . . . 0.0 114.5 -177.824 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 12.7 tt -73.01 -43.26 58.98 Favored 'Isoleucine or valine' 0 C--O 1.189 -2.099 0 CA-C-O 113.108 -3.33 . . . . 0.0 114.198 160.347 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.592 HG21 HD22 ' A' ' 34' ' ' LEU . 3.1 t -65.09 -50.17 75.74 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.647 1 CA-C-N 126.61 4.277 . . . . 0.0 113.888 -177.457 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 38.0 mt-30 -46.49 -57.93 4.25 Favored 'General case' 0 C--N 1.365 1.24 0 CA-C-O 114.131 -2.842 . . . . 0.0 108.949 158.377 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . 0.548 4.6 t70 -36.68 -56.2 0.84 Allowed 'General case' 0 N--CA 1.496 1.827 0 N-CA-C 118.301 2.704 . . . . 0.0 118.301 161.997 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . 0.261 . . -84.44 -20.33 31.96 Favored 'General case' 0 CA--C 1.544 0.713 0 N-CA-C 118.013 2.597 . . . . 0.0 118.013 -149.2 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . 0.304 1.1 pt? -96.51 -42.82 7.89 Favored 'General case' 0 N--CA 1.485 1.298 0 N-CA-C 117.933 2.568 . . . . 0.0 117.933 147.869 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 13.0 t -170.65 82.77 0.09 Allowed 'General case' 0 N--CA 1.483 1.223 0 CA-C-N 120.4 1.455 . . . . 0.0 107.474 -174.931 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . 0.32 4.2 tmtt? -37.54 -43.54 1.38 Allowed Pre-proline 0 N--CA 1.531 3.575 1 N-CA-C 122.308 4.188 . . . . 0.0 122.308 172.585 . . . . . . . . 3 2 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 11.5 Cg_endo -62.37 141.26 86.52 Favored 'Trans proline' 0 CA--C 1.563 1.929 0 N-CA-C 120.736 3.322 . . . . 0.0 120.736 -161.702 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 15.8 m -88.17 -40.87 0.48 Allowed Pre-proline 0 N--CA 1.502 2.164 0 O-C-N 116.587 -3.821 . . . . 0.0 119.24 35.174 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . 0.435 ' HA ' ' HA ' ' A' ' 48' ' ' VAL . 33.5 Cg_exo -66.96 96.89 0.39 Allowed 'Trans proline' 0 C--N 1.375 1.926 0 CA-C-N 125.827 3.117 . . . . 0.0 116.279 -169.993 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . 0.435 ' HA ' ' HA ' ' A' ' 47' ' ' PRO . 2.3 m -160.02 -66.34 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.509 2.507 0 O-C-N 116.448 -3.908 . . . . 0.0 107.496 30.423 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . 0.423 ' H ' HG23 ' A' ' 48' ' ' VAL . 9.0 t -70.06 39.21 0.04 OUTLIER 'General case' 0 CA--C 1.577 2.014 0 N-CA-C 118.394 2.739 . . . . 0.0 118.394 162.747 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 97.81 -115.83 5.37 Favored Glycine 0 N--CA 1.489 2.178 0 N-CA-C 110.551 -1.02 . . . . 0.0 110.551 -147.297 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 71.8 m-85 -87.63 105.62 17.47 Favored 'General case' 0 CA--C 1.581 2.17 2 O-C-N 113.457 -5.731 . . . . 0.0 111.593 -3.775 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . 0.325 7.6 tpt180 -81.35 -131.06 0.02 OUTLIER 'General case' 0 N--CA 1.51 2.527 0 O-C-N 118.355 -2.716 . . . . 0.0 113.072 -176.109 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . 0.557 ' CB ' ' HA ' ' B' ' 53' ' ' ASN 0.401 8.9 m120 72.66 110.78 0.06 Allowed 'General case' 0 N--CA 1.509 2.519 0 N-CA-C 119.976 3.325 . . . . 0.0 119.976 131.133 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . 0.504 ' CB ' ' HB2' ' B' ' 53' ' ' ASN 1.268 0.0 OUTLIER 46.62 5.34 0.0 OUTLIER 'General case' 0 N--CA 1.511 2.581 1 N-CA-C 123.486 4.624 . . . . 0.0 123.486 -173.96 . . . . . . . . 5 4 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . 0.48 ' HB3' ' C ' ' A' ' 53' ' ' ASN 0.396 . . -10.51 -71.22 0.0 OUTLIER 'General case' 0 CA--C 1.592 2.573 2 O-C-N 114.17 -5.332 . . . . 0.0 124.005 94.597 . . . . . . . . 4 3 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.421 ' HA ' ' HB3' ' A' ' 59' ' ' ALA . 31.3 mp0 -53.13 -0.78 0.02 OUTLIER 'General case' 0 CA--C 1.595 2.693 0 N-CA-C 118.935 2.939 . . . . 0.0 118.935 155.448 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.44 ' HB2' ' CB ' ' A' ' 54' ' ' ASP . 27.0 ttt180 -88.38 -42.03 12.44 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 119.834 -1.792 . . . . 0.0 113.712 163.333 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 5.7 mp -61.2 -44.65 96.95 Favored 'General case' 0 CA--C 1.578 2.049 0 CA-C-O 121.563 0.697 . . . . 0.0 112.06 171.781 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . 0.421 ' HB3' ' HA ' ' A' ' 56' ' ' GLU . . . -36.7 -65.83 0.26 Allowed 'General case' 0 N--CA 1.484 1.274 0 N-CA-C 119.036 2.976 . . . . 0.0 119.036 146.149 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -78.42 1.58 21.65 Favored 'General case' 0 N--CA 1.486 1.328 0 N-CA-C 116.97 2.211 . . . . 0.0 116.97 -177.852 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 29.5 tt0 -74.77 -64.99 0.92 Allowed 'General case' 0 CA--C 1.55 0.953 0 CA-C-O 116.852 -1.546 . . . . 0.0 109.158 159.908 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 1.7 tp60 -70.06 -60.74 2.11 Favored 'General case' 0 C--N 1.363 1.187 0 CA-C-N 122.742 2.519 . . . . 0.0 111.39 176.155 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . 0.471 ' HA ' HG22 ' A' ' 66' ' ' VAL 0.339 29.9 t -84.89 45.12 1.13 Allowed 'General case' 0 CA--C 1.566 1.578 0 N-CA-C 116.968 2.211 . . . . 0.0 116.968 172.242 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 -94.4 -52.44 4.34 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 119.369 -2.082 . . . . 0.0 113.374 110.645 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 20.7 mt -68.15 -19.57 64.81 Favored 'General case' 0 CA--C 1.576 1.974 0 N-CA-C 117.145 2.276 . . . . 0.0 117.145 -164.374 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.471 HG22 ' HA ' ' A' ' 63' ' ' SER . 26.4 m . . . . . 0 N--CA 1.51 2.533 0 N-CA-C 117.439 2.385 . . . . 0.0 117.439 159.487 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.559 1.289 0 N-CA-C 113.649 0.981 . . . . 0.0 113.649 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 2' ' ' ARG . . . . . . . . . . . . . 25.6 ptt180 -81.01 88.13 5.96 Favored 'General case' 0 CA--C 1.567 1.624 0 CA-C-O 122.243 1.02 . . . . 0.0 112.405 171.928 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -117.66 74.89 0.96 Allowed 'General case' 0 CA--C 1.567 1.62 0 O-C-N 120.239 -1.538 . . . . 0.0 107.009 160.793 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 4' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -104.55 152.42 39.38 Favored Pre-proline 0 CA--C 1.56 1.358 1 O-C-N 115.861 -4.275 . . . . 0.0 111.341 42.678 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 21.7 Cg_exo -64.77 -172.25 0.19 Allowed 'Trans proline' 0 CA--C 1.572 2.412 0 C-N-CA 122.714 2.276 . . . . 0.0 115.921 158.51 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 6' ' ' HIS . . . . . . . . . . . . . 80.1 m80 -96.02 145.52 25.38 Favored 'General case' 0 CA--C 1.581 2.153 0 CA-C-N 113.154 -1.839 . . . . 0.0 111.287 177.978 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 7' ' ' PHE . . . . . 0.752 ' CZ ' HD12 ' A' ' 34' ' ' LEU . 2.3 p90 -128.93 162.46 27.51 Favored 'General case' 0 CA--C 1.574 1.868 0 O-C-N 119.188 -2.195 . . . . 0.0 112.838 144.108 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 8' ' ' ASN . . . . . . . . . . . . . 7.9 p-10 -64.05 103.54 0.61 Allowed 'General case' 0 CA--C 1.572 1.789 0 O-C-N 120.153 -1.592 . . . . 0.0 115.134 171.646 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 9' ' ' PHE . . . . . 0.633 ' CG ' HD13 ' A' ' 34' ' ' LEU . 3.7 t80 -126.02 105.72 9.1 Favored 'General case' 0 CA--C 1.539 0.543 0 O-C-N 120.971 -1.08 . . . . 0.0 108.135 160.88 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 10' ' ' ARG . . . . . . . . . . . . 0.467 0.1 OUTLIER 94.64 87.39 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.596 1 O-C-N 114.081 -5.387 . . . . 0.0 109.519 -12.543 . . . . . . . . 4 3 . 1 . 005 nuclear nobuild full ' B' B ' 11' ' ' MET . . . . . 0.599 ' SD ' HD23 ' B' ' 19' ' ' LEU . 8.5 mtm -148.84 123.85 4.94 Favored Pre-proline 0 CA--C 1.566 1.568 0 CA-C-O 117.152 -1.404 . . . . 0.0 110.201 -159.133 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 12' ' ' PRO . . . . . . . . . . . . . 77.9 Cg_exo -40.76 143.16 0.62 Allowed 'Trans proline' 0 C--N 1.371 1.76 0 C-N-CA 123.467 2.778 . . . . 0.0 116.935 162.688 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 13' ' ' MET . . . . . 0.417 ' SD ' ' HG3' ' B' ' 17' ' ' GLU . 15.4 tpp -56.35 -32.47 64.74 Favored 'General case' 0 N--CA 1.493 1.691 0 N-CA-C 118.449 2.759 . . . . 0.0 118.449 -160.712 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 14' ' ' GLU . . . . . . . . . . . . 0.281 10.3 pt-20 -60.47 -50.92 71.64 Favored 'General case' 0 N--CA 1.49 1.534 0 N-CA-C 115.87 1.804 . . . . 0.0 115.87 162.36 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 15' ' ' VAL . . . . . 0.471 HG21 HD22 ' A' ' 35' ' ' LEU . 0.2 OUTLIER -58.35 -45.21 89.57 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.265 0 CA-C-N 122.924 2.602 . . . . 0.0 113.972 177.854 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 1.1 ttt180 -74.98 -34.4 61.99 Favored 'General case' 0 CA--C 1.544 0.727 0 CA-C-O 115.912 -1.994 . . . . 0.0 116.099 173.709 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 17' ' ' GLU . . . . . 0.417 ' HG3' ' SD ' ' B' ' 13' ' ' MET . 43.4 mt-10 -63.61 -39.37 94.2 Favored 'General case' 0 N--CA 1.497 1.886 0 CA-C-N 124.206 3.185 . . . . 0.0 114.052 161.632 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 44.5 mtmt -61.52 -60.55 3.52 Favored 'General case' 0 CA--C 1.568 1.641 0 CA-C-N 120.572 1.533 . . . . 0.0 114.199 169.913 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 19' ' ' LEU . . . . . 0.607 HD21 ' HG ' ' B' ' 34' ' ' LEU . 13.9 tp -60.86 -37.72 83.1 Favored 'General case' 0 N--CA 1.488 1.469 0 N-CA-C 115.249 1.574 . . . . 0.0 115.249 175.324 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 20' ' ' LYS . . . . . . . . . . . . . 19.8 ttpt -85.51 -30.87 23.09 Favored 'General case' 0 CA--C 1.561 1.366 0 CA-C-O 117.242 -1.361 . . . . 0.0 114.252 179.949 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 20.9 m-30 -64.91 -77.04 0.06 Allowed 'General case' 0 N--CA 1.491 1.598 0 CA-C-O 113.193 -3.289 . . . . 0.0 109.668 157.62 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 22' ' ' ARG . . . . . 0.514 ' HE ' HD12 ' B' ' 37' ' ' ILE 0.316 0.0 OUTLIER -19.89 -53.44 0.01 OUTLIER 'General case' 0 CA--C 1.585 2.327 0 CA-C-N 125.776 3.898 . . . . 0.0 116.39 171.022 . . . . . . . . 4 4 . 1 . 005 nuclear nobuild full ' B' B ' 23' ' ' ALA . . . . . 0.498 ' HB2' ' CB ' ' B' ' 33' ' ' GLU . . . -51.85 -80.63 0.01 OUTLIER 'General case' 0 CA--C 1.587 2.395 0 N-CA-C 118.978 2.955 . . . . 0.0 118.978 154.966 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 64.3 mm-40 -65.34 -35.28 80.5 Favored 'General case' 0 N--CA 1.501 2.099 0 N-CA-C 119.123 3.009 . . . . 0.0 119.123 -179.546 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 25' ' ' ALA . . . . . . . . . . . . . . . -39.25 -50.25 1.95 Allowed 'General case' 0 CA--C 1.588 2.43 0 N-CA-C 116.288 1.958 . . . . 0.0 116.288 153.38 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 26' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -95.65 -47.14 6.33 Favored 'General case' 0 CA--C 1.576 1.951 0 N-CA-C 116.592 2.071 . . . . 0.0 116.592 -174.059 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 27' ' ' GLY . . . . . . . . . . . . . . . 128.29 14.86 2.35 Favored Glycine 0 N--CA 1.498 2.822 0 N-CA-C 119.024 2.37 . . . . 0.0 119.024 -161.227 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 28' ' ' ARG . . . . . . . . . . . . . 79.0 mtm-85 -112.26 149.23 32.63 Favored 'General case' 0 N--CA 1.492 1.643 0 N-CA-C 104.779 -2.304 . . . . 0.0 104.779 168.766 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 29' ' ' SER . . . . . . . . . . . . . 92.3 p -117.93 109.58 16.68 Favored 'General case' 0 N--CA 1.503 2.185 0 O-C-N 118.053 -2.905 . . . . 0.0 105.786 -167.89 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 30' ' ' MET . . . . . . . . . . . . . 18.5 mtp -42.35 -42.73 3.27 Favored 'General case' 0 N--CA 1.499 1.985 0 N-CA-C 118.8 2.889 . . . . 0.0 118.8 -140.457 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 31' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -47.02 -42.63 18.53 Favored 'General case' 0 CA--C 1.592 2.586 0 CA-C-N 125.727 3.876 . . . . 0.0 115.556 165.444 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 32' ' ' SER . . . . . . . . . . . . 0.294 32.1 t -53.33 -67.8 0.23 Allowed 'General case' 0 N--CA 1.499 2.002 0 N-CA-C 119.048 2.981 . . . . 0.0 119.048 144.829 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 33' ' ' GLU . . . . . 0.498 ' CB ' ' HB2' ' B' ' 23' ' ' ALA . 0.1 OUTLIER -62.36 -59.85 4.4 Favored 'General case' 0 N--CA 1.513 2.687 0 CA-C-N 124.112 3.142 . . . . 0.0 117.066 -178.569 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 34' ' ' LEU . . . . . 0.809 HD12 ' CZ ' ' A' ' 7' ' ' PHE . 0.1 OUTLIER -34.74 -56.96 0.54 Allowed 'General case' 0 CA--C 1.547 0.832 0 CA-C-O 115.413 -2.232 . . . . 0.0 109.61 164.426 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 35' ' ' LEU . . . . . 0.412 ' HA ' HD23 ' B' ' 35' ' ' LEU . 10.1 mt -61.55 -49.28 77.31 Favored 'General case' 0 C--N 1.367 1.359 0 CA-C-N 123.145 2.702 . . . . 0.0 116.164 177.055 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 36' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -54.92 -52.88 61.58 Favored 'General case' 0 CA--C 1.574 1.901 0 CA-C-O 116.874 -1.536 . . . . 0.0 114.026 173.95 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 37' ' ' ILE . . . . . 0.514 HD12 ' HE ' ' B' ' 22' ' ' ARG . 4.3 tt -64.29 -30.71 50.88 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.861 0 CA-C-N 122.546 2.43 . . . . 0.0 115.957 168.821 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 38' ' ' VAL . . . . . 0.538 HG13 HD22 ' A' ' 19' ' ' LEU . 3.5 t -73.96 -46.75 45.19 Favored 'Isoleucine or valine' 0 CA--C 1.575 1.923 0 CA-C-N 121.441 1.928 . . . . 0.0 110.967 -179.71 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 31.2 mt-30 -52.08 -43.07 63.68 Favored 'General case' 0 CA--C 1.572 1.801 0 N-CA-C 114.13 1.159 . . . . 0.0 114.13 155.413 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 40' ' ' ASP . . . . . . . . . . . . 0.385 15.6 m-20 -53.53 -42.01 66.99 Favored 'General case' 0 N--CA 1.495 1.817 0 N-CA-C 116.782 2.141 . . . . 0.0 116.782 156.055 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 41' ' ' ALA . . . . . 0.505 ' HB3' ' HA ' ' B' ' 38' ' ' VAL . . . -70.34 -38.2 74.82 Favored 'General case' 0 CA--C 1.562 1.427 0 N-CA-C 115.27 1.581 . . . . 0.0 115.27 -171.609 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 42' ' ' LEU . . . . . 0.493 HD11 ' HB2' ' A' ' 19' ' ' LEU . 3.8 mt -85.52 -35.88 20.85 Favored 'General case' 0 CA--C 1.565 1.535 0 C-N-CA 125.635 1.574 . . . . 0.0 114.258 174.066 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 43' ' ' SER . . . . . . . . . . . . . 47.6 t -61.53 -61.76 2.3 Favored 'General case' 0 N--CA 1.497 1.875 0 N-CA-C 114.673 1.36 . . . . 0.0 114.673 164.742 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 44' ' ' LYS . . . . . . . . . . . . 0.533 6.8 mtmp? 96.8 -72.42 0.0 OUTLIER Pre-proline 0 CA--C 1.582 2.198 0 N-CA-C 116.327 1.973 . . . . 0.0 116.327 179.871 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 79.8 Cg_endo -88.75 139.46 3.92 Favored 'Trans proline' 0 CA--C 1.563 1.975 0 CA-C-N 125.253 2.912 . . . . 0.0 116.775 -163.538 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 46' ' ' SER . . . . . . . . . . . . . 26.5 t -85.25 147.78 48.28 Favored Pre-proline 0 CA--C 1.582 2.206 0 O-C-N 120.177 -1.577 . . . . 0.0 110.756 114.112 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 84.9 Cg_endo -73.98 71.07 4.32 Favored 'Trans proline' 0 CA--C 1.573 2.428 0 CA-C-N 123.844 2.409 . . . . 0.0 115.72 -179.325 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 48' ' ' VAL . . . . . . . . . . . . . 8.2 p -165.97 120.17 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.644 0 N-CA-C 108.162 -1.051 . . . . 0.0 108.162 -169.513 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 49' ' ' THR . . . . . . . . . . . . . 76.7 p -129.02 57.13 1.65 Allowed 'General case' 0 N--CA 1.505 2.281 0 CA-C-O 122.22 1.009 . . . . 0.0 113.164 -179.207 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 50' ' ' GLY . . . . . . . . . . . . . . . -99.53 36.33 4.14 Favored Glycine 0 N--CA 1.497 2.764 0 N-CA-C 117.723 1.849 . . . . 0.0 117.723 173.144 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 51' ' ' TYR . . . . . . . . . . . . 0.25 0.0 OUTLIER -135.85 13.95 3.38 Favored 'General case' 0 CA--C 1.584 2.286 0 N-CA-C 115.884 1.809 . . . . 0.0 115.884 -172.907 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 52' ' ' ARG . . . . . . . . . . . . 0.779 11.6 mpt_? 102.22 -23.06 0.02 OUTLIER 'General case' 0 CA--C 1.621 3.689 1 N-CA-C 128.49 6.478 . . . . 0.0 128.49 169.76 . . . . . . . . 3 2 . 1 . 005 nuclear nobuild full ' B' B ' 53' ' ' ASN . . . . . 0.686 ' C ' ' HB3' ' B' ' 55' ' ' ALA 0.596 0.0 OUTLIER -176.23 -161.1 0.07 Allowed 'General case' 0 N--CA 1.503 2.213 2 O-C-N 106.107 -10.371 . . . . 0.0 121.428 -12.276 . . . . . . . . 5 4 . 1 . 005 nuclear nobuild full ' B' B ' 54' ' ' ASP . . . . . 0.471 ' HA ' ' HB2' ' B' ' 57' ' ' ARG 0.585 0.0 OUTLIER -64.9 -4.86 4.95 Favored 'General case' 0 N--CA 1.506 2.339 1 CA-C-N 126.205 4.093 . . . . 0.0 117.386 175.22 . . . . . . . . 5 4 . 1 . 005 nuclear nobuild full ' B' B ' 55' ' ' ALA . . . . . 0.686 ' HB3' ' C ' ' B' ' 53' ' ' ASN 0.347 . . -0.59 -131.0 0.0 OUTLIER 'General case' 0 CA--C 1.566 1.582 1 N-CA-C 124.543 5.016 . . . . 0.0 124.543 108.752 . . . . . . . . 4 3 . 1 . 005 nuclear nobuild full ' B' B ' 56' ' ' GLU . . . . . 0.596 ' O ' ' HB3' ' B' ' 59' ' ' ALA 0.299 6.6 tp10 -38.79 -25.69 0.01 OUTLIER 'General case' 0 CA--C 1.583 2.247 0 N-CA-C 119.582 3.179 . . . . 0.0 119.582 155.641 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 57' ' ' ARG . . . . . 0.471 ' HB2' ' HA ' ' B' ' 54' ' ' ASP . 0.2 OUTLIER -94.46 -31.62 13.88 Favored 'General case' 0 CA--C 1.564 1.481 0 O-C-N 119.047 -2.283 . . . . 0.0 110.165 -176.788 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 58' ' ' LEU . . . . . 0.425 ' HA ' ' H ' ' B' ' 61' ' ' GLU 0.626 89.5 mt -89.09 0.37 56.76 Favored 'General case' 0 CA--C 1.592 2.594 0 O-C-N 118.051 -2.905 . . . . 0.0 115.751 157.496 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 59' ' ' ALA . . . . . 0.596 ' HB3' ' O ' ' B' ' 56' ' ' GLU . . . -56.17 -39.02 71.7 Favored 'General case' 0 N--CA 1.485 1.295 0 O-C-N 117.422 -3.299 . . . . 0.0 117.762 133.003 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 60' ' ' ASP . . . . . 0.461 ' HA ' ' HB2' ' B' ' 63' ' ' SER . 11.8 t70 -56.57 -27.8 58.72 Favored 'General case' 0 N--CA 1.508 2.472 0 CA-C-N 123.532 2.878 . . . . 0.0 117.22 158.389 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 61' ' ' GLU . . . . . 0.489 ' OE1' HD21 ' B' ' 65' ' ' LEU 0.42 0.5 OUTLIER -53.8 -65.62 0.54 Allowed 'General case' 0 N--CA 1.494 1.737 0 CA-C-O 116.305 -1.807 . . . . 0.0 111.251 154.782 . . . . . . . . 4 4 . 1 . 005 nuclear nobuild full ' B' B ' 62' ' ' GLN . . . . . 0.427 HE21 HG23 ' B' ' 66' ' ' VAL . 4.6 tp60 -60.22 -55.59 31.94 Favored 'General case' 0 CA--C 1.57 1.726 0 CA-C-N 122.798 2.545 . . . . 0.0 112.906 -174.662 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 63' ' ' SER . . . . . 0.49 ' HA ' ' CG1' ' B' ' 66' ' ' VAL . 23.8 m -9.69 -64.51 0.0 OUTLIER 'General case' 0 N--CA 1.506 2.354 1 N-CA-C 124.262 4.912 . . . . 0.0 124.262 150.829 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 64' ' ' GLU . . . . . 0.47 ' HB3' ' HD3' ' A' ' 28' ' ' ARG 0.399 66.8 mt-10 -93.85 8.44 41.17 Favored 'General case' 0 CA--C 1.591 2.548 0 CA-C-N 115.625 -0.716 . . . . 0.0 111.62 -179.883 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 65' ' ' LEU . . . . . 0.489 HD21 ' OE1' ' B' ' 61' ' ' GLU . 0.0 OUTLIER -105.69 22.37 15.66 Favored 'General case' 0 CA--C 1.61 3.287 0 C-N-CA 127.398 2.279 . . . . 0.0 112.634 144.53 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 66' ' ' VAL . . . . . 0.49 ' CG1' ' HA ' ' B' ' 63' ' ' SER . 1.0 OUTLIER . . . . . 0 N--CA 1.507 2.384 0 C-N-CA 127.743 2.417 . . . . 0.0 108.033 -171.336 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.564 1.505 0 N-CA-C 114.031 1.122 . . . . 0.0 114.031 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 1.1 mpm_? -84.51 69.38 10.56 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 120.614 -1.304 . . . . 0.0 114.074 -168.627 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 9.1 p-10 -148.38 63.09 1.09 Allowed 'General case' 0 N--CA 1.491 1.589 0 O-C-N 120.944 -1.097 . . . . 0.0 109.495 -178.597 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 6.7 p-10 -144.89 81.18 10.9 Favored Pre-proline 0 CA--C 1.567 1.601 0 O-C-N 121.078 -1.014 . . . . 0.0 111.155 176.078 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 5.5 Cg_exo -100.19 146.1 0.39 Allowed 'Trans proline' 0 C--N 1.366 1.476 0 C-N-CA 122.065 1.844 . . . . 0.0 112.618 -160.58 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 66.1 m80 -68.31 146.79 52.96 Favored 'General case' 0 N--CA 1.485 1.294 0 N-CA-C 114.415 1.265 . . . . 0.0 114.415 -179.971 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . 0.846 ' CZ ' HD12 ' B' ' 34' ' ' LEU . 20.2 p90 -138.62 160.12 40.4 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 120.918 -1.114 . . . . 0.0 112.336 135.275 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 21.1 m120 -55.22 100.81 0.04 OUTLIER 'General case' 0 CA--C 1.572 1.808 0 N-CA-C 114.869 1.433 . . . . 0.0 114.869 174.168 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . 0.643 ' CD2' HD13 ' B' ' 34' ' ' LEU . 10.1 t80 -130.97 103.78 6.74 Favored 'General case' 0 C--N 1.34 0.179 0 N-CA-C 106.685 -1.598 . . . . 0.0 106.685 165.479 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . 0.495 0.0 OUTLIER 88.42 68.66 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.691 1 O-C-N 114.367 -5.208 . . . . 0.0 112.533 -9.774 . . . . . . . . 4 3 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . 0.611 ' SD ' HD23 ' A' ' 19' ' ' LEU . 8.4 ptp -144.02 116.77 5.71 Favored Pre-proline 0 CA--C 1.571 1.779 0 CA-C-O 115.114 -2.374 . . . . 0.0 109.27 -164.545 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 63.3 Cg_exo -34.69 143.94 0.06 OUTLIER 'Trans proline' 0 C--N 1.379 2.176 0 C-N-CA 124.667 3.578 . . . . 0.0 119.631 -172.564 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . 0.408 ' SD ' ' HG3' ' A' ' 17' ' ' GLU . 4.4 tpp -44.35 -41.59 6.2 Favored 'General case' 0 CA--C 1.581 2.141 0 N-CA-C 116.598 2.073 . . . . 0.0 116.598 -161.042 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -63.43 -44.29 95.01 Favored 'General case' 0 CA--C 1.571 1.788 0 N-CA-C 117.379 2.363 . . . . 0.0 117.379 167.979 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 1.6 t -54.56 -45.15 71.21 Favored 'Isoleucine or valine' 0 N--CA 1.513 2.705 0 CA-C-N 122.935 2.607 . . . . 0.0 113.301 169.63 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 7.1 ttt180 -74.87 -43.25 55.43 Favored 'General case' 0 C--O 1.212 -0.918 0 CA-C-O 116.107 -1.902 . . . . 0.0 115.093 174.908 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.408 ' HG3' ' SD ' ' A' ' 13' ' ' MET . 47.9 mt-10 -58.26 -32.1 68.05 Favored 'General case' 0 N--CA 1.493 1.681 0 CA-C-N 124.126 3.148 . . . . 0.0 115.266 163.296 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . 0.292 54.1 mtmt -67.82 -54.0 22.52 Favored 'General case' 0 CA--C 1.564 1.516 0 CA-C-N 121.112 1.778 . . . . 0.0 114.737 166.182 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.663 HD21 ' HG ' ' A' ' 34' ' ' LEU 0.288 14.9 tp -67.08 -33.84 76.37 Favored 'General case' 0 CA--C 1.574 1.874 0 N-CA-C 115.254 1.576 . . . . 0.0 115.254 175.632 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.496 ' HB2' ' SD ' ' A' ' 30' ' ' MET . 15.0 ttpt -91.71 -28.58 17.34 Favored 'General case' 0 CA--C 1.555 1.162 0 C-N-CA 126.788 2.035 . . . . 0.0 114.143 -178.671 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 22.1 m-30 -63.18 -71.21 0.17 Allowed 'General case' 0 N--CA 1.49 1.526 0 CA-C-O 113.265 -3.255 . . . . 0.0 109.383 153.841 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . 0.304 0.0 OUTLIER -25.09 -53.35 0.04 OUTLIER 'General case' 0 CA--C 1.587 2.399 0 CA-C-N 125.71 3.868 . . . . 0.0 116.158 171.393 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.524 ' HB2' ' HB3' ' A' ' 33' ' ' GLU . . . -50.61 -79.22 0.02 OUTLIER 'General case' 0 CA--C 1.585 2.296 0 N-CA-C 119.806 3.261 . . . . 0.0 119.806 154.557 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 75.2 mm-40 -69.67 -33.86 73.17 Favored 'General case' 0 N--CA 1.499 2.007 0 N-CA-C 118.809 2.892 . . . . 0.0 118.809 -177.251 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -40.72 -48.73 3.02 Favored 'General case' 0 CA--C 1.584 2.257 0 N-CA-C 116.307 1.965 . . . . 0.0 116.307 152.72 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . 0.254 0.0 OUTLIER -98.51 -40.04 8.44 Favored 'General case' 0 CA--C 1.577 1.988 0 N-CA-C 117.416 2.376 . . . . 0.0 117.416 -172.097 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 137.83 6.22 1.55 Allowed Glycine 0 N--CA 1.5 2.919 0 N-CA-C 120.368 2.907 . . . . 0.0 120.368 -168.595 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.464 HH12 HG11 ' B' ' 66' ' ' VAL . 32.4 mtm-85 -116.83 165.78 12.91 Favored 'General case' 0 N--CA 1.492 1.653 0 CA-C-N 120.989 2.394 . . . . 0.0 108.17 173.885 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 8.6 t -123.76 116.78 23.57 Favored 'General case' 0 N--CA 1.496 1.841 0 N-CA-C 105.206 -2.146 . . . . 0.0 105.206 -177.952 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' MET . . . . . 0.496 ' SD ' ' HB2' ' A' ' 20' ' ' LYS . 13.2 mtp -43.38 -42.57 4.7 Favored 'General case' 0 N--CA 1.497 1.908 0 N-CA-C 119.101 3.0 . . . . 0.0 119.101 -143.886 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . 0.258 0.1 OUTLIER -48.09 -41.97 27.65 Favored 'General case' 0 CA--C 1.592 2.594 0 CA-C-N 125.255 3.661 . . . . 0.0 114.957 166.522 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . 0.333 34.8 t -52.6 -64.04 0.95 Allowed 'General case' 0 N--CA 1.499 2.005 0 N-CA-C 120.507 3.521 . . . . 0.0 120.507 145.569 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . 0.524 ' HB3' ' HB2' ' A' ' 23' ' ' ALA . 2.8 tp10 -72.48 -53.24 12.66 Favored 'General case' 0 N--CA 1.512 2.639 0 CA-C-N 123.461 2.846 . . . . 0.0 117.852 -177.523 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.663 ' HG ' HD21 ' A' ' 19' ' ' LEU . 0.2 OUTLIER -38.47 -54.18 1.5 Allowed 'General case' 0 CA--C 1.554 1.133 0 CA-C-O 115.773 -2.06 . . . . 0.0 109.429 162.097 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.518 HD21 ' HG2' ' B' ' 11' ' ' MET . 15.1 mt -63.38 -54.96 28.66 Favored 'General case' 0 C--N 1.37 1.481 0 CA-C-N 123.51 2.868 . . . . 0.0 114.935 176.398 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -52.4 -44.32 65.29 Favored 'General case' 0 CA--C 1.564 1.512 0 CA-C-O 116.818 -1.563 . . . . 0.0 115.04 175.868 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -68.58 -41.08 82.71 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.533 0 CA-C-N 121.946 2.157 . . . . 0.0 114.532 169.928 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.407 HG21 HD22 ' A' ' 34' ' ' LEU . 3.8 t -71.76 -46.24 62.37 Favored 'Isoleucine or valine' 0 CA--C 1.583 2.218 0 CA-C-N 121.393 1.906 . . . . 0.0 111.241 -178.108 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 26.5 mt-30 -51.8 -43.05 62.92 Favored 'General case' 0 N--CA 1.488 1.465 0 C-N-CA 124.65 1.18 . . . . 0.0 114.134 156.261 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . 0.629 ' O ' HD23 ' B' ' 58' ' ' LEU 0.459 24.2 m-20 -46.5 -56.47 5.93 Favored 'General case' 0 N--CA 1.488 1.461 0 N-CA-C 114.225 1.195 . . . . 0.0 114.225 155.622 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . 0.362 . . -83.35 -39.71 20.38 Favored 'General case' 0 CA--C 1.543 0.704 0 N-CA-C 118.526 2.787 . . . . 0.0 118.526 -154.634 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.487 HD13 ' HB3' ' B' ' 18' ' ' LYS . 1.4 pp -102.08 -0.8 32.88 Favored 'General case' 0 CA--C 1.563 1.457 0 N-CA-C 117.841 2.534 . . . . 0.0 117.841 159.706 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 26.8 t -126.39 -7.15 6.39 Favored 'General case' 0 N--CA 1.496 1.842 0 CA-C-N 123.521 2.873 . . . . 0.0 118.697 178.873 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . 0.334 4.2 tmmm? -93.01 -53.04 0.26 Allowed Pre-proline 0 N--CA 1.506 2.359 0 CA-C-N 123.833 3.015 . . . . 0.0 118.91 -168.346 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -89.42 147.86 5.23 Favored 'Trans proline' 0 CA--C 1.567 2.139 0 CA-C-N 124.894 2.783 . . . . 0.0 118.99 -157.613 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 86.8 p -74.83 128.89 84.5 Favored Pre-proline 0 N--CA 1.5 2.029 0 O-C-N 117.407 -3.308 . . . . 0.0 115.306 48.707 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 84.8 Cg_endo -76.61 -72.6 0.01 OUTLIER 'Trans proline' 0 CA--C 1.555 1.573 0 CA-C-N 122.943 2.087 . . . . 0.0 115.02 -167.976 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 6.8 p -161.48 -68.26 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.496 1.867 0 CA-C-N 110.017 -3.265 . . . . 0.0 108.016 166.829 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 11.2 t -80.04 26.04 0.36 Allowed 'General case' 0 CA--C 1.567 1.631 0 N-CA-C 119.204 3.039 . . . . 0.0 119.204 -179.63 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 67.8 -49.51 0.34 Allowed Glycine 0 CA--C 1.562 2.997 0 N-CA-C 118.782 2.273 . . . . 0.0 118.782 -167.802 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . 0.549 7.9 m-85 78.25 -35.17 0.19 Allowed 'General case' 0 N--CA 1.496 1.842 0 N-CA-C 120.954 3.687 . . . . 0.0 120.954 -177.715 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . 0.403 39.1 ttt180 112.3 -58.5 0.0 OUTLIER 'General case' 0 N--CA 1.508 2.458 0 C-N-CA 127.251 2.22 . . . . 0.0 116.515 -169.248 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . 0.446 ' H ' ' HB2' ' A' ' 56' ' ' GLU 0.399 58.3 m-80 -87.81 -59.02 2.36 Favored 'General case' 0 CA--C 1.564 1.513 2 O-C-N 112.497 -6.377 . . . . 0.0 118.191 22.555 . . . . . . . . 4 3 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . 0.671 ' HB2' ' H ' ' B' ' 54' ' ' ASP . 21.2 m-20 -92.67 60.36 3.46 Favored 'General case' 0 CA--C 1.556 1.188 2 O-C-N 109.575 -8.203 . . . . 0.0 114.693 6.067 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . 0.806 ' HA ' ' H ' ' A' ' 58' ' ' LEU 0.431 . . -74.68 -2.85 28.07 Favored 'General case' 0 CA--C 1.589 2.461 0 O-C-N 116.398 -3.939 . . . . 0.0 119.999 125.061 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.738 ' O ' ' HB3' ' A' ' 59' ' ' ALA . 1.8 tm-20 -53.05 -26.78 17.02 Favored 'General case' 0 CA--C 1.591 2.545 0 O-C-N 118.158 -2.839 . . . . 0.0 116.546 129.969 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.546 ' HB2' ' HB3' ' A' ' 54' ' ' ASP 0.383 4.8 mpt_? -79.38 -13.31 59.7 Favored 'General case' 0 CA--C 1.572 1.792 0 O-C-N 116.595 -3.815 . . . . 0.0 114.873 158.303 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.806 ' H ' ' HA ' ' A' ' 55' ' ' ALA 0.34 3.4 mp -75.06 3.1 9.08 Favored 'General case' 0 CA--C 1.609 3.223 0 O-C-N 116.536 -3.853 . . . . 0.0 115.51 144.401 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . 0.738 ' HB3' ' O ' ' A' ' 56' ' ' GLU . . . -71.49 -12.95 61.65 Favored 'General case' 0 N--CA 1.507 2.392 1 O-C-N 115.954 -4.216 . . . . 0.0 119.854 135.454 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.485 ' HB3' ' O ' ' A' ' 57' ' ' ARG . 9.2 t70 -65.59 -26.14 67.71 Favored 'General case' 0 N--CA 1.524 3.228 0 O-C-N 118.231 -2.793 . . . . 0.0 118.513 138.111 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.597 ' H ' ' HA ' ' A' ' 58' ' ' LEU 0.606 42.3 mm-40 -58.73 -21.97 56.48 Favored 'General case' 0 CA--C 1.569 1.705 0 C-N-CA 116.889 -1.924 . . . . 0.0 113.998 150.119 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . 0.438 ' O ' HG13 ' A' ' 66' ' ' VAL 0.356 0.0 OUTLIER -68.35 -36.24 78.94 Favored 'General case' 0 N--CA 1.491 1.604 0 CA-C-N 123.667 2.939 . . . . 0.0 114.62 151.308 . . . . . . . . 4 4 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . . 75.6 m -42.65 -54.06 4.18 Favored 'General case' 0 N--CA 1.532 3.671 1 CA-C-N 127.336 4.607 . . . . 0.0 117.465 168.677 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . 0.475 0.4 OUTLIER -31.95 -102.78 0.0 OUTLIER 'General case' 0 CA--C 1.587 2.388 0 N-CA-C 117.267 2.321 . . . . 0.0 117.267 133.969 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . 0.251 0.7 OUTLIER -76.71 49.39 0.62 Allowed 'General case' 0 CA--C 1.588 2.437 0 CA-C-N 124.153 3.16 . . . . 0.0 118.852 -174.021 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.438 HG13 ' O ' ' A' ' 62' ' ' GLN . 0.9 OUTLIER . . . . . 0 N--CA 1.5 2.029 0 C-N-CA 125.589 1.556 . . . . 0.0 107.636 173.347 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.557 1.224 0 N-CA-C 113.674 0.99 . . . . 0.0 113.674 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 2' ' ' ARG . . . . . . . . . . . . . 88.5 mtt180 -94.94 81.73 3.76 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.566 -0.709 . . . . 0.0 110.6 169.7 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . 0.292 5.2 p-10 -168.72 -39.96 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.611 0 N-CA-C 114.982 1.475 . . . . 0.0 114.982 178.162 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 4' ' ' ASP . . . . . . . . . . . . . 23.4 m-20 -109.14 113.87 58.53 Favored Pre-proline 0 CA--C 1.582 2.192 0 N-CA-C 115.684 1.735 . . . . 0.0 115.684 178.744 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 5' ' ' PRO . . . . . . . . . . . . 0.619 7.6 Cg_exo 52.93 -84.55 0.0 OUTLIER 'Trans proline' 0 N--CA 1.492 1.407 1 N-CA-C 126.262 5.447 . . . . 0.0 126.262 89.797 . . . . . . . . 3 2 . 1 . 006 nuclear nobuild full ' B' B ' 6' ' ' HIS . . . . . . . . . . . . . 64.9 m80 -75.17 111.73 10.71 Favored 'General case' 0 CA--C 1.564 1.503 0 N-CA-C 115.508 1.67 . . . . 0.0 115.508 -149.396 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 7' ' ' PHE . . . . . 0.607 ' CZ ' HD12 ' A' ' 34' ' ' LEU 0.292 30.7 p90 -122.09 -166.22 1.37 Allowed 'General case' 0 CA--C 1.563 1.462 0 O-C-N 120.35 -1.469 . . . . 0.0 108.919 128.772 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 8' ' ' ASN . . . . . . . . . . . . . 34.6 m-20 -116.09 105.65 12.85 Favored 'General case' 0 CA--C 1.555 1.166 0 O-C-N 120.102 -1.624 . . . . 0.0 107.37 166.598 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 9' ' ' PHE . . . . . 0.632 ' CE2' HD22 ' A' ' 34' ' ' LEU 0.25 5.0 t80 -71.75 92.72 1.22 Allowed 'General case' 0 CA--C 1.576 1.977 0 CA-C-O 126.676 3.131 . . . . 0.0 113.256 176.126 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 10' ' ' ARG . . . . . . . . . . . . . 28.5 ptt85 -81.9 130.14 34.98 Favored 'General case' 0 N--CA 1.48 1.05 1 CA-C-N 108.291 -4.05 . . . . 0.0 111.256 168.498 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 11' ' ' MET . . . . . 0.551 ' HE2' ' CD2' ' B' ' 9' ' ' PHE . 28.3 mtm -136.44 121.91 13.31 Favored Pre-proline 0 CA--C 1.565 1.527 0 CA-C-O 117.509 -1.234 . . . . 0.0 111.7 -163.703 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 12' ' ' PRO . . . . . . . . . . . . . 80.3 Cg_exo -43.66 145.03 1.95 Allowed 'Trans proline' 0 C--N 1.378 2.123 0 C-N-CA 123.913 3.076 . . . . 0.0 116.02 169.23 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 13' ' ' MET . . . . . . . . . . . . . 15.7 tpp -60.8 -34.06 73.93 Favored 'General case' 0 N--CA 1.492 1.655 0 N-CA-C 117.083 2.253 . . . . 0.0 117.083 -150.559 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -59.7 -49.31 78.23 Favored 'General case' 0 CA--C 1.573 1.861 0 N-CA-C 117.688 2.477 . . . . 0.0 117.688 161.335 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -58.28 -48.06 85.91 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.453 0 CA-C-N 123.369 2.804 . . . . 0.0 113.331 174.253 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 4.2 ttt180 -71.21 -37.23 72.08 Favored 'General case' 0 C--O 1.216 -0.703 0 CA-C-O 115.951 -1.976 . . . . 0.0 115.519 173.024 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 17' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -60.6 -35.81 77.02 Favored 'General case' 0 CA--C 1.569 1.709 0 CA-C-N 124.119 3.145 . . . . 0.0 114.185 161.578 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 18' ' ' LYS . . . . . 0.487 ' HB3' HD13 ' A' ' 42' ' ' LEU 0.291 44.1 mtmt -67.79 -48.71 65.54 Favored 'General case' 0 CA--C 1.566 1.574 0 CA-C-N 121.443 1.929 . . . . 0.0 115.483 169.55 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 19' ' ' LEU . . . . . 0.451 ' HB3' ' CE ' ' B' ' 30' ' ' MET 0.278 0.4 OUTLIER -70.49 -36.29 73.73 Favored 'General case' 0 CA--C 1.574 1.891 0 CA-C-N 120.904 1.684 . . . . 0.0 115.06 173.604 . . . . . . . . 4 4 . 1 . 006 nuclear nobuild full ' B' B ' 20' ' ' LYS . . . . . 0.439 ' HB2' ' SD ' ' B' ' 30' ' ' MET . 15.8 ttpt -88.34 -27.89 21.35 Favored 'General case' 0 CA--C 1.555 1.168 0 C-N-CA 125.822 1.649 . . . . 0.0 113.682 178.729 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 22.1 m-30 -64.09 -72.89 0.13 Allowed 'General case' 0 N--CA 1.49 1.545 1 CA-C-O 111.469 -4.11 . . . . 0.0 109.598 156.052 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . 0.253 12.0 tpp180 -13.19 -61.04 0.01 OUTLIER 'General case' 0 CA--C 1.592 2.558 1 CA-C-N 127.07 4.487 . . . . 0.0 116.34 164.519 . . . . . . . . 3 2 . 1 . 006 nuclear nobuild full ' B' B ' 23' ' ' ALA . . . . . 0.426 ' HB2' ' CB ' ' B' ' 33' ' ' GLU . . . -54.96 -75.86 0.03 OUTLIER 'General case' 0 CA--C 1.59 2.486 0 N-CA-C 119.29 3.07 . . . . 0.0 119.29 160.561 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 52.6 mt-10 -68.46 -34.77 76.54 Favored 'General case' 0 N--CA 1.504 2.263 0 N-CA-C 118.819 2.896 . . . . 0.0 118.819 -179.345 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 25' ' ' ALA . . . . . . . . . . . . . . . -38.31 -46.87 1.15 Allowed 'General case' 0 CA--C 1.579 2.062 0 N-CA-C 115.973 1.842 . . . . 0.0 115.973 152.321 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 26' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -98.66 -51.21 3.99 Favored 'General case' 0 CA--C 1.577 1.984 0 N-CA-C 117.458 2.392 . . . . 0.0 117.458 -173.651 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 27' ' ' GLY . . . . . . . . . . . . . . . 117.69 23.47 3.68 Favored Glycine 0 CA--C 1.563 3.082 0 N-CA-C 119.575 2.59 . . . . 0.0 119.575 -151.251 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 28' ' ' ARG . . . . . 0.517 HH21 ' HG3' ' B' ' 36' ' ' GLN . 16.8 mtt85 -112.47 147.44 36.52 Favored 'General case' 0 CA--C 1.572 1.821 0 N-CA-C 103.769 -2.678 . . . . 0.0 103.769 158.984 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 29' ' ' SER . . . . . . . . . . . . . 35.6 t -113.42 112.18 23.2 Favored 'General case' 0 N--CA 1.505 2.302 0 O-C-N 117.793 -3.067 . . . . 0.0 105.67 -172.884 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 30' ' ' MET . . . . . 0.451 ' CE ' ' HB3' ' B' ' 19' ' ' LEU . 22.7 mtp -40.65 -45.61 2.4 Favored 'General case' 0 N--CA 1.5 2.038 0 N-CA-C 118.822 2.897 . . . . 0.0 118.822 -144.364 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 31' ' ' ASN . . . . . . . . . . . . . 20.0 t-20 -44.44 -44.03 8.18 Favored 'General case' 0 CA--C 1.594 2.673 0 CA-C-N 125.494 3.77 . . . . 0.0 115.576 165.045 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 32' ' ' SER . . . . . . . . . . . . 0.279 56.3 m -57.36 -60.42 3.67 Favored 'General case' 0 N--CA 1.5 2.034 0 N-CA-C 120.7 3.593 . . . . 0.0 120.7 148.464 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 33' ' ' GLU . . . . . 0.426 ' CB ' ' HB2' ' B' ' 23' ' ' ALA . 0.1 OUTLIER -67.49 -61.64 1.8 Allowed 'General case' 0 N--CA 1.51 2.542 0 CA-C-N 123.666 2.939 . . . . 0.0 115.293 177.667 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 34' ' ' LEU . . . . . 0.846 HD12 ' CZ ' ' A' ' 7' ' ' PHE . 0.0 OUTLIER -32.17 -53.78 0.3 Allowed 'General case' 0 N--CA 1.481 1.091 0 CA-C-O 115.289 -2.291 . . . . 0.0 109.266 163.967 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 35' ' ' LEU . . . . . 0.59 HD21 ' HB2' ' A' ' 11' ' ' MET . 11.8 mt -62.28 -54.42 41.01 Favored 'General case' 0 C--N 1.368 1.382 0 CA-C-N 123.528 2.876 . . . . 0.0 115.053 176.275 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 36' ' ' GLN . . . . . 0.517 ' HG3' HH21 ' B' ' 28' ' ' ARG . 0.9 OUTLIER -59.86 -39.46 85.29 Favored 'General case' 0 CA--C 1.569 1.679 0 CA-C-O 116.302 -1.809 . . . . 0.0 115.582 175.479 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 37' ' ' ILE . . . . . 0.454 ' HA ' ' HB3' ' B' ' 40' ' ' ASP . 10.4 tt -68.55 -26.3 33.02 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.622 0 CA-C-N 123.452 2.842 . . . . 0.0 115.253 162.668 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 38' ' ' VAL . . . . . 0.507 ' CG1' HD22 ' A' ' 19' ' ' LEU . 4.3 t -86.68 -47.05 16.36 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.094 0 CA-C-N 125.037 3.562 . . . . 0.0 112.77 -178.891 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 27.8 mt-30 -46.07 -49.37 16.5 Favored 'General case' 0 N--CA 1.484 1.269 0 CA-C-O 116.119 -1.896 . . . . 0.0 113.068 150.961 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 40' ' ' ASP . . . . . 0.454 ' HB3' ' HA ' ' B' ' 37' ' ' ILE 0.374 50.1 t0 -44.01 -61.3 1.5 Allowed 'General case' 0 N--CA 1.494 1.76 0 CA-C-N 120.892 1.678 . . . . 0.0 114.638 154.533 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -82.62 19.21 1.33 Allowed 'General case' 0 CA--C 1.55 0.98 0 N-CA-C 120.556 3.539 . . . . 0.0 120.556 -162.39 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -147.78 -9.54 0.41 Allowed 'General case' 0 N--CA 1.484 1.232 0 N-CA-C 116.358 1.985 . . . . 0.0 116.358 143.772 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 43' ' ' SER . . . . . . . . . . . . . 86.7 p -149.56 10.62 0.75 Allowed 'General case' 0 N--CA 1.486 1.37 0 N-CA-C 118.144 2.646 . . . . 0.0 118.144 -163.071 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 44' ' ' LYS . . . . . . . . . . . . 0.313 7.6 tmtt? -32.36 -61.49 0.32 Allowed Pre-proline 0 N--CA 1.523 3.18 1 N-CA-C 125.042 5.201 . . . . 0.0 125.042 -159.05 . . . . . . . . 3 2 . 1 . 006 nuclear nobuild full ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 12.4 Cg_endo -66.49 101.21 0.52 Allowed 'Trans proline' 0 CA--C 1.567 2.145 0 N-CA-C 120.709 3.311 . . . . 0.0 120.709 -136.881 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 46' ' ' SER . . . . . . . . . . . . . 69.7 m -69.2 140.52 90.7 Favored Pre-proline 0 CA--C 1.585 2.323 0 O-C-N 120.602 -1.311 . . . . 0.0 112.187 120.504 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -75.0 90.6 1.07 Allowed 'Trans proline' 0 CA--C 1.569 2.255 0 C-N-CA 122.545 2.163 . . . . 0.0 116.267 -166.491 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 48' ' ' VAL . . . . . . . . . . . . . 34.8 m -133.93 17.84 1.31 Allowed 'Isoleucine or valine' 0 N--CA 1.502 2.127 0 N-CA-C 118.4 2.741 . . . . 0.0 118.4 -178.246 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 49' ' ' THR . . . . . . . . . . . . . 61.2 p -145.3 96.9 2.91 Favored 'General case' 0 N--CA 1.496 1.858 2 O-C-N 109.269 -8.394 . . . . 0.0 109.846 11.844 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 50' ' ' GLY . . . . . . . . . . . . . . . -170.14 -93.0 0.09 OUTLIER Glycine 0 N--CA 1.488 2.151 0 CA-C-O 119.534 -0.592 . . . . 0.0 112.286 176.957 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 51' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -156.69 38.11 0.32 Allowed 'General case' 0 CA--C 1.586 2.329 2 O-C-N 115.237 -4.684 . . . . 0.0 113.498 -12.895 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 52' ' ' ARG . . . . . . . . . . . . . 33.1 ptt85 -84.8 141.54 30.42 Favored 'General case' 0 N--CA 1.505 2.28 0 O-C-N 119.72 -1.862 . . . . 0.0 115.081 -177.561 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 53' ' ' ASN . . . . . 0.551 ' ND2' ' H ' ' B' ' 56' ' ' GLU 0.77 0.0 OUTLIER -56.54 128.29 35.44 Favored 'General case' 0 N--CA 1.496 1.871 0 CA-C-N 122.211 2.278 . . . . 0.0 114.828 172.324 . . . . . . . . 4 4 . 1 . 006 nuclear nobuild full ' B' B ' 54' ' ' ASP . . . . . 0.671 ' H ' ' HB2' ' A' ' 54' ' ' ASP 0.341 3.4 m-20 -101.11 48.03 0.9 Allowed 'General case' 0 CA--C 1.583 2.226 0 CA-C-O 126.984 3.278 . . . . 0.0 110.718 135.95 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 55' ' ' ALA . . . . . 0.897 ' HB1' HD22 ' B' ' 58' ' ' LEU 0.331 . . -87.01 -9.03 56.54 Favored 'General case' 0 CA--C 1.555 1.166 1 O-C-N 116.212 -4.055 . . . . 0.0 117.822 136.302 . . . . . . . . 4 3 . 1 . 006 nuclear nobuild full ' B' B ' 56' ' ' GLU . . . . . 0.551 ' H ' ' ND2' ' B' ' 53' ' ' ASN . 6.8 mm-40 -37.64 -14.65 0.0 OUTLIER 'General case' 0 CA--C 1.584 2.264 1 N-CA-C 124.572 5.027 . . . . 0.0 124.572 113.901 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 57' ' ' ARG . . . . . 0.631 ' H ' ' C ' ' B' ' 54' ' ' ASP . 0.1 OUTLIER -90.59 -44.17 9.72 Favored 'General case' 0 CA--C 1.565 1.536 0 O-C-N 119.297 -2.127 . . . . 0.0 114.798 155.618 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 58' ' ' LEU . . . . . 0.897 HD22 ' HB1' ' B' ' 55' ' ' ALA . 0.8 OUTLIER -42.2 -62.7 0.88 Allowed 'General case' 0 N--CA 1.527 3.394 0 CA-C-N 122.024 2.193 . . . . 0.0 115.708 164.984 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 59' ' ' ALA . . . . . 0.452 ' CB ' ' HA ' ' B' ' 56' ' ' GLU 0.374 . . -5.09 -76.92 0.0 OUTLIER 'General case' 0 CA--C 1.547 0.862 1 N-CA-C 124.717 5.08 . . . . 0.0 124.717 131.946 . . . . . . . . 4 3 . 1 . 006 nuclear nobuild full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 6.0 t0 -60.32 -9.32 3.34 Favored 'General case' 0 CA--C 1.573 1.844 0 CA-C-N 124.744 3.429 . . . . 0.0 116.854 170.741 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 61.4 tt0 -70.75 -45.74 64.24 Favored 'General case' 0 N--CA 1.499 2.014 0 CA-C-N 122.984 2.629 . . . . 0.0 113.609 155.926 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 62' ' ' GLN . . . . . 0.661 ' O ' HG13 ' B' ' 66' ' ' VAL 0.289 0.3 OUTLIER -75.18 -66.17 0.79 Allowed 'General case' 0 N--CA 1.492 1.647 0 CA-C-N 122.316 2.325 . . . . 0.0 111.953 170.904 . . . . . . . . 4 4 . 1 . 006 nuclear nobuild full ' B' B ' 63' ' ' SER . . . . . . . . . . . . 0.374 46.7 p -54.17 -5.02 0.06 Allowed 'General case' 0 CA--C 1.578 2.056 1 N-CA-C 122.081 4.104 . . . . 0.0 122.081 168.944 . . . . . . . . 3 2 . 1 . 006 nuclear nobuild full ' B' B ' 64' ' ' GLU . . . . . . . . . . . . . 21.7 tt0 -95.16 -40.4 9.62 Favored 'General case' 0 N--CA 1.496 1.855 0 CA-C-N 124.409 3.277 . . . . 0.0 113.831 144.269 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 3.0 mp -105.88 46.22 0.93 Allowed 'General case' 0 N--CA 1.502 2.135 0 CA-C-N 122.14 2.246 . . . . 0.0 113.575 -173.655 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 66' ' ' VAL . . . . . 0.661 HG13 ' O ' ' B' ' 62' ' ' GLN . 2.6 m . . . . . 0 N--CA 1.505 2.318 0 C-N-CA 125.636 1.574 . . . . 0.0 111.795 173.916 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.562 1.421 0 N-CA-C 113.497 0.925 . . . . 0.0 113.497 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 89.5 mtm180 -80.3 74.48 7.13 Favored 'General case' 0 N--CA 1.496 1.87 0 CA-C-O 122.546 1.165 . . . . 0.0 113.49 -177.896 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 13.8 t70 -159.15 -41.56 0.06 Allowed 'General case' 0 N--CA 1.489 1.492 0 O-C-N 120.901 -1.124 . . . . 0.0 112.976 174.671 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -145.15 82.74 9.66 Favored Pre-proline 0 CA--C 1.57 1.717 0 O-C-N 120.531 -1.355 . . . . 0.0 108.12 162.594 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 5.7 Cg_exo -99.74 146.61 0.45 Allowed 'Trans proline' 0 C--N 1.366 1.473 0 CA-C-N 122.688 1.996 . . . . 0.0 113.782 -154.049 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 73.5 m80 -67.56 137.35 55.64 Favored 'General case' 0 CA--C 1.564 1.508 0 CA-C-N 114.377 -1.283 . . . . 0.0 113.383 173.031 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . 0.726 ' CZ ' HD12 ' B' ' 34' ' ' LEU 0.267 27.5 p90 -120.52 167.74 12.08 Favored 'General case' 0 CA--C 1.562 1.415 0 O-C-N 119.557 -1.965 . . . . 0.0 110.576 115.314 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 98.5 m-20 -89.99 90.87 8.34 Favored 'General case' 0 N--CA 1.487 1.411 0 O-C-N 119.695 -1.878 . . . . 0.0 108.059 166.365 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . 0.658 ' CD2' HD13 ' B' ' 34' ' ' LEU . 8.5 t80 -63.67 150.77 43.57 Favored 'General case' 0 CA--C 1.557 1.217 0 CA-C-O 125.457 2.551 . . . . 0.0 112.344 168.749 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -154.32 94.55 1.73 Allowed 'General case' 0 C--N 1.307 -1.28 0 CA-C-N 111.616 -2.538 . . . . 0.0 107.825 -139.539 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . 0.504 ' SD ' ' CD2' ' A' ' 9' ' ' PHE . 0.8 OUTLIER -114.77 115.59 43.71 Favored Pre-proline 0 CA--C 1.56 1.352 0 CA-C-O 117.219 -1.372 . . . . 0.0 111.785 -158.796 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 80.8 Cg_exo -42.47 140.61 2.55 Favored 'Trans proline' 0 CA--C 1.56 1.81 0 C-N-CA 122.79 2.327 . . . . 0.0 115.772 161.233 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . 0.409 ' SD ' ' HG3' ' A' ' 17' ' ' GLU . 22.9 tpp -55.68 -32.36 63.19 Favored 'General case' 0 N--CA 1.492 1.668 0 N-CA-C 118.376 2.732 . . . . 0.0 118.376 -157.671 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . 0.256 9.4 pt-20 -60.9 -46.49 90.45 Favored 'General case' 0 CA--C 1.568 1.66 0 N-CA-C 116.568 2.062 . . . . 0.0 116.568 162.186 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.432 ' CG1' HG12 ' B' ' 38' ' ' VAL . 0.6 OUTLIER -57.24 -49.6 79.35 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.234 0 CA-C-N 122.925 2.602 . . . . 0.0 112.82 172.7 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 1.4 ttt180 -72.39 -33.95 67.56 Favored 'General case' 0 C--O 1.216 -0.703 0 CA-C-O 116.086 -1.911 . . . . 0.0 115.433 175.39 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.409 ' HG3' ' SD ' ' A' ' 13' ' ' MET . 39.6 mt-10 -61.89 -40.32 95.01 Favored 'General case' 0 CA--C 1.566 1.563 0 CA-C-N 124.062 3.119 . . . . 0.0 114.53 161.093 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . 0.255 46.3 mtmt -67.92 -48.5 65.79 Favored 'General case' 0 CA--C 1.564 1.484 0 CA-C-N 121.577 1.989 . . . . 0.0 115.366 173.024 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.614 ' HB3' ' CE ' ' A' ' 30' ' ' MET 0.365 0.2 OUTLIER -68.16 -37.3 80.86 Favored 'General case' 0 CA--C 1.574 1.876 0 C-N-CA 124.791 1.236 . . . . 0.0 112.461 172.362 . . . . . . . . 4 4 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.523 ' HA ' ' HB3' ' A' ' 23' ' ' ALA . 27.8 ttpt -90.17 -22.83 21.52 Favored 'General case' 0 CA--C 1.567 1.612 0 O-C-N 119.155 -2.216 . . . . 0.0 115.382 179.534 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . 0.41 ' O ' ' HB3' ' A' ' 25' ' ' ALA . 14.8 m-85 -62.8 -68.02 0.37 Allowed 'General case' 0 N--CA 1.492 1.657 0 CA-C-O 114.009 -2.901 . . . . 0.0 110.511 151.88 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.417 ' HE ' HG13 ' A' ' 37' ' ' ILE 0.349 32.2 ttt85 -28.45 -45.19 0.03 OUTLIER 'General case' 0 CA--C 1.601 2.933 0 CA-C-N 125.682 3.856 . . . . 0.0 116.917 166.635 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.523 ' HB3' ' HA ' ' A' ' 20' ' ' LYS 0.288 . . -54.2 -80.29 0.02 OUTLIER 'General case' 0 CA--C 1.58 2.103 0 N-CA-C 118.111 2.634 . . . . 0.0 118.111 153.796 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 51.8 mm-40 -66.6 -36.93 83.79 Favored 'General case' 0 CA--C 1.578 2.049 0 N-CA-C 118.742 2.867 . . . . 0.0 118.742 -178.3 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.41 ' HB3' ' O ' ' A' ' 21' ' ' PHE . . . -42.6 -51.55 5.13 Favored 'General case' 0 CA--C 1.59 2.483 0 N-CA-C 116.399 2.0 . . . . 0.0 116.399 156.308 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 91.8 m-20 -79.04 -47.12 16.78 Favored 'General case' 0 N--CA 1.501 2.104 0 N-CA-C 116.15 1.907 . . . . 0.0 116.15 173.749 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 113.52 35.61 1.56 Allowed Glycine 0 N--CA 1.499 2.884 0 N-CA-C 117.132 1.613 . . . . 0.0 117.132 -154.476 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 75.7 mtm180 -131.27 155.44 47.14 Favored 'General case' 0 CA--C 1.576 1.975 0 N-CA-C 104.308 -2.479 . . . . 0.0 104.308 177.721 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 77.3 p -126.03 109.85 12.88 Favored 'General case' 0 N--CA 1.509 2.508 0 O-C-N 117.47 -3.269 . . . . 0.0 107.654 -171.822 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' MET . . . . . 0.614 ' CE ' ' HB3' ' A' ' 19' ' ' LEU . 0.1 OUTLIER -45.56 -38.52 6.53 Favored 'General case' 0 N--CA 1.496 1.863 0 N-CA-C 120.265 3.432 . . . . 0.0 120.265 -137.739 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 11.0 t-20 -47.3 -46.51 25.14 Favored 'General case' 0 CA--C 1.597 2.771 0 CA-C-N 124.931 3.514 . . . . 0.0 114.411 163.808 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . 0.314 17.5 t -48.77 -76.22 0.02 OUTLIER 'General case' 0 N--CA 1.5 2.05 0 N-CA-C 117.582 2.438 . . . . 0.0 117.582 143.923 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . 0.458 ' HB3' ' HB2' ' A' ' 23' ' ' ALA . 10.6 tm-20 -60.74 -53.58 55.66 Favored 'General case' 0 N--CA 1.506 2.351 0 CA-C-N 123.559 2.89 . . . . 0.0 118.745 -172.104 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.644 HD13 ' CG ' ' B' ' 9' ' ' PHE . 0.2 OUTLIER -42.99 -53.98 4.49 Favored 'General case' 0 CA--C 1.567 1.618 0 CA-C-O 115.699 -2.096 . . . . 0.0 106.244 167.52 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.481 ' HG ' ' CE1' ' B' ' 9' ' ' PHE . 19.7 mt -62.93 -44.56 95.75 Favored 'General case' 0 C--N 1.375 1.701 0 CA-C-N 124.093 3.133 . . . . 0.0 115.759 177.545 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . 0.437 ' O ' ' HB2' ' A' ' 40' ' ' ASP . 0.0 OUTLIER -61.47 -44.46 97.06 Favored 'General case' 0 N--CA 1.48 1.046 0 CA-C-O 115.632 -2.128 . . . . 0.0 113.8 177.892 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . 0.417 HG13 ' HE ' ' A' ' 22' ' ' ARG . 0.4 OUTLIER -69.79 -35.12 63.74 Favored 'Isoleucine or valine' 0 CA--C 1.564 1.504 0 CA-C-N 121.278 1.853 . . . . 0.0 115.027 165.95 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.584 HG21 HD22 ' A' ' 34' ' ' LEU . 6.6 t -76.51 -46.56 31.55 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.839 0 CA-C-N 121.93 2.15 . . . . 0.0 111.641 -173.147 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 14.0 tp60 -62.61 -36.77 83.82 Favored 'General case' 0 CA--C 1.567 1.613 0 O-C-N 121.142 -0.974 . . . . 0.0 112.957 160.58 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . 0.437 ' HB2' ' O ' ' A' ' 36' ' ' GLN 0.446 0.3 OUTLIER -41.35 -53.4 3.3 Favored 'General case' 0 N--CA 1.502 2.164 0 N-CA-C 116.467 2.025 . . . . 0.0 116.467 149.101 . . . . . . . . 4 4 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . 0.408 ' HB3' ' HA ' ' A' ' 38' ' ' VAL . . . -77.85 -33.73 52.08 Favored 'General case' 0 CA--C 1.553 1.092 0 N-CA-C 118.031 2.604 . . . . 0.0 118.031 -164.722 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.42 HD21 ' HG ' ' B' ' 19' ' ' LEU 0.304 0.5 OUTLIER -125.81 22.61 7.43 Favored 'General case' 0 N--CA 1.488 1.466 0 N-CA-C 115.45 1.648 . . . . 0.0 115.45 172.452 . . . . . . . . 4 4 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 57.9 p -126.99 -50.58 1.45 Allowed 'General case' 0 N--CA 1.495 1.817 0 N-CA-C 117.098 2.258 . . . . 0.0 117.098 148.198 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . 0.296 80.3 tttt -69.55 -51.25 16.72 Favored Pre-proline 0 N--CA 1.505 2.303 0 N-CA-C 120.312 3.449 . . . . 0.0 120.312 -117.979 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -81.69 108.82 1.94 Allowed 'Trans proline' 0 CA--C 1.563 1.966 0 N-CA-C 119.186 2.725 . . . . 0.0 119.186 -155.728 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . 0.256 50.7 m -124.15 -80.75 0.0 OUTLIER Pre-proline 0 CA--C 1.571 1.76 0 CA-C-O 114.964 -2.446 . . . . 0.0 109.997 153.982 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 43.9 Cg_endo -79.55 63.47 8.73 Favored 'Trans proline' 0 CA--C 1.573 2.459 0 CA-C-N 126.788 3.46 . . . . 0.0 114.511 169.235 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 75.2 t -142.01 -52.15 0.22 Allowed 'Isoleucine or valine' 0 N--CA 1.499 1.982 0 CA-C-N 114.841 -1.072 . . . . 0.0 113.342 -157.78 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 12.2 t -150.13 149.13 29.82 Favored 'General case' 0 N--CA 1.497 1.875 2 O-C-N 112.751 -6.218 . . . . 0.0 114.264 18.54 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 96.39 -50.38 1.64 Allowed Glycine 0 N--CA 1.495 2.601 0 N-CA-C 119.261 2.465 . . . . 0.0 119.261 154.21 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -70.63 72.06 0.5 Allowed 'General case' 0 CA--C 1.576 1.945 0 N-CA-C 115.984 1.846 . . . . 0.0 115.984 -177.091 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -114.54 76.01 0.96 Allowed 'General case' 0 CA--C 1.587 2.375 0 N-CA-C 114.253 1.205 . . . . 0.0 114.253 -170.766 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . 0.436 ' O ' ' HB2' ' A' ' 56' ' ' GLU . 0.1 OUTLIER -147.8 155.45 41.68 Favored 'General case' 0 N--CA 1.487 1.378 1 O-C-N 112.579 -6.326 . . . . 0.0 117.967 -18.678 . . . . . . . . 4 4 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . 0.553 ' HB2' ' HB2' ' A' ' 57' ' ' ARG 2.253 1.1 p30 -73.0 27.77 0.06 Allowed 'General case' 0 N--CA 1.504 2.264 0 CA-C-N 121.7 2.046 . . . . 0.0 111.593 169.795 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . 0.307 . . -104.45 9.46 35.61 Favored 'General case' 0 CA--C 1.553 1.071 0 O-C-N 117.58 -3.2 . . . . 0.0 118.496 144.779 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.436 ' HB2' ' O ' ' A' ' 53' ' ' ASN . 41.9 mt-10 -48.92 -26.68 2.61 Favored 'General case' 0 CA--C 1.595 2.684 0 N-CA-C 118.986 2.958 . . . . 0.0 118.986 113.191 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.553 ' HB2' ' HB2' ' A' ' 54' ' ' ASP 0.316 2.5 tmt_? -83.16 -60.8 2.04 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 118.741 -2.474 . . . . 0.0 114.395 170.473 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.879 HD23 HD22 ' B' ' 53' ' ' ASN 0.35 4.2 pp -56.24 -27.54 55.35 Favored 'General case' 0 CA--C 1.577 1.994 0 N-CA-C 115.784 1.772 . . . . 0.0 115.784 169.751 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -43.6 -64.12 0.71 Allowed 'General case' 0 N--CA 1.484 1.252 0 N-CA-C 117.641 2.46 . . . . 0.0 117.641 145.354 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -68.27 -11.26 59.1 Favored 'General case' 0 N--CA 1.493 1.724 0 CA-C-N 122.733 2.515 . . . . 0.0 117.465 178.091 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 9.3 mm-40 -74.68 -56.72 4.5 Favored 'General case' 0 N--CA 1.483 1.196 0 O-C-N 120.876 -1.14 . . . . 0.0 111.201 170.623 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . 0.637 ' HA ' HE21 ' A' ' 62' ' ' GLN 0.273 0.0 OUTLIER -73.1 -62.16 1.56 Allowed 'General case' 0 C--N 1.355 0.828 0 CA-C-N 120.845 1.657 . . . . 0.0 112.972 169.427 . . . . . . . . 4 4 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . 0.375 41.7 t -79.68 39.16 0.4 Allowed 'General case' 0 CA--C 1.581 2.163 0 N-CA-C 118.739 2.866 . . . . 0.0 118.739 172.341 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 8.0 mt-10 -98.37 -57.43 2.2 Favored 'General case' 0 N--CA 1.5 2.056 0 O-C-N 118.316 -2.74 . . . . 0.0 113.273 111.391 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.92 -39.21 93.65 Favored 'General case' 0 CA--C 1.568 1.664 0 N-CA-C 117.801 2.519 . . . . 0.0 117.801 -160.227 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.555 HG13 ' O ' ' A' ' 62' ' ' GLN 0.396 12.0 m . . . . . 0 N--CA 1.511 2.609 0 N-CA-C 120.073 3.361 . . . . 0.0 120.073 164.613 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.566 1.582 0 N-CA-C 116.263 1.949 . . . . 0.0 116.263 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 2' ' ' ARG . . . . . . . . . . . . 0.378 39.9 ptt180 44.7 46.98 8.75 Favored 'General case' 0 N--CA 1.502 2.14 0 N-CA-C 120.488 3.514 . . . . 0.0 120.488 -179.076 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -155.18 -51.39 0.09 Allowed 'General case' 0 N--CA 1.488 1.446 0 O-C-N 120.982 -1.074 . . . . 0.0 111.764 171.913 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 4' ' ' ASP . . . . . . . . . . . . 0.272 4.7 p-10 -137.66 87.33 17.46 Favored Pre-proline 0 CA--C 1.573 1.853 0 O-C-N 121.44 -0.788 . . . . 0.0 111.904 157.21 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 7.3 Cg_exo -95.41 145.9 1.38 Allowed 'Trans proline' 0 C--N 1.37 1.709 0 CA-C-N 122.636 1.977 . . . . 0.0 115.514 -161.254 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 6' ' ' HIS . . . . . . . . . . . . . 80.3 m80 -79.51 126.19 30.55 Favored 'General case' 0 CA--C 1.566 1.575 0 CA-C-N 113.99 -1.459 . . . . 0.0 112.277 175.278 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 7' ' ' PHE . . . . . 0.591 ' CZ ' HD12 ' A' ' 34' ' ' LEU . 0.8 OUTLIER -128.93 155.61 45.04 Favored 'General case' 0 CA--C 1.567 1.609 0 O-C-N 120.655 -1.278 . . . . 0.0 111.067 154.322 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 8' ' ' ASN . . . . . . . . . . . . . 6.7 p-10 -59.18 103.27 0.17 Allowed 'General case' 0 CA--C 1.575 1.904 0 N-CA-C 115.709 1.744 . . . . 0.0 115.709 171.15 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 9' ' ' PHE . . . . . 0.644 ' CG ' HD13 ' A' ' 34' ' ' LEU . 2.6 t80 -126.49 104.95 8.42 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 124.515 1.126 . . . . 0.0 108.557 158.365 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 10' ' ' ARG . . . . . . . . . . . . 0.472 34.8 tpt85 97.66 83.55 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.784 1 O-C-N 113.746 -5.596 . . . . 0.0 111.297 -19.161 . . . . . . . . 3 2 . 1 . 007 nuclear nobuild full ' B' B ' 11' ' ' MET . . . . . 0.455 ' HG2' HD21 ' A' ' 35' ' ' LEU . 16.1 mtt -151.5 130.13 6.25 Favored Pre-proline 0 CA--C 1.567 1.621 0 CA-C-O 117.26 -1.352 . . . . 0.0 110.46 -155.842 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 12' ' ' PRO . . . . . . . . . . . . . 83.8 Cg_exo -43.92 147.87 1.16 Allowed 'Trans proline' 0 CA--C 1.559 1.734 0 C-N-CA 123.172 2.582 . . . . 0.0 117.971 168.101 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 13' ' ' MET . . . . . . . . . . . . . 2.0 tpt -47.27 -39.84 15.4 Favored 'General case' 0 CA--C 1.575 1.917 0 N-CA-C 117.867 2.543 . . . . 0.0 117.867 -166.393 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -63.85 -50.92 66.97 Favored 'General case' 0 N--CA 1.487 1.421 0 N-CA-C 116.722 2.119 . . . . 0.0 116.722 171.15 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 15' ' ' VAL . . . . . 0.466 HG12 HG12 ' A' ' 38' ' ' VAL . 0.0 OUTLIER -59.35 -51.15 76.04 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.612 0 CA-C-N 121.145 1.793 . . . . 0.0 113.65 176.522 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -67.0 -31.63 72.32 Favored 'General case' 0 CA--C 1.547 0.847 0 CA-C-O 115.987 -1.959 . . . . 0.0 116.266 170.811 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 17' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -60.23 -47.47 85.82 Favored 'General case' 0 N--CA 1.492 1.629 0 CA-C-N 123.775 2.989 . . . . 0.0 113.822 160.691 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . 0.671 3.9 pttt -72.13 -35.43 69.1 Favored 'General case' 0 CA--C 1.568 1.641 0 N-CA-C 118.359 2.726 . . . . 0.0 118.359 177.459 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 19' ' ' LEU . . . . . 0.646 ' HB3' ' HE1' ' B' ' 30' ' ' MET 0.361 0.4 OUTLIER -68.81 -40.13 79.7 Favored 'General case' 0 CA--C 1.587 2.37 0 O-C-N 120.753 -1.217 . . . . 0.0 113.637 164.568 . . . . . . . . 4 4 . 1 . 007 nuclear nobuild full ' B' B ' 20' ' ' LYS . . . . . . . . . . . . . 28.8 ttpt -88.75 -30.39 19.09 Favored 'General case' 0 CA--C 1.56 1.358 0 O-C-N 120.135 -1.603 . . . . 0.0 115.09 -177.368 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 35.5 m-85 -58.52 -69.61 0.18 Allowed 'General case' 0 N--CA 1.49 1.526 0 CA-C-O 112.211 -3.757 . . . . 0.0 110.387 153.708 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . 0.295 23.5 ttt180 -21.99 -56.76 0.03 OUTLIER 'General case' 0 CA--C 1.589 2.46 1 CA-C-N 126.717 4.326 . . . . 0.0 116.579 168.219 . . . . . . . . 3 2 . 1 . 007 nuclear nobuild full ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -51.99 -71.94 0.06 Allowed 'General case' 0 CA--C 1.575 1.927 0 N-CA-C 121.199 3.778 . . . . 0.0 121.199 157.544 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 66.7 mm-40 -73.25 -32.11 64.52 Favored 'General case' 0 N--CA 1.497 1.917 0 N-CA-C 118.019 2.6 . . . . 0.0 118.019 -177.996 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 25' ' ' ALA . . . . . . . . . . . . . . . -41.71 -48.36 4.17 Favored 'General case' 0 CA--C 1.578 2.023 0 N-CA-C 116.775 2.139 . . . . 0.0 116.775 151.462 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 26' ' ' ASN . . . . . . . . . . . . 0.253 0.1 OUTLIER -93.82 -41.2 9.77 Favored 'General case' 0 CA--C 1.581 2.169 0 N-CA-C 116.862 2.171 . . . . 0.0 116.862 -179.349 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 27' ' ' GLY . . . . . . . . . . . . . . . 113.94 49.98 0.52 Allowed Glycine 0 N--CA 1.497 2.72 0 N-CA-C 116.152 1.221 . . . . 0.0 116.152 -167.218 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 28' ' ' ARG . . . . . . . . . . . . . 5.2 ttt85 -156.24 86.95 1.03 Allowed 'General case' 0 N--CA 1.496 1.837 0 N-CA-C 106.817 -1.549 . . . . 0.0 106.817 -164.826 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 29' ' ' SER . . . . . . . . . . . . . 12.3 t -81.9 129.57 34.8 Favored 'General case' 0 N--CA 1.5 2.027 0 O-C-N 118.58 -2.575 . . . . 0.0 107.747 -150.95 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 30' ' ' MET . . . . . 0.646 ' HE1' ' HB3' ' B' ' 19' ' ' LEU . 0.0 OUTLIER -46.62 -39.79 11.84 Favored 'General case' 0 N--CA 1.496 1.871 0 N-CA-C 119.546 3.165 . . . . 0.0 119.546 -143.349 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 31' ' ' ASN . . . . . . . . . . . . 0.261 0.1 OUTLIER -48.55 -39.38 23.37 Favored 'General case' 0 CA--C 1.589 2.456 0 CA-C-N 125.781 3.9 . . . . 0.0 114.997 166.332 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 32' ' ' SER . . . . . . . . . . . . 0.319 33.5 t -56.77 -67.19 0.33 Allowed 'General case' 0 CA--C 1.576 1.952 0 N-CA-C 119.39 3.108 . . . . 0.0 119.39 147.385 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . 0.25 6.2 tp10 -66.23 -55.1 17.83 Favored 'General case' 0 N--CA 1.52 3.068 0 CA-C-N 124.963 3.529 . . . . 0.0 115.809 -178.298 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 34' ' ' LEU . . . . . 0.726 HD12 ' CZ ' ' A' ' 7' ' ' PHE . 0.1 OUTLIER -39.71 -54.91 2.0 Favored 'General case' 0 CA--C 1.553 1.086 0 CA-C-O 115.057 -2.401 . . . . 0.0 108.086 167.239 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 35' ' ' LEU . . . . . . . . . . . . . 11.6 mt -63.08 -54.66 34.5 Favored 'General case' 0 C--N 1.373 1.622 0 CA-C-N 124.485 3.312 . . . . 0.0 115.124 177.533 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 36' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -56.59 -38.13 71.59 Favored 'General case' 0 CA--C 1.566 1.592 0 N-CA-C 115.484 1.661 . . . . 0.0 115.484 177.858 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 37' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -69.66 -38.05 75.48 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.474 0 N-CA-C 115.658 1.725 . . . . 0.0 115.658 164.885 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 38' ' ' VAL . . . . . 0.477 HG21 HD22 ' B' ' 34' ' ' LEU . 3.1 t -73.83 -48.07 40.87 Favored 'Isoleucine or valine' 0 CA--C 1.577 1.989 0 C-N-CA 127.14 2.176 . . . . 0.0 111.732 -178.849 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -47.17 -51.44 18.28 Favored 'General case' 0 CA--C 1.556 1.208 0 CA-C-O 117.508 -1.234 . . . . 0.0 113.427 153.416 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 40' ' ' ASP . . . . . . . . . . . . 0.936 0.5 OUTLIER -52.14 -37.41 54.32 Favored 'General case' 0 CA--C 1.573 1.833 0 N-CA-C 118.879 2.918 . . . . 0.0 118.879 160.706 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 41' ' ' ALA . . . . . 0.56 ' HA ' HD22 ' A' ' 58' ' ' LEU . . . -68.86 -49.01 61.94 Favored 'General case' 0 CA--C 1.554 1.126 0 N-CA-C 115.892 1.812 . . . . 0.0 115.892 -170.263 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 1.4 pp -117.74 -0.8 11.71 Favored 'General case' 0 CA--C 1.566 1.585 0 N-CA-C 117.534 2.42 . . . . 0.0 117.534 178.364 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 43' ' ' SER . . . . . . . . . . . . . 6.8 m -75.34 -26.82 58.91 Favored 'General case' 0 N--CA 1.497 1.913 0 CA-C-N 120.945 1.702 . . . . 0.0 115.028 148.298 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 44' ' ' LYS . . . . . 0.49 ' HB3' HD21 ' B' ' 53' ' ' ASN 0.677 45.0 pttt 67.48 -110.55 0.0 OUTLIER Pre-proline 0 CA--C 1.588 2.44 0 CA-C-O 114.582 -2.628 . . . . 0.0 116.056 173.064 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -74.55 148.87 38.11 Favored 'Trans proline' 0 CA--C 1.562 1.877 0 CA-C-N 127.423 3.687 . . . . 0.0 117.508 -171.813 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 46' ' ' SER . . . . . . . . . . . . . 73.0 m -115.71 177.8 1.12 Allowed Pre-proline 0 CA--C 1.584 2.265 0 CA-C-N 113.853 -1.522 . . . . 0.0 110.259 138.623 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_exo -67.31 85.92 0.34 Allowed 'Trans proline' 0 CA--C 1.571 2.356 0 CA-C-N 123.866 2.416 . . . . 0.0 116.658 179.253 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 48' ' ' VAL . . . . . . . . . . . . 0.375 48.7 t -106.38 -88.08 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.507 2.415 0 CA-C-O 118.292 -0.861 . . . . 0.0 110.907 -179.241 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 49' ' ' THR . . . . . 0.537 HG21 HH21 ' A' ' 57' ' ' ARG . 2.6 m -149.42 140.1 22.63 Favored 'General case' 0 CA--C 1.575 1.923 2 O-C-N 110.979 -7.326 . . . . 0.0 110.354 -12.251 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 50' ' ' GLY . . . . . . . . . . . . . . . 143.34 93.14 0.17 Allowed Glycine 0 N--CA 1.493 2.447 0 CA-C-O 118.396 -1.224 . . . . 0.0 112.71 173.144 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 51' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -29.77 149.86 0.0 OUTLIER 'General case' 0 N--CA 1.501 2.097 3 CA-C-N 128.263 6.032 . . . . 0.0 124.554 4.62 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 52' ' ' ARG . . . . . . . . . . . . . 1.2 tpt180 -95.04 167.35 11.44 Favored 'General case' 0 CA--C 1.586 2.34 0 C-N-CA 124.831 1.253 . . . . 0.0 111.69 156.52 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 53' ' ' ASN . . . . . 0.879 HD22 HD23 ' A' ' 58' ' ' LEU 0.763 52.2 p30 -71.86 85.19 0.95 Allowed 'General case' 0 N--CA 1.501 2.111 0 O-C-N 118.791 -2.443 . . . . 0.0 111.372 169.411 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 54' ' ' ASP . . . . . 0.499 ' HA ' ' HB2' ' B' ' 57' ' ' ARG 0.538 4.2 p30 -76.72 31.18 0.13 Allowed 'General case' 0 C--N 1.36 1.024 0 N-CA-C 119.261 3.059 . . . . 0.0 119.261 145.278 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 55' ' ' ALA . . . . . 0.449 ' O ' ' HB2' ' B' ' 59' ' ' ALA . . . -112.45 -15.88 13.01 Favored 'General case' 0 CA--C 1.548 0.891 0 N-CA-C 119.388 3.107 . . . . 0.0 119.388 141.664 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 45.5 mm-40 -66.98 -1.49 4.15 Favored 'General case' 0 N--CA 1.498 1.97 0 N-CA-C 118.154 2.65 . . . . 0.0 118.154 137.137 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 57' ' ' ARG . . . . . 0.499 ' HB2' ' HA ' ' B' ' 54' ' ' ASP 0.375 0.0 OUTLIER -105.13 -24.37 12.77 Favored 'General case' 0 CA--C 1.596 2.737 0 O-C-N 119.944 -1.722 . . . . 0.0 115.418 160.16 . . . . . . . . 4 4 . 1 . 007 nuclear nobuild full ' B' B ' 58' ' ' LEU . . . . . 0.493 HD23 ' H ' ' B' ' 59' ' ' ALA 0.486 0.0 OUTLIER -65.33 -43.68 90.19 Favored 'General case' 0 N--CA 1.52 3.064 0 O-C-N 117.809 -3.057 . . . . 0.0 118.802 161.396 . . . . . . . . 4 4 . 1 . 007 nuclear nobuild full ' B' B ' 59' ' ' ALA . . . . . 0.493 ' H ' HD23 ' B' ' 58' ' ' LEU 0.374 . . -8.64 -83.78 0.0 OUTLIER 'General case' 0 N--CA 1.477 0.902 1 N-CA-C 123.265 4.543 . . . . 0.0 123.265 120.617 . . . . . . . . 4 3 . 1 . 007 nuclear nobuild full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 64.2 m-20 -51.19 -12.83 0.14 Allowed 'General case' 0 CA--C 1.572 1.824 0 CA-C-N 123.979 3.081 . . . . 0.0 119.137 170.233 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 5.9 tm-20 -64.42 -60.2 3.44 Favored 'General case' 0 N--CA 1.496 1.84 0 CA-C-N 122.546 2.43 . . . . 0.0 114.545 152.435 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 62' ' ' GLN . . . . . 0.66 ' O ' HG13 ' B' ' 66' ' ' VAL . 0.1 OUTLIER -70.83 -63.51 1.08 Allowed 'General case' 0 CA--C 1.558 1.271 0 CA-C-N 121.058 1.754 . . . . 0.0 114.179 173.529 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 63' ' ' SER . . . . . . . . . . . . 0.287 5.3 p -70.51 31.18 0.04 OUTLIER 'General case' 0 CA--C 1.571 1.751 0 N-CA-C 120.225 3.417 . . . . 0.0 120.225 165.487 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 64' ' ' GLU . . . . . . . . . . . . . 81.1 mt-10 -104.38 -47.95 3.97 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 119.585 -1.947 . . . . 0.0 111.627 123.171 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 3.6 mp -85.41 42.52 0.96 Allowed 'General case' 0 N--CA 1.502 2.162 0 N-CA-C 116.666 2.099 . . . . 0.0 116.666 -174.884 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 66' ' ' VAL . . . . . 0.66 HG13 ' O ' ' B' ' 62' ' ' GLN . 8.4 m . . . . . 0 N--CA 1.496 1.837 0 C-N-CA 126.657 1.983 . . . . 0.0 109.362 172.549 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 1.437 0 N-CA-C 116.032 1.864 . . . . 0.0 116.032 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 70.2 mtm-85 59.15 42.21 19.16 Favored 'General case' 0 N--CA 1.5 2.044 0 N-CA-C 116.634 2.087 . . . . 0.0 116.634 173.719 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 5.8 p-10 -120.62 115.42 23.34 Favored 'General case' 0 CA--C 1.553 1.088 0 N-CA-C 106.0 -1.852 . . . . 0.0 106.0 -177.858 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 23.8 p-10 -145.02 86.87 7.47 Favored Pre-proline 0 CA--C 1.57 1.745 1 O-C-N 113.557 -5.714 . . . . 0.0 113.18 27.768 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 65.2 Cg_endo -67.5 157.7 60.54 Favored 'Trans proline' 0 CA--C 1.564 2.024 0 C-N-CA 123.044 2.496 . . . . 0.0 117.566 175.949 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . 0.444 ' HA ' ' HA ' ' B' ' 10' ' ' ARG . 76.0 m80 -85.1 145.13 27.81 Favored 'General case' 0 CA--C 1.565 1.538 0 N-CA-C 115.296 1.591 . . . . 0.0 115.296 -171.28 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . 0.793 ' CZ ' HD12 ' B' ' 34' ' ' LEU . 1.3 p90 -128.31 136.78 51.46 Favored 'General case' 0 N--CA 1.487 1.407 0 O-C-N 120.094 -1.629 . . . . 0.0 109.351 135.987 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 58.5 m-20 -73.53 92.47 1.91 Allowed 'General case' 0 CA--C 1.558 1.257 0 O-C-N 120.953 -1.092 . . . . 0.0 110.748 175.75 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . 0.696 ' CD2' HD13 ' B' ' 34' ' ' LEU . 3.9 t80 -68.87 163.35 24.51 Favored 'General case' 0 CA--C 1.562 1.423 0 CA-C-O 124.69 2.186 . . . . 0.0 110.466 164.347 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 173.18 98.74 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.783 0 CA-C-N 113.114 -1.857 . . . . 0.0 107.135 -124.304 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 7.3 mtt -145.75 131.74 9.54 Favored Pre-proline 0 N--CA 1.496 1.852 0 CA-C-O 116.751 -1.595 . . . . 0.0 112.275 -153.125 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 79.9 Cg_exo -43.27 150.16 0.43 Allowed 'Trans proline' 0 CA--C 1.561 1.846 0 C-N-CA 123.113 2.542 . . . . 0.0 116.936 170.585 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 21.2 tpp -64.38 -28.72 69.89 Favored 'General case' 0 N--CA 1.491 1.619 0 N-CA-C 116.987 2.217 . . . . 0.0 116.987 -164.192 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 9.1 pm0 -57.54 -48.01 80.46 Favored 'General case' 0 CA--C 1.566 1.571 0 N-CA-C 116.973 2.212 . . . . 0.0 116.973 156.365 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.401 ' CG1' HG12 ' B' ' 38' ' ' VAL . 2.0 t -60.97 -47.28 94.26 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.047 0 CA-C-N 122.019 2.19 . . . . 0.0 115.25 -179.747 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . 0.509 0.1 OUTLIER -114.87 27.43 9.43 Favored 'General case' 0 N--CA 1.485 1.314 0 N-CA-C 118.376 2.732 . . . . 0.0 118.376 170.979 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 5.5 pt-20 -71.61 -45.96 60.62 Favored 'General case' 0 N--CA 1.483 1.222 0 O-C-N 119.141 -2.224 . . . . 0.0 113.517 119.856 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . 0.297 56.0 mtmt -60.98 -52.26 65.77 Favored 'General case' 0 CA--C 1.563 1.469 0 N-CA-C 116.338 1.977 . . . . 0.0 116.338 177.986 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.744 ' HB3' ' CE ' ' A' ' 30' ' ' MET . 6.9 mt -65.67 -43.93 87.79 Favored 'General case' 0 CA--C 1.576 1.946 0 CA-C-N 120.291 1.405 . . . . 0.0 114.326 166.898 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 5.7 ttpt -77.7 -29.36 51.33 Favored 'General case' 0 CA--C 1.572 1.806 0 CA-C-N 123.296 2.771 . . . . 0.0 113.69 -178.499 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . 0.429 ' O ' ' HB3' ' A' ' 25' ' ' ALA . 17.3 m-30 -63.71 -67.86 0.39 Allowed 'General case' 0 N--CA 1.485 1.317 0 CA-C-O 115.627 -2.13 . . . . 0.0 111.725 159.792 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . 0.307 14.1 ttt180 -26.06 -49.19 0.03 OUTLIER 'General case' 0 CA--C 1.595 2.697 0 CA-C-N 124.626 3.376 . . . . 0.0 115.889 164.782 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . 0.293 . . -55.26 -76.53 0.03 OUTLIER 'General case' 0 CA--C 1.591 2.52 0 O-C-N 117.174 -3.454 . . . . 0.0 118.225 156.278 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 38.8 mt-10 -69.01 -46.87 66.89 Favored 'General case' 0 N--CA 1.504 2.238 0 N-CA-C 119.342 3.09 . . . . 0.0 119.342 -179.182 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.429 ' HB3' ' O ' ' A' ' 21' ' ' PHE . . . -41.08 -47.27 3.12 Favored 'General case' 0 CA--C 1.577 2.003 0 N-CA-C 117.611 2.448 . . . . 0.0 117.611 158.724 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . 0.329 0.0 OUTLIER -124.6 -43.21 2.04 Favored 'General case' 0 CA--C 1.571 1.776 0 CA-C-O 117.884 -1.055 . . . . 0.0 113.439 -146.713 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 173.26 -27.92 0.09 OUTLIER Glycine 0 N--CA 1.498 2.77 0 N-CA-C 120.78 3.072 . . . . 0.0 120.78 173.802 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.458 ' CZ ' HE21 ' A' ' 36' ' ' GLN 0.396 36.6 mtm105 -110.3 179.96 3.94 Favored 'General case' 0 N--CA 1.498 1.945 0 CA-C-N 119.635 1.717 . . . . 0.0 107.39 -169.816 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . 0.449 ' H ' ' HB3' ' A' ' 32' ' ' SER . 80.2 p -131.4 105.81 7.84 Favored 'General case' 0 N--CA 1.502 2.171 0 O-C-N 117.487 -3.258 . . . . 0.0 105.757 -172.0 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' MET . . . . . 0.744 ' CE ' ' HB3' ' A' ' 19' ' ' LEU . 0.0 OUTLIER -38.26 -45.65 1.0 Allowed 'General case' 0 N--CA 1.495 1.81 0 N-CA-C 120.336 3.458 . . . . 0.0 120.336 -139.947 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 15.0 t-20 -42.63 -47.59 5.3 Favored 'General case' 0 CA--C 1.597 2.763 0 O-C-N 117.758 -3.089 . . . . 0.0 115.293 162.788 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . 0.449 ' HB3' ' H ' ' A' ' 29' ' ' SER 0.277 42.8 t -54.0 -63.94 0.99 Allowed 'General case' 0 N--CA 1.501 2.119 0 N-CA-C 120.073 3.36 . . . . 0.0 120.073 147.052 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 5.9 tm-20 -69.35 -51.77 33.65 Favored 'General case' 0 N--CA 1.515 2.79 0 CA-C-N 123.042 2.655 . . . . 0.0 116.986 -175.598 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.767 HD12 ' CZ ' ' B' ' 7' ' ' PHE . 0.0 OUTLIER -44.08 -54.8 5.21 Favored 'General case' 0 CA--C 1.561 1.387 0 CA-C-O 115.535 -2.174 . . . . 0.0 107.59 162.793 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.423 ' HG ' ' CE1' ' B' ' 9' ' ' PHE . 10.9 mt -64.3 -56.2 16.1 Favored 'General case' 0 N--CA 1.491 1.622 0 CA-C-N 124.759 3.436 . . . . 0.0 115.099 -176.598 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . 0.458 HE21 ' CZ ' ' A' ' 28' ' ' ARG . 0.5 OUTLIER -57.73 -38.59 75.58 Favored 'General case' 0 CA--C 1.563 1.45 0 CA-C-O 115.928 -1.987 . . . . 0.0 113.366 177.206 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -69.59 -33.3 56.19 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.668 0 CA-C-N 122.485 2.402 . . . . 0.0 115.441 166.972 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.691 HG13 HD12 ' B' ' 19' ' ' LEU . 2.3 t -74.98 -49.49 28.35 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.544 0 C-N-CA 128.535 2.734 . . . . 0.0 112.974 178.906 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 34.3 mt-30 -43.34 -55.13 4.25 Favored 'General case' 0 N--CA 1.484 1.254 0 CA-C-O 116.695 -1.622 . . . . 0.0 112.294 151.531 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . 0.418 ' HA ' ' HA ' ' A' ' 44' ' ' LYS 0.429 0.9 OUTLIER -41.6 -49.81 4.1 Favored 'General case' 0 N--CA 1.495 1.812 0 N-CA-C 118.072 2.619 . . . . 0.0 118.072 158.789 . . . . . . . . 4 4 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . 0.331 . . -87.75 -17.67 31.15 Favored 'General case' 0 CA--C 1.548 0.875 0 N-CA-C 117.784 2.513 . . . . 0.0 117.784 -159.361 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.47 HD13 ' HG3' ' B' ' 18' ' ' LYS . 0.5 OUTLIER -108.64 -15.0 14.52 Favored 'General case' 0 N--CA 1.495 1.775 0 N-CA-C 118.625 2.824 . . . . 0.0 118.625 153.079 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 75.7 p -135.85 -32.94 0.87 Allowed 'General case' 0 N--CA 1.496 1.838 0 N-CA-C 116.905 2.187 . . . . 0.0 116.905 -173.138 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . 0.418 ' HA ' ' HA ' ' A' ' 40' ' ' ASP 0.703 6.5 tmtt? 56.34 -87.61 0.0 OUTLIER Pre-proline 0 CA--C 1.596 2.724 1 N-CA-C 123.134 4.494 . . . . 0.0 123.134 -125.999 . . . . . . . . 4 3 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 47.2 Cg_endo -81.53 143.74 13.78 Favored 'Trans proline' 0 CA--C 1.557 1.658 0 CA-C-N 126.282 3.279 . . . . 0.0 119.296 -132.0 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 19.4 m -140.01 -58.17 0.02 OUTLIER Pre-proline 0 CA--C 1.573 1.842 0 CA-C-O 116.06 -1.924 . . . . 0.0 112.408 133.499 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 41.8 Cg_endo -90.11 36.51 0.34 Allowed 'Trans proline' 0 C--N 1.375 1.965 0 N-CA-C 121.125 3.471 . . . . 0.0 121.125 -157.022 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . 0.429 10.2 t -142.23 -87.01 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.515 2.787 0 N-CA-C 108.144 -1.058 . . . . 0.0 108.144 154.65 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 4.4 t -169.84 150.94 4.02 Favored 'General case' 0 CA--C 1.58 2.104 2 O-C-N 111.677 -6.89 . . . . 0.0 113.389 -14.655 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -102.33 41.27 2.17 Favored Glycine 0 N--CA 1.508 3.466 0 N-CA-C 116.998 1.559 . . . . 0.0 116.998 147.995 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . 0.588 ' HA ' ' HE ' ' B' ' 57' ' ' ARG . 10.1 m-30 -99.7 106.78 18.74 Favored 'General case' 0 CA--C 1.572 1.807 0 C-N-CA 124.28 1.032 . . . . 0.0 109.406 176.704 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 38.9 ttp180 -135.37 136.78 41.75 Favored 'General case' 0 N--CA 1.51 2.571 0 N-CA-C 115.08 1.511 . . . . 0.0 115.08 179.767 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . 0.746 ' HA ' ' HB2' ' A' ' 55' ' ' ALA 0.357 3.3 m120 111.68 176.6 0.0 OUTLIER 'General case' 0 N--CA 1.525 3.322 0 C-N-CA 129.122 2.969 . . . . 0.0 110.689 -179.048 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . 0.437 ' HA ' ' HB3' ' A' ' 53' ' ' ASN . 6.7 p30 -86.19 123.93 32.02 Favored 'General case' 0 C--N 1.359 1.02 2 O-C-N 108.316 -8.99 . . . . 0.0 105.934 -14.916 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . 0.917 ' H ' ' H ' ' A' ' 57' ' ' ARG 0.458 . . -129.89 -125.98 0.21 Allowed 'General case' 0 C--N 1.292 -1.91 0 CA-C-N 111.796 -2.456 . . . . 0.0 106.981 -108.286 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.53 ' HA ' ' HB3' ' A' ' 59' ' ' ALA . 20.7 mm-40 -6.17 -17.37 0.0 OUTLIER 'General case' 0 CA--C 1.601 2.932 1 N-CA-C 125.789 5.478 . . . . 0.0 125.789 90.241 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.917 ' H ' ' H ' ' A' ' 55' ' ' ALA 0.323 0.0 OUTLIER -120.96 -37.87 2.91 Favored 'General case' 0 CA--C 1.564 1.494 0 O-C-N 118.305 -2.747 . . . . 0.0 111.593 -169.286 . . . . . . . . 4 4 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 4.2 tp -75.18 -13.03 60.42 Favored 'General case' 0 CA--C 1.58 2.115 0 N-CA-C 115.627 1.714 . . . . 0.0 115.627 144.056 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . 0.53 ' HB3' ' HA ' ' A' ' 56' ' ' GLU . . . -54.55 -51.31 65.63 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 119.451 -2.031 . . . . 0.0 114.734 148.652 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 2.6 t70 -71.36 -14.52 62.21 Favored 'General case' 0 N--CA 1.482 1.143 0 N-CA-C 116.868 2.173 . . . . 0.0 116.868 171.186 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . 0.278 13.4 tp10 -73.15 -59.72 2.58 Favored 'General case' 0 N--CA 1.484 1.273 0 CA-C-N 119.602 1.092 . . . . 0.0 112.642 167.946 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . 0.437 ' O ' HG13 ' A' ' 66' ' ' VAL . 8.0 tp60 -67.62 -59.61 3.21 Favored 'General case' 0 CA--C 1.555 1.144 0 CA-C-N 121.75 2.068 . . . . 0.0 110.703 172.734 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . 0.439 ' HA ' HG22 ' A' ' 66' ' ' VAL 0.297 46.0 t -92.72 52.07 1.81 Allowed 'General case' 0 CA--C 1.562 1.42 0 N-CA-C 118.497 2.777 . . . . 0.0 118.497 172.928 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -110.25 -21.07 12.41 Favored 'General case' 0 CA--C 1.577 1.995 0 O-C-N 119.81 -1.806 . . . . 0.0 115.643 109.197 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 20.8 mt -91.37 -7.31 51.2 Favored 'General case' 0 N--CA 1.509 2.476 0 CA-C-N 122.84 2.564 . . . . 0.0 116.452 -174.161 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.439 HG22 ' HA ' ' A' ' 63' ' ' SER . 13.8 m . . . . . 0 N--CA 1.503 2.218 0 N-CA-C 118.28 2.696 . . . . 0.0 118.28 164.497 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.565 1.544 0 N-CA-C 113.837 1.051 . . . . 0.0 113.837 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 2' ' ' ARG . . . . . . . . . . . . . 36.4 ptt180 -62.15 -41.97 98.8 Favored 'General case' 0 N--CA 1.506 2.346 1 N-CA-C 121.854 4.02 . . . . 0.0 121.854 -177.429 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . 0.389 15.7 t70 69.54 106.23 0.06 Allowed 'General case' 0 CA--C 1.568 1.649 0 CA-C-N 111.902 -2.408 . . . . 0.0 116.156 -171.886 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 4' ' ' ASP . . . . . . . . . . . . 0.519 2.7 p30 66.19 67.27 0.71 Allowed Pre-proline 0 CA--C 1.569 1.694 0 N-CA-C 120.419 3.488 . . . . 0.0 120.419 166.893 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -62.3 165.07 15.83 Favored 'Trans proline' 0 CA--C 1.568 2.196 0 C-N-CA 122.276 1.984 . . . . 0.0 116.991 150.205 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 6' ' ' HIS . . . . . . . . . . . . . 76.6 m80 -88.27 153.46 21.2 Favored 'General case' 0 CA--C 1.569 1.711 0 CA-C-N 111.723 -2.49 . . . . 0.0 112.429 169.544 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 7' ' ' PHE . . . . . 0.767 ' CZ ' HD12 ' A' ' 34' ' ' LEU . 10.0 p90 -130.43 159.69 36.29 Favored 'General case' 0 CA--C 1.568 1.647 0 O-C-N 119.491 -2.006 . . . . 0.0 112.047 129.782 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 8' ' ' ASN . . . . . . . . . . . . . 14.6 p-10 -65.74 87.69 0.09 Allowed 'General case' 0 CA--C 1.567 1.626 0 N-CA-C 114.279 1.214 . . . . 0.0 114.279 168.937 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 9' ' ' PHE . . . . . 0.678 ' CD2' HD13 ' A' ' 34' ' ' LEU 0.254 1.9 t80 -79.76 179.44 7.53 Favored 'General case' 0 CA--C 1.556 1.177 0 CA-C-O 123.724 1.726 . . . . 0.0 110.361 158.932 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 10' ' ' ARG . . . . . 0.444 ' HA ' ' HA ' ' A' ' 6' ' ' HIS 0.425 67.4 mtt180 -127.16 -136.94 0.25 Allowed 'General case' 0 N--CA 1.477 0.886 0 CA-C-N 114.246 -1.343 . . . . 0.0 110.832 -164.418 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 11' ' ' MET . . . . . 0.523 ' SD ' ' CD2' ' B' ' 9' ' ' PHE . 5.1 mmt -146.12 171.14 6.8 Favored Pre-proline 0 CA--C 1.579 2.071 0 O-C-N 117.301 -3.375 . . . . 0.0 110.683 63.331 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 12' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -45.76 131.92 13.31 Favored 'Trans proline' 0 C--N 1.371 1.721 0 O-C-N 117.103 -2.104 . . . . 0.0 113.328 147.882 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 13' ' ' MET . . . . . . . . . . . . . 22.5 tpp -60.17 -27.12 66.86 Favored 'General case' 0 CA--C 1.568 1.637 0 N-CA-C 118.14 2.644 . . . . 0.0 118.14 -154.335 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 14' ' ' GLU . . . . . . . . . . . . 0.271 11.1 pt-20 -57.14 -50.07 73.96 Favored 'General case' 0 CA--C 1.565 1.546 0 N-CA-C 117.001 2.223 . . . . 0.0 117.001 162.309 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 15' ' ' VAL . . . . . 0.471 ' CG1' HG12 ' A' ' 38' ' ' VAL . 0.1 OUTLIER -63.52 -43.06 98.17 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.884 0 CA-C-N 121.037 1.744 . . . . 0.0 114.375 173.756 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 16' ' ' ARG . . . . . . . . . . . . 0.261 4.8 ttt180 -78.97 -32.22 45.26 Favored 'General case' 0 N--CA 1.478 0.943 0 CA-C-O 116.058 -1.925 . . . . 0.0 114.518 175.404 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 17' ' ' GLU . . . . . . . . . . . . . 5.3 pt-20 -64.77 -43.97 91.53 Favored 'General case' 0 N--CA 1.484 1.26 0 CA-C-N 124.0 3.091 . . . . 0.0 113.305 163.209 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 18' ' ' LYS . . . . . 0.47 ' HG3' HD13 ' A' ' 42' ' ' LEU 0.615 16.5 pttt -70.14 -33.25 71.57 Favored 'General case' 0 CA--C 1.565 1.551 0 N-CA-C 117.858 2.54 . . . . 0.0 117.858 173.712 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 19' ' ' LEU . . . . . 0.691 HD12 HG13 ' A' ' 38' ' ' VAL 0.367 0.7 OUTLIER -76.59 -40.27 50.01 Favored 'General case' 0 CA--C 1.567 1.617 0 CA-C-N 121.016 1.735 . . . . 0.0 114.021 166.689 . . . . . . . . 4 4 . 1 . 008 nuclear nobuild full ' B' B ' 20' ' ' LYS . . . . . . . . . . . . . 3.0 ttpt -79.71 -32.77 41.32 Favored 'General case' 0 CA--C 1.563 1.458 0 O-C-N 119.861 -1.774 . . . . 0.0 114.556 179.174 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 18.9 m-85 -60.78 -73.86 0.09 Allowed 'General case' 0 N--CA 1.491 1.619 1 CA-C-O 111.613 -4.042 . . . . 0.0 109.951 155.213 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . 0.276 17.9 ttt180 -22.81 -54.82 0.03 OUTLIER 'General case' 0 N--CA 1.506 2.334 1 CA-C-N 127.601 4.728 . . . . 0.0 117.066 170.655 . . . . . . . . 3 2 . 1 . 008 nuclear nobuild full ' B' B ' 23' ' ' ALA . . . . . 0.516 ' HB2' ' CB ' ' B' ' 33' ' ' GLU . . . -48.63 -79.8 0.01 OUTLIER 'General case' 0 CA--C 1.58 2.102 0 N-CA-C 118.489 2.774 . . . . 0.0 118.489 156.592 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 46.4 mm-40 -65.82 -34.22 77.65 Favored 'General case' 0 N--CA 1.498 1.93 0 N-CA-C 118.978 2.955 . . . . 0.0 118.978 -178.429 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 25' ' ' ALA . . . . . . . . . . . . . . . -41.96 -48.1 4.47 Favored 'General case' 0 CA--C 1.578 2.052 0 N-CA-C 117.536 2.421 . . . . 0.0 117.536 153.712 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 26' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -97.97 -44.52 6.63 Favored 'General case' 0 CA--C 1.576 1.951 0 N-CA-C 116.64 2.089 . . . . 0.0 116.64 -173.614 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 27' ' ' GLY . . . . . . . . . . . . . . . 122.62 13.7 4.58 Favored Glycine 0 N--CA 1.498 2.798 0 N-CA-C 119.05 2.38 . . . . 0.0 119.05 -159.584 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 28' ' ' ARG . . . . . 0.675 ' HE ' ' HG2' ' B' ' 33' ' ' GLU . 61.8 mtm-85 -109.54 154.72 22.31 Favored 'General case' 0 CA--C 1.575 1.924 0 N-CA-C 103.981 -2.6 . . . . 0.0 103.981 167.302 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 29' ' ' SER . . . . . . . . . . . . . 79.1 p -129.35 112.35 13.76 Favored 'General case' 0 N--CA 1.505 2.311 0 O-C-N 117.049 -3.532 . . . . 0.0 106.001 -169.737 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 30' ' ' MET . . . . . 0.468 ' CE ' ' HB3' ' B' ' 19' ' ' LEU . 24.1 mtp -47.15 -38.58 11.95 Favored 'General case' 0 N--CA 1.497 1.915 0 N-CA-C 118.772 2.878 . . . . 0.0 118.772 -135.198 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 31' ' ' ASN . . . . . . . . . . . . 0.26 0.1 OUTLIER -48.21 -43.27 31.85 Favored 'General case' 0 CA--C 1.598 2.816 0 O-C-N 116.906 -3.622 . . . . 0.0 115.315 164.425 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 32' ' ' SER . . . . . . . . . . . . 0.461 75.4 p -54.84 -63.5 1.13 Allowed 'General case' 0 N--CA 1.505 2.319 0 N-CA-C 118.755 2.872 . . . . 0.0 118.755 145.262 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 33' ' ' GLU . . . . . 0.675 ' HG2' ' HE ' ' B' ' 28' ' ' ARG . 3.0 tm-20 -67.18 -50.15 62.11 Favored 'General case' 0 N--CA 1.511 2.624 0 N-CA-C 120.35 3.463 . . . . 0.0 120.35 -177.052 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 34' ' ' LEU . . . . . 0.793 HD12 ' CZ ' ' A' ' 7' ' ' PHE . 0.1 OUTLIER -42.07 -54.69 3.48 Favored 'General case' 0 CA--C 1.554 1.126 0 CA-C-O 114.881 -2.485 . . . . 0.0 107.756 159.807 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 35' ' ' LEU . . . . . 0.415 HD23 ' HA ' ' B' ' 35' ' ' LEU . 12.2 mt -60.38 -40.11 89.71 Favored 'General case' 0 N--CA 1.492 1.633 0 CA-C-N 124.75 3.432 . . . . 0.0 116.766 176.028 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 36' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.22 -46.07 74.94 Favored 'General case' 0 N--CA 1.488 1.438 0 N-CA-C 115.017 1.488 . . . . 0.0 115.017 176.145 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 37' ' ' ILE . . . . . . . . . . . . . 5.3 tt -63.12 -30.2 49.11 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.408 0 CA-C-O 114.858 -2.496 . . . . 0.0 116.101 161.89 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 38' ' ' VAL . . . . . 0.616 ' HA ' ' HB3' ' B' ' 41' ' ' ALA . 2.2 t -83.63 -46.21 18.4 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.923 0 CA-C-N 121.893 2.133 . . . . 0.0 112.704 -172.301 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 33.5 mt-30 -57.28 -38.89 74.63 Favored 'General case' 0 CA--C 1.572 1.82 0 O-C-N 121.148 -0.97 . . . . 0.0 112.497 157.291 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 40' ' ' ASP . . . . . . . . . . . . 0.528 5.2 m-20 -52.93 -41.45 64.46 Favored 'General case' 0 CA--C 1.58 2.103 0 N-CA-C 119.264 3.061 . . . . 0.0 119.264 151.168 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 41' ' ' ALA . . . . . 0.616 ' HB3' ' HA ' ' B' ' 38' ' ' VAL . . . -75.68 -20.62 58.3 Favored 'General case' 0 N--CA 1.493 1.715 0 N-CA-C 116.695 2.109 . . . . 0.0 116.695 -175.663 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 22.4 mt -96.14 -36.35 11.0 Favored 'General case' 0 N--CA 1.488 1.464 0 C-N-CA 125.057 1.343 . . . . 0.0 113.673 170.743 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 43' ' ' SER . . . . . . . . . . . . . 22.8 t -64.0 -41.64 97.42 Favored 'General case' 0 N--CA 1.497 1.891 0 N-CA-C 117.334 2.346 . . . . 0.0 117.334 169.898 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 44' ' ' LYS . . . . . . . . . . . . 0.32 7.4 mmpt? 70.41 150.47 0.13 Allowed Pre-proline 0 CA--C 1.582 2.185 0 N-CA-C 118.135 2.643 . . . . 0.0 118.135 179.304 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 28.2 Cg_endo -99.44 138.31 0.3 Allowed 'Trans proline' 0 C--N 1.377 2.076 0 N-CA-C 118.515 2.467 . . . . 0.0 118.515 -168.197 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 46' ' ' SER . . . . . . . . . . . . . 74.5 m -97.22 -47.96 0.23 Allowed Pre-proline 0 CA--C 1.576 1.963 0 CA-C-O 115.627 -2.13 . . . . 0.0 113.256 141.823 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 67.5 Cg_exo -61.04 76.85 0.08 OUTLIER 'Trans proline' 0 CA--C 1.57 2.31 0 CA-C-N 124.979 2.814 . . . . 0.0 117.679 166.789 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 48' ' ' VAL . . . . . . . . . . . . 0.251 27.9 m -88.9 -27.19 5.39 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.137 0 N-CA-C 118.756 2.873 . . . . 0.0 118.756 -179.223 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 49' ' ' THR . . . . . . . . . . . . . 87.0 m -117.95 100.51 7.61 Favored 'General case' 0 CA--C 1.568 1.662 2 O-C-N 113.148 -5.97 . . . . 0.0 106.938 -22.041 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 50' ' ' GLY . . . . . . . . . . . . . . . 78.84 6.05 88.61 Favored Glycine 0 N--CA 1.497 2.758 0 N-CA-C 120.706 3.042 . . . . 0.0 120.706 -171.316 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 51' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -75.17 -36.66 61.48 Favored 'General case' 0 CA--C 1.584 2.263 0 CA-C-N 121.43 2.615 . . . . 0.0 117.27 -170.902 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 52' ' ' ARG . . . . . . . . . . . . 0.304 48.2 ttt180 -162.1 -88.28 0.03 OUTLIER 'General case' 0 CA--C 1.591 2.555 0 C-N-CA 125.488 1.515 . . . . 0.0 112.129 169.784 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 53' ' ' ASN . . . . . 0.506 ' C ' ' HB3' ' B' ' 55' ' ' ALA . 0.5 OUTLIER -169.12 -167.47 0.73 Allowed 'General case' 0 N--CA 1.503 2.194 2 O-C-N 111.373 -7.079 . . . . 0.0 116.739 3.512 . . . . . . . . 4 4 . 1 . 008 nuclear nobuild full ' B' B ' 54' ' ' ASP . . . . . 0.674 ' HB2' ' HB2' ' A' ' 53' ' ' ASN 0.63 1.2 m-20 -132.45 48.42 2.42 Favored 'General case' 0 CA--C 1.575 1.928 0 CA-C-O 127.207 3.384 . . . . 0.0 118.225 -148.355 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 55' ' ' ALA . . . . . 0.623 ' HB3' ' N ' ' B' ' 54' ' ' ASP 0.527 . . 47.29 -88.2 0.01 OUTLIER 'General case' 0 CA--C 1.571 1.759 2 O-C-N 109.157 -8.464 . . . . 0.0 122.205 41.741 . . . . . . . . 4 3 . 1 . 008 nuclear nobuild full ' B' B ' 56' ' ' GLU . . . . . 0.802 ' O ' ' HB3' ' B' ' 59' ' ' ALA . 42.0 mt-10 -41.47 -22.15 0.02 OUTLIER 'General case' 0 N--CA 1.51 2.536 0 N-CA-C 119.339 3.088 . . . . 0.0 119.339 139.441 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 57' ' ' ARG . . . . . 0.588 ' HE ' ' HA ' ' A' ' 51' ' ' TYR 0.396 1.2 mpt_? -101.28 -8.53 22.05 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 117.069 -3.519 . . . . 0.0 113.203 177.782 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 58' ' ' LEU . . . . . 0.524 ' HA ' ' H ' ' B' ' 61' ' ' GLU 0.556 4.0 mp -83.18 -5.35 59.09 Favored 'General case' 0 CA--C 1.603 3.005 0 O-C-N 119.289 -2.132 . . . . 0.0 116.555 144.987 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 59' ' ' ALA . . . . . 0.802 ' HB3' ' O ' ' B' ' 56' ' ' GLU . . . -45.28 -46.72 12.84 Favored 'General case' 0 N--CA 1.518 2.947 0 O-C-N 117.074 -3.517 . . . . 0.0 115.033 131.193 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -79.4 -8.27 58.98 Favored 'General case' 0 N--CA 1.496 1.874 0 N-CA-C 119.163 3.024 . . . . 0.0 119.163 175.915 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 61' ' ' GLU . . . . . 0.524 ' H ' ' HA ' ' B' ' 58' ' ' LEU . 10.4 tm-20 -56.15 -55.58 31.32 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.027 -1.046 . . . . 0.0 111.782 145.538 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 62' ' ' GLN . . . . . 0.63 ' O ' HG13 ' B' ' 66' ' ' VAL 0.311 4.8 tp60 -54.46 -46.86 73.43 Favored 'General case' 0 CA--C 1.574 1.867 0 N-CA-C 116.074 1.879 . . . . 0.0 116.074 167.479 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 21.6 m -36.32 -59.09 0.66 Allowed 'General case' 0 N--CA 1.511 2.584 0 N-CA-C 118.483 2.772 . . . . 0.0 118.483 166.106 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 64' ' ' GLU . . . . . . . . . . . . 0.416 8.9 mt-10 -87.23 10.28 17.54 Favored 'General case' 0 CA--C 1.573 1.865 0 N-CA-C 113.099 0.777 . . . . 0.0 113.099 -175.171 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 65' ' ' LEU . . . . . 0.515 HD22 ' HA ' ' B' ' 62' ' ' GLN . 0.0 OUTLIER -88.08 -55.01 3.93 Favored 'General case' 0 CA--C 1.58 2.123 0 C-N-CA 125.151 1.38 . . . . 0.0 113.844 143.218 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 66' ' ' VAL . . . . . 0.63 HG13 ' O ' ' B' ' 62' ' ' GLN 0.427 11.2 m . . . . . 0 N--CA 1.515 2.788 0 N-CA-C 118.435 2.754 . . . . 0.0 118.435 -161.344 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.561 1.404 0 N-CA-C 113.703 1.001 . . . . 0.0 113.703 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 18.5 mmm180 -89.06 80.87 6.91 Favored 'General case' 0 N--CA 1.493 1.715 0 CA-C-O 122.668 1.223 . . . . 0.0 113.373 -179.927 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 13.2 p-10 -111.24 47.46 1.0 Allowed 'General case' 0 CA--C 1.572 1.813 0 O-C-N 121.463 -0.773 . . . . 0.0 110.259 158.424 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 26.3 p-10 -139.99 67.98 34.72 Favored Pre-proline 0 CA--C 1.57 1.736 0 O-C-N 120.566 -1.334 . . . . 0.0 113.715 166.918 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 1.9 Cg_endo -109.55 173.51 0.07 OUTLIER 'Trans proline' 0 CA--C 1.556 1.619 0 C-N-CA 121.94 1.76 . . . . 0.0 112.964 -157.554 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . 0.268 1.8 p-80 -143.61 148.35 35.73 Favored 'General case' 0 N--CA 1.486 1.347 0 N-CA-C 118.173 2.657 . . . . 0.0 118.173 -144.581 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . 0.53 ' CZ ' HD23 ' B' ' 34' ' ' LEU . 25.5 p90 -131.71 166.18 22.08 Favored 'General case' 0 CA--C 1.561 1.393 0 CA-C-N 113.806 -1.543 . . . . 0.0 109.033 168.91 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 14.1 m120 -74.39 98.39 3.26 Favored 'General case' 0 CA--C 1.563 1.467 0 O-C-N 119.641 -1.912 . . . . 0.0 110.872 162.67 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . 0.436 ' HD2' HD11 ' A' ' 34' ' ' LEU . 3.6 t80 -69.97 157.61 37.15 Favored 'General case' 0 CA--C 1.568 1.662 0 CA-C-O 124.26 1.981 . . . . 0.0 109.873 147.283 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 12.3 tpt180 169.27 87.34 0.0 OUTLIER 'General case' 0 N--CA 1.502 2.137 0 O-C-N 119.264 -2.147 . . . . 0.0 106.904 -124.283 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -136.79 121.7 12.79 Favored Pre-proline 0 CA--C 1.575 1.909 0 CA-C-O 117.248 -1.358 . . . . 0.0 112.886 -149.172 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 98.9 Cg_exo -43.26 150.91 0.35 Allowed 'Trans proline' 0 C--N 1.379 2.142 0 C-N-CA 123.875 3.05 . . . . 0.0 118.969 -179.904 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -50.94 -40.19 56.72 Favored 'General case' 0 N--CA 1.499 1.994 0 N-CA-C 117.983 2.586 . . . . 0.0 117.983 -165.805 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 9.6 pt-20 -63.37 -43.25 98.15 Favored 'General case' 0 CA--C 1.564 1.492 0 N-CA-C 116.287 1.958 . . . . 0.0 116.287 165.428 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.429 ' CG1' HG12 ' B' ' 38' ' ' VAL . 1.2 t -59.96 -48.91 86.0 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.064 0 CA-C-N 123.002 2.637 . . . . 0.0 112.637 172.457 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 3.4 ttt180 -69.7 -41.29 75.59 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-N 121.13 1.786 . . . . 0.0 115.797 174.111 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -60.91 -37.68 83.08 Favored 'General case' 0 CA--C 1.565 1.543 0 CA-C-N 123.289 2.768 . . . . 0.0 114.378 166.237 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 48.4 mtmt -62.47 -62.76 1.53 Allowed 'General case' 0 CA--C 1.564 1.488 0 CA-C-N 121.229 1.832 . . . . 0.0 114.481 166.7 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.541 HD21 ' HG ' ' A' ' 34' ' ' LEU . 12.5 tp -56.89 -36.19 69.84 Favored 'General case' 0 N--CA 1.491 1.578 0 N-CA-C 115.855 1.798 . . . . 0.0 115.855 176.319 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 12.1 ttpt -89.29 -27.85 20.28 Favored 'General case' 0 CA--C 1.568 1.656 0 C-N-CA 125.143 1.377 . . . . 0.0 114.046 179.081 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . 0.416 ' O ' ' HB3' ' A' ' 25' ' ' ALA . 13.2 m-30 -65.31 -70.67 0.22 Allowed 'General case' 0 N--CA 1.493 1.681 0 CA-C-O 115.103 -2.38 . . . . 0.0 110.926 156.887 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.574 ' HE ' HD12 ' A' ' 37' ' ' ILE 0.35 0.0 OUTLIER -23.55 -47.71 0.01 OUTLIER 'General case' 0 CA--C 1.6 2.869 0 CA-C-N 124.631 3.378 . . . . 0.0 115.102 163.794 . . . . . . . . 4 4 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.407 ' HB2' ' CB ' ' A' ' 33' ' ' GLU . . . -57.94 -76.96 0.03 OUTLIER 'General case' 0 CA--C 1.587 2.377 0 N-CA-C 117.61 2.448 . . . . 0.0 117.61 156.726 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -63.45 -45.62 90.02 Favored 'General case' 0 N--CA 1.503 2.198 0 N-CA-C 118.948 2.944 . . . . 0.0 118.948 179.102 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.416 ' HB3' ' O ' ' A' ' 21' ' ' PHE . . . -40.02 -51.67 2.53 Favored 'General case' 0 CA--C 1.589 2.449 0 N-CA-C 116.523 2.045 . . . . 0.0 116.523 159.055 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 91.0 m-20 -82.02 -47.61 12.43 Favored 'General case' 0 N--CA 1.499 2.019 0 N-CA-C 116.238 1.94 . . . . 0.0 116.238 176.356 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 116.23 37.03 1.05 Allowed Glycine 0 CA--C 1.56 2.853 0 N-CA-C 117.776 1.87 . . . . 0.0 117.776 -156.834 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 29.1 mtm-85 -126.3 161.02 28.74 Favored 'General case' 0 CA--C 1.569 1.689 0 N-CA-C 106.532 -1.655 . . . . 0.0 106.532 168.211 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 38.1 t -119.6 115.0 23.09 Favored 'General case' 0 N--CA 1.501 2.105 0 O-C-N 118.842 -2.411 . . . . 0.0 105.411 -177.681 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 22.7 mtp -43.72 -40.93 4.54 Favored 'General case' 0 N--CA 1.5 2.068 0 N-CA-C 119.109 3.003 . . . . 0.0 119.109 -146.175 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -46.17 -44.63 16.14 Favored 'General case' 0 CA--C 1.601 2.906 0 CA-C-N 125.683 3.856 . . . . 0.0 115.371 163.721 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . 0.356 28.7 t -49.07 -75.59 0.03 OUTLIER 'General case' 0 N--CA 1.503 2.191 0 N-CA-C 118.338 2.718 . . . . 0.0 118.338 143.608 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . 0.407 ' CB ' ' HB2' ' A' ' 23' ' ' ALA . 10.4 tp10 -60.6 -55.01 38.45 Favored 'General case' 0 N--CA 1.516 2.87 0 CA-C-N 124.217 3.19 . . . . 0.0 116.191 -173.208 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.788 HD12 ' CZ ' ' B' ' 7' ' ' PHE . 0.1 OUTLIER -39.88 -53.9 2.23 Favored 'General case' 0 CA--C 1.55 0.972 0 CA-C-O 115.805 -2.045 . . . . 0.0 108.3 167.481 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.428 HD23 ' HA ' ' A' ' 35' ' ' LEU . 13.1 mt -61.1 -47.24 87.21 Favored 'General case' 0 N--CA 1.486 1.348 0 CA-C-N 123.263 2.756 . . . . 0.0 115.913 174.75 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.56 -44.71 93.21 Favored 'General case' 0 N--CA 1.479 0.989 0 CA-C-O 116.748 -1.596 . . . . 0.0 114.269 177.472 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . 0.574 HD12 ' HE ' ' A' ' 22' ' ' ARG . 3.8 tt -69.94 -32.68 52.46 Favored 'Isoleucine or valine' 0 C--O 1.199 -1.598 0 CA-C-O 114.989 -2.434 . . . . 0.0 114.719 166.168 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.478 HG21 HD22 ' A' ' 34' ' ' LEU . 3.0 t -78.21 -48.36 23.09 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.179 0 CA-C-N 123.581 2.9 . . . . 0.0 112.156 -174.435 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 27.2 mt-30 -49.4 -46.15 47.03 Favored 'General case' 0 CA--C 1.563 1.462 0 C-N-CA 123.77 0.828 . . . . 0.0 112.153 154.507 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . 0.422 3.9 t0 -51.55 -41.65 61.25 Favored 'General case' 0 N--CA 1.488 1.439 0 N-CA-C 118.913 2.931 . . . . 0.0 118.913 158.444 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . 0.275 . . -87.24 -40.73 14.27 Favored 'General case' 0 N--CA 1.479 0.978 0 N-CA-C 115.465 1.654 . . . . 0.0 115.465 -155.494 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 2.1 pp -94.79 -25.4 16.67 Favored 'General case' 0 CA--C 1.565 1.526 0 N-CA-C 117.471 2.397 . . . . 0.0 117.471 160.632 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 16.2 t -106.8 -13.29 15.29 Favored 'General case' 0 N--CA 1.495 1.781 0 CA-C-N 122.754 2.525 . . . . 0.0 116.208 -177.734 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . 0.549 ' HB3' ' HE ' ' B' ' 57' ' ' ARG . 42.6 mttt -119.93 61.47 7.35 Favored Pre-proline 0 N--CA 1.489 1.504 0 CA-C-N 120.921 1.691 . . . . 0.0 108.34 163.067 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 64.8 Cg_endo -88.26 100.9 0.42 Allowed 'Trans proline' 0 CA--C 1.572 2.385 0 N-CA-C 120.18 3.108 . . . . 0.0 120.18 75.414 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 58.0 m -107.78 116.56 57.18 Favored Pre-proline 0 CA--C 1.577 2.018 0 CA-C-O 117.662 -1.161 . . . . 0.0 108.292 152.037 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . 0.271 4.7 Cg_exo -17.6 74.23 0.0 OUTLIER 'Trans proline' 0 CA--C 1.573 2.446 1 N-CA-C 126.164 5.409 . . . . 0.0 126.164 -156.977 . . . . . . . . 3 2 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . 0.42 29.2 t 76.84 -67.02 0.17 Allowed 'Isoleucine or valine' 0 N--CA 1.504 2.262 0 N-CA-C 115.427 1.64 . . . . 0.0 115.427 167.794 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . 0.339 5.5 p 74.85 58.85 0.07 Allowed 'General case' 0 CA--C 1.58 2.101 0 CA-C-O 122.469 1.128 . . . . 0.0 112.172 -172.401 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 79.19 -63.59 3.87 Favored Glycine 0 N--CA 1.498 2.824 0 N-CA-C 119.21 2.444 . . . . 0.0 119.21 -172.874 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -94.09 53.98 1.84 Allowed 'General case' 0 CA--C 1.583 2.239 0 N-CA-C 119.002 2.964 . . . . 0.0 119.002 -156.15 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 81.9 mtt85 50.37 93.13 0.02 OUTLIER 'General case' 0 N--CA 1.509 2.519 0 N-CA-C 118.529 2.789 . . . . 0.0 118.529 160.304 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . 0.89 HD22 ' H ' ' A' ' 55' ' ' ALA 0.308 3.1 p-10 -170.15 -92.86 0.01 OUTLIER 'General case' 0 N--CA 1.511 2.588 0 CA-C-O 116.311 -1.805 . . . . 0.0 112.975 -161.541 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . 0.405 ' O ' ' HB2' ' A' ' 57' ' ' ARG 1.832 56.3 m-20 65.23 2.14 1.79 Allowed 'General case' 0 N--CA 1.521 3.107 1 N-CA-C 123.205 4.521 . . . . 0.0 123.205 -129.834 . . . . . . . . 4 3 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . 0.89 ' H ' HD22 ' A' ' 53' ' ' ASN . . . 25.1 85.55 0.01 OUTLIER 'General case' 0 CA--C 1.502 -0.88 0 CA-C-N 111.333 -2.667 . . . . 0.0 118.198 -134.212 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.433 ' HG2' ' H ' ' B' ' 54' ' ' ASP 1.321 1.8 pt-20 109.47 3.49 0.01 OUTLIER 'General case' 0 CA--C 1.591 2.541 3 N-CA-C 129.523 6.86 . . . . 0.0 129.523 155.826 . . . . . . . . 4 3 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.645 ' CB ' ' HB3' ' A' ' 59' ' ' ALA 2.457 0.0 OUTLIER 9.8 73.16 0.01 OUTLIER 'General case' 0 CA--C 1.609 3.218 2 CA-C-N 102.222 -6.808 . . . . 0.0 113.326 -95.579 . . . . . . . . 5 4 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.51 HD23 ' H ' ' A' ' 59' ' ' ALA . 0.3 OUTLIER -53.01 -41.24 64.46 Favored 'General case' 0 N--CA 1.536 3.83 1 O-C-N 114.921 -4.862 . . . . 0.0 109.918 172.083 . . . . . . . . 4 4 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . 0.645 ' HB3' ' CB ' ' A' ' 57' ' ' ARG 0.271 . . -18.75 -77.08 0.01 OUTLIER 'General case' 0 CA--C 1.575 1.935 2 CA-C-N 105.998 -5.092 . . . . 0.0 123.59 132.212 . . . . . . . . 4 3 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.525 ' H ' ' C ' ' A' ' 57' ' ' ARG . 6.0 m-20 -124.12 -6.32 7.79 Favored 'General case' 0 CA--C 1.559 1.293 0 CA-C-N 121.872 2.124 . . . . 0.0 113.026 -159.46 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . 2.012 36.9 mt-10 -25.85 -83.06 0.01 OUTLIER 'General case' 0 CA--C 1.55 0.967 0 N-CA-C 120.409 3.485 . . . . 0.0 120.409 116.116 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . 0.657 ' O ' HG13 ' A' ' 66' ' ' VAL . 9.5 tp60 -88.09 -55.69 3.64 Favored 'General case' 0 C--N 1.36 1.023 0 C-N-CA 119.269 -0.972 . . . . 0.0 110.575 -161.158 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . 0.272 66.0 p -82.04 52.54 2.0 Allowed 'General case' 0 CA--C 1.56 1.343 0 N-CA-C 115.023 1.49 . . . . 0.0 115.023 152.878 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 30.0 tt0 -97.42 -59.43 1.78 Allowed 'General case' 0 CA--C 1.562 1.427 0 O-C-N 118.842 -2.411 . . . . 0.0 111.709 104.91 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . 0.288 2.2 mp -94.22 49.64 1.32 Allowed 'General case' 0 N--CA 1.502 2.142 0 CA-C-O 124.02 1.867 . . . . 0.0 114.974 -162.965 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.657 HG13 ' O ' ' A' ' 62' ' ' GLN . 2.2 m . . . . . 0 N--CA 1.5 2.065 0 CA-C-N 112.737 -2.028 . . . . 0.0 113.203 173.414 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 1.525 0 N-CA-C 117.616 2.45 . . . . 0.0 117.616 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 2' ' ' ARG . . . . . . . . . . . . 0.336 79.3 mtt180 67.8 52.04 0.75 Allowed 'General case' 0 N--CA 1.494 1.744 0 N-CA-C 117.131 2.271 . . . . 0.0 117.131 174.056 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 43.4 m-20 -95.49 63.95 2.55 Favored 'General case' 0 CA--C 1.571 1.768 0 O-C-N 120.787 -1.195 . . . . 0.0 108.177 147.567 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 4' ' ' ASP . . . . . . . . . . . . . 3.6 p-10 -162.6 90.07 1.32 Allowed Pre-proline 0 CA--C 1.57 1.73 0 C-N-CA 124.851 1.26 . . . . 0.0 108.13 -176.522 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 7.2 Cg_exo -91.58 140.43 2.5 Favored 'Trans proline' 0 CA--C 1.552 1.379 0 CA-C-N 123.533 2.298 . . . . 0.0 113.183 -159.981 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 6' ' ' HIS . . . . . . . . . . . . . 67.5 m80 -72.29 128.13 34.69 Favored 'General case' 0 CA--C 1.575 1.923 0 CA-C-N 114.852 -1.067 . . . . 0.0 111.784 173.008 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 7' ' ' PHE . . . . . 0.788 ' CZ ' HD12 ' A' ' 34' ' ' LEU 0.252 2.5 p90 -131.92 149.47 52.43 Favored 'General case' 0 CA--C 1.565 1.529 0 O-C-N 119.882 -1.761 . . . . 0.0 111.036 147.877 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 8' ' ' ASN . . . . . . . . . . . . . 12.9 m120 -71.86 84.69 0.94 Allowed 'General case' 0 N--CA 1.491 1.606 0 O-C-N 120.521 -1.362 . . . . 0.0 112.234 176.727 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 9' ' ' PHE . . . . . 0.673 ' CD2' HD13 ' A' ' 34' ' ' LEU . 9.0 t80 -81.23 149.75 28.9 Favored 'General case' 0 CA--C 1.561 1.374 0 CA-C-O 126.151 2.881 . . . . 0.0 111.306 171.033 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 10' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -172.6 112.5 0.26 Allowed 'General case' 0 C--N 1.307 -1.243 0 CA-C-N 111.5 -2.591 . . . . 0.0 105.54 -129.351 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 11' ' ' MET . . . . . 0.408 ' SD ' ' CD2' ' B' ' 9' ' ' PHE . 0.9 OUTLIER -133.71 117.91 14.31 Favored Pre-proline 0 CA--C 1.564 1.487 0 CA-C-O 117.375 -1.298 . . . . 0.0 110.032 -153.176 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 12' ' ' PRO . . . . . . . . . . . . . 76.1 Cg_exo -42.92 145.59 1.09 Allowed 'Trans proline' 0 C--N 1.374 1.869 0 C-N-CA 123.249 2.633 . . . . 0.0 116.1 163.886 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 13' ' ' MET . . . . . . . . . . . . . 3.5 tpt -51.56 -41.18 60.94 Favored 'General case' 0 N--CA 1.494 1.736 0 N-CA-C 118.551 2.797 . . . . 0.0 118.551 -154.632 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -63.39 -43.29 98.0 Favored 'General case' 0 CA--C 1.563 1.457 0 N-CA-C 116.722 2.119 . . . . 0.0 116.722 166.708 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -57.43 -47.25 85.22 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.39 0 CA-C-N 124.394 3.27 . . . . 0.0 112.951 172.576 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 1.9 ttt180 -75.13 -37.84 61.26 Favored 'General case' 0 N--CA 1.475 0.818 0 CA-C-O 116.6 -1.666 . . . . 0.0 115.236 176.381 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 17' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -61.74 -37.37 83.99 Favored 'General case' 0 CA--C 1.569 1.676 0 CA-C-N 123.12 2.691 . . . . 0.0 114.056 163.405 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . 0.269 43.2 mtmt -66.3 -49.93 65.36 Favored 'General case' 0 CA--C 1.563 1.461 0 CA-C-N 122.018 2.19 . . . . 0.0 115.112 170.416 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 19' ' ' LEU . . . . . 0.53 HD21 HD22 ' B' ' 34' ' ' LEU 0.27 11.8 tp -70.12 -39.22 75.59 Favored 'General case' 0 N--CA 1.487 1.391 0 C-N-CA 124.98 1.312 . . . . 0.0 114.526 176.374 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 20' ' ' LYS . . . . . 0.402 ' HB2' ' SD ' ' B' ' 30' ' ' MET . 13.4 ttpt -84.92 -28.6 25.81 Favored 'General case' 0 CA--C 1.565 1.525 0 CA-C-O 117.423 -1.275 . . . . 0.0 114.271 177.597 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 18.5 m-30 -67.03 -70.72 0.23 Allowed 'General case' 0 N--CA 1.492 1.644 0 CA-C-O 113.093 -3.337 . . . . 0.0 109.945 160.337 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . 0.275 37.2 ttt85 -20.26 -53.78 0.02 OUTLIER 'General case' 0 CA--C 1.587 2.391 1 CA-C-N 126.284 4.129 . . . . 0.0 116.372 165.399 . . . . . . . . 3 2 . 1 . 009 nuclear nobuild full ' B' B ' 23' ' ' ALA . . . . . 0.494 ' HB2' ' CB ' ' B' ' 33' ' ' GLU . . . -54.32 -79.53 0.02 OUTLIER 'General case' 0 CA--C 1.588 2.438 0 N-CA-C 117.288 2.329 . . . . 0.0 117.288 159.023 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 66.7 mm-40 -71.49 -32.58 68.4 Favored 'General case' 0 CA--C 1.575 1.934 0 N-CA-C 119.361 3.097 . . . . 0.0 119.361 -176.41 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 25' ' ' ALA . . . . . . . . . . . . . . . -41.56 -49.99 4.05 Favored 'General case' 0 CA--C 1.58 2.1 0 N-CA-C 116.549 2.055 . . . . 0.0 116.549 153.131 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 26' ' ' ASN . . . . . . . . . . . . 0.264 0.0 OUTLIER -107.6 -42.27 4.81 Favored 'General case' 0 CA--C 1.576 1.972 0 N-CA-C 116.09 1.885 . . . . 0.0 116.09 -163.975 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 27' ' ' GLY . . . . . . . . . . . . . . . 134.27 12.24 1.46 Allowed Glycine 0 N--CA 1.498 2.824 0 N-CA-C 119.232 2.453 . . . . 0.0 119.232 -167.097 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 28' ' ' ARG . . . . . 0.408 ' HE ' ' HG2' ' B' ' 33' ' ' GLU . 72.4 mtm-85 -111.35 165.75 11.69 Favored 'General case' 0 CA--C 1.575 1.922 0 CA-C-N 120.39 2.095 . . . . 0.0 105.424 168.087 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 29' ' ' SER . . . . . . . . . . . . . 8.8 t -133.7 113.62 12.54 Favored 'General case' 0 N--CA 1.506 2.361 0 O-C-N 117.103 -3.498 . . . . 0.0 107.129 -177.247 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 30' ' ' MET . . . . . 0.402 ' SD ' ' HB2' ' B' ' 20' ' ' LYS . 25.6 mtp -44.8 -34.46 2.32 Favored 'General case' 0 N--CA 1.5 2.029 0 N-CA-C 121.338 3.829 . . . . 0.0 121.338 -139.533 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 31' ' ' ASN . . . . . . . . . . . . 0.26 8.8 t-20 -49.75 -49.64 47.42 Favored 'General case' 0 CA--C 1.591 2.543 0 O-C-N 118.572 -2.58 . . . . 0.0 113.882 161.318 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 32' ' ' SER . . . . . . . . . . . . 0.29 27.6 t -49.43 -64.26 0.86 Allowed 'General case' 0 N--CA 1.501 2.115 0 N-CA-C 119.649 3.203 . . . . 0.0 119.649 146.955 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 33' ' ' GLU . . . . . 0.494 ' CB ' ' HB2' ' B' ' 23' ' ' ALA . 0.0 OUTLIER -67.55 -60.47 2.53 Favored 'General case' 0 N--CA 1.516 2.863 0 CA-C-N 123.45 2.841 . . . . 0.0 116.156 -176.449 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 34' ' ' LEU . . . . . 0.53 HD23 ' CZ ' ' A' ' 7' ' ' PHE 0.543 0.1 OUTLIER -49.06 -37.06 19.83 Favored 'General case' 0 CA--C 1.563 1.48 0 CA-C-O 114.184 -2.817 . . . . 0.0 108.207 172.009 . . . . . . . . 4 4 . 1 . 009 nuclear nobuild full ' B' B ' 35' ' ' LEU . . . . . 0.405 ' HA ' HD23 ' B' ' 35' ' ' LEU . 13.9 mt -64.67 -56.73 11.92 Favored 'General case' 0 N--CA 1.491 1.613 1 CA-C-N 126.158 4.072 . . . . 0.0 115.725 167.559 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 36' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -50.64 -40.26 52.78 Favored 'General case' 0 CA--C 1.58 2.101 0 N-CA-C 115.784 1.772 . . . . 0.0 115.784 175.734 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 37' ' ' ILE . . . . . 0.423 ' HA ' ' HB3' ' B' ' 40' ' ' ASP . 0.5 OUTLIER -74.03 -35.62 42.28 Favored 'Isoleucine or valine' 0 CA--C 1.571 1.762 0 N-CA-C 116.164 1.913 . . . . 0.0 116.164 166.47 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 38' ' ' VAL . . . . . 0.518 ' HA ' ' HB3' ' B' ' 41' ' ' ALA . 3.3 t -72.5 -46.76 54.47 Favored 'Isoleucine or valine' 0 CA--C 1.575 1.941 0 O-C-N 119.041 -2.287 . . . . 0.0 110.796 177.699 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 23.7 mt-30 -51.38 -40.85 60.06 Favored 'General case' 0 CA--C 1.562 1.427 0 N-CA-C 114.539 1.311 . . . . 0.0 114.539 155.517 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 40' ' ' ASP . . . . . 0.423 ' HB3' ' HA ' ' B' ' 37' ' ' ILE . 44.8 t0 -53.32 -47.71 69.07 Favored 'General case' 0 N--CA 1.492 1.634 0 N-CA-C 116.518 2.044 . . . . 0.0 116.518 156.102 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 41' ' ' ALA . . . . . 0.518 ' HB3' ' HA ' ' B' ' 38' ' ' VAL 0.263 . . -69.6 -26.86 64.65 Favored 'General case' 0 CA--C 1.564 1.514 0 N-CA-C 117.462 2.393 . . . . 0.0 117.462 -174.618 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -110.31 -34.06 6.46 Favored 'General case' 0 CA--C 1.573 1.856 0 C-N-CA 124.687 1.195 . . . . 0.0 112.993 175.356 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 43' ' ' SER . . . . . . . . . . . . . 7.5 t -84.49 32.93 0.5 Allowed 'General case' 0 N--CA 1.505 2.323 0 N-CA-C 116.783 2.142 . . . . 0.0 116.783 164.134 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 44' ' ' LYS . . . . . . . . . . . . . 30.8 mtpp -41.35 -24.87 0.15 Allowed Pre-proline 0 CA--C 1.599 2.836 1 N-CA-C 127.404 6.076 . . . . 0.0 127.404 145.325 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 0.3 OUTLIER -44.25 169.4 0.03 OUTLIER 'Trans proline' 0 CA--C 1.564 1.994 1 N-CA-C 125.751 5.25 . . . . 0.0 125.751 -162.731 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 46' ' ' SER . . . . . . . . . . . . . 86.4 p -84.94 118.09 70.19 Favored Pre-proline 0 CA--C 1.58 2.101 0 CA-C-O 116.585 -1.674 . . . . 0.0 112.777 162.408 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_endo -103.57 115.24 0.42 Allowed 'Cis proline' 0 CA--C 1.571 2.355 0 CA-C-N 124.766 2.738 . . . . 0.0 116.088 -0.974 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 48' ' ' VAL . . . . . 0.526 HG13 HG22 ' B' ' 49' ' ' THR . 7.7 p -74.81 -37.55 42.44 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.26 0 O-C-N 120.409 -1.432 . . . . 0.0 113.988 143.453 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 49' ' ' THR . . . . . 0.526 HG22 HG13 ' B' ' 48' ' ' VAL . 5.4 t -159.69 -174.97 4.89 Favored 'General case' 0 CA--C 1.572 1.823 0 CA-C-O 124.086 1.898 . . . . 0.0 115.178 -143.649 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 50' ' ' GLY . . . . . . . . . . . . . . . -92.5 -47.48 3.23 Favored Glycine 0 N--CA 1.495 2.632 0 CA-C-N 112.748 -2.024 . . . . 0.0 117.368 163.526 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 51' ' ' TYR . . . . . . . . . . . . 0.3 0.0 OUTLIER -65.7 88.25 0.1 Allowed 'General case' 0 CA--C 1.584 2.265 0 CA-C-N 119.339 1.569 . . . . 0.0 113.768 170.281 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 52' ' ' ARG . . . . . . . . . . . . . 4.0 tpm_? -87.3 94.0 9.55 Favored 'General case' 0 CA--C 1.576 1.945 0 N-CA-C 114.758 1.392 . . . . 0.0 114.758 -166.714 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 53' ' ' ASN . . . . . 0.47 ' HA ' ' H ' ' B' ' 55' ' ' ALA . 0.7 OUTLIER -154.04 -149.22 0.27 Allowed 'General case' 0 CA--C 1.61 3.258 0 N-CA-C 107.238 -1.393 . . . . 0.0 107.238 -158.073 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 54' ' ' ASP . . . . . 0.434 ' HA ' ' HB1' ' A' ' 55' ' ' ALA . 0.5 OUTLIER 53.61 -71.84 0.01 OUTLIER 'General case' 0 N--CA 1.497 1.901 2 O-C-N 111.184 -7.198 . . . . 0.0 113.909 -66.912 . . . . . . . . 4 4 . 1 . 009 nuclear nobuild full ' B' B ' 55' ' ' ALA . . . . . 0.648 ' HA ' ' HB2' ' B' ' 56' ' ' GLU 2.367 . . 111.12 -150.94 0.0 OUTLIER 'General case' 0 N--CA 1.384 -3.726 2 CA-C-O 130.374 4.892 . . . . 0.0 99.549 -156.152 . . . . . . . . 4 3 . 1 . 009 nuclear nobuild full ' B' B ' 56' ' ' GLU . . . . . 0.648 ' HB2' ' HA ' ' B' ' 55' ' ' ALA 0.373 22.4 mt-10 64.54 -53.43 0.29 Allowed 'General case' 0 C--N 1.249 -3.782 1 O-C-N 98.075 -15.391 . . . . 0.0 118.614 24.049 . . . . . . . . 4 3 . 1 . 009 nuclear nobuild full ' B' B ' 57' ' ' ARG . . . . . 0.549 ' HE ' ' HB3' ' A' ' 44' ' ' LYS . 0.0 OUTLIER -103.81 -54.96 2.47 Favored 'General case' 0 N--CA 1.485 1.311 0 CA-C-N 124.159 3.163 . . . . 0.0 118.151 -176.156 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 58' ' ' LEU . . . . . 0.423 ' CB ' ' HB3' ' B' ' 54' ' ' ASP 0.403 0.2 OUTLIER -66.88 -16.96 64.66 Favored 'General case' 0 CA--C 1.577 2.003 0 CA-C-O 115.81 -2.043 . . . . 0.0 113.328 157.526 . . . . . . . . 4 4 . 1 . 009 nuclear nobuild full ' B' B ' 59' ' ' ALA . . . . . . . . . . . . . . . -48.82 -60.56 2.64 Favored 'General case' 0 C--N 1.379 1.861 0 CA-C-N 123.54 2.882 . . . . 0.0 118.104 147.041 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -125.23 -16.97 5.81 Favored 'General case' 0 N--CA 1.486 1.359 0 N-CA-C 114.947 1.462 . . . . 0.0 114.947 -151.943 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 61' ' ' GLU . . . . . . . . . . . . 0.286 0.5 OUTLIER -68.47 -21.3 64.63 Favored 'General case' 0 CA--C 1.559 1.299 0 CA-C-O 112.293 -3.717 . . . . 0.0 113.699 138.143 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 62' ' ' GLN . . . . . 0.662 ' O ' HG13 ' B' ' 66' ' ' VAL 0.271 4.0 tp60 -75.36 -89.16 0.03 OUTLIER 'General case' 0 C--N 1.394 2.519 1 CA-C-N 127.552 4.706 . . . . 0.0 110.445 161.115 . . . . . . . . 4 3 . 1 . 009 nuclear nobuild full ' B' B ' 63' ' ' SER . . . . . . . . . . . . 0.406 35.9 t -88.0 49.18 1.75 Allowed 'General case' 0 CA--C 1.557 1.219 0 N-CA-C 116.591 2.071 . . . . 0.0 116.591 179.412 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 64' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -119.01 -21.33 7.73 Favored 'General case' 0 CA--C 1.575 1.924 0 CA-C-O 114.476 -2.678 . . . . 0.0 115.491 112.442 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 65' ' ' LEU . . . . . . . . . . . . 0.319 3.5 mt -109.49 50.06 0.8 Allowed 'General case' 0 N--CA 1.512 2.673 1 CA-C-N 126.8 4.363 . . . . 0.0 113.522 -178.872 . . . . . . . . 3 2 . 1 . 009 nuclear nobuild full ' B' B ' 66' ' ' VAL . . . . . 0.662 HG13 ' O ' ' B' ' 62' ' ' GLN . 2.4 m . . . . . 0 N--CA 1.495 1.776 0 CA-C-N 111.59 -2.55 . . . . 0.0 112.961 175.359 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.56 1.344 0 N-CA-C 113.627 0.973 . . . . 0.0 113.627 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -79.87 77.73 6.51 Favored 'General case' 0 N--CA 1.496 1.834 0 CA-C-O 122.764 1.268 . . . . 0.0 112.696 178.515 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -92.02 77.67 5.35 Favored 'General case' 0 N--CA 1.49 1.56 0 N-CA-C 107.068 -1.456 . . . . 0.0 107.068 171.053 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 2.1 p30 -159.6 78.97 2.75 Favored Pre-proline 0 CA--C 1.568 1.67 0 CA-C-N 115.371 -0.831 . . . . 0.0 112.1 -172.341 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 3.7 Cg_exo -98.06 148.74 0.75 Allowed 'Trans proline' 0 CA--C 1.551 1.343 0 CA-C-N 122.363 1.88 . . . . 0.0 114.131 -155.246 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 80.8 m80 -84.9 130.42 34.65 Favored 'General case' 0 CA--C 1.566 1.577 0 CA-C-N 113.946 -1.479 . . . . 0.0 112.369 178.476 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . 0.482 ' CZ ' HD23 ' B' ' 34' ' ' LEU . 3.2 p90 -132.45 159.56 38.99 Favored 'General case' 0 CA--C 1.567 1.625 0 CA-C-O 122.704 1.24 . . . . 0.0 111.048 153.896 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 70.7 m-80 -66.18 101.73 0.75 Allowed 'General case' 0 CA--C 1.573 1.847 0 O-C-N 120.877 -1.14 . . . . 0.0 112.68 173.999 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . 0.457 ' CE1' ' HG ' ' B' ' 35' ' ' LEU . 5.2 t80 -120.18 110.08 16.19 Favored 'General case' 0 CA--C 1.547 0.838 0 N-CA-C 106.372 -1.714 . . . . 0.0 106.372 157.839 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . 0.383 0.0 OUTLIER 98.66 89.05 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.633 1 O-C-N 113.897 -5.502 . . . . 0.0 110.098 -17.654 . . . . . . . . 4 3 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . 0.496 ' SD ' ' HG3' ' A' ' 16' ' ' ARG . 1.6 mpt? -147.74 149.57 33.91 Favored Pre-proline 0 CA--C 1.567 1.632 0 CA-C-O 118.086 -0.959 . . . . 0.0 111.976 -170.237 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_exo -44.85 141.94 5.56 Favored 'Trans proline' 0 CA--C 1.567 2.155 0 C-N-CA 122.436 2.091 . . . . 0.0 115.989 154.783 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . 0.433 ' SD ' ' HG3' ' A' ' 17' ' ' GLU . 13.7 tpp -56.07 -27.79 54.96 Favored 'General case' 0 N--CA 1.496 1.847 0 N-CA-C 118.934 2.939 . . . . 0.0 118.934 -169.811 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 7.6 pt-20 -65.93 -47.62 74.12 Favored 'General case' 0 CA--C 1.57 1.712 0 N-CA-C 115.957 1.836 . . . . 0.0 115.957 165.304 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -60.37 -49.07 85.72 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.216 0 CA-C-N 122.263 2.301 . . . . 0.0 112.513 174.402 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . 0.496 ' HG3' ' SD ' ' A' ' 11' ' ' MET . 5.8 ttt180 -69.8 -33.11 71.91 Favored 'General case' 0 CA--C 1.548 0.894 0 CA-C-O 116.047 -1.93 . . . . 0.0 115.562 173.8 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.433 ' HG3' ' SD ' ' A' ' 13' ' ' MET . 37.1 mt-10 -60.19 -48.1 83.16 Favored 'General case' 0 N--CA 1.491 1.615 0 CA-C-N 123.941 3.064 . . . . 0.0 114.197 160.312 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.405 ' HB3' HD13 ' B' ' 42' ' ' LEU . 53.0 mtmt -61.89 -45.66 92.79 Favored 'General case' 0 CA--C 1.562 1.436 0 N-CA-C 116.134 1.902 . . . . 0.0 116.134 174.529 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.589 ' CD2' HD22 ' A' ' 34' ' ' LEU 0.258 14.0 tp -69.0 -40.55 78.65 Favored 'General case' 0 CA--C 1.565 1.544 0 N-CA-C 115.01 1.485 . . . . 0.0 115.01 172.195 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.453 ' HB2' ' SD ' ' A' ' 30' ' ' MET . 16.1 ttpt -85.22 -26.2 26.87 Favored 'General case' 0 CA--C 1.567 1.603 0 N-CA-C 114.259 1.207 . . . . 0.0 114.259 179.757 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . 0.42 ' O ' ' HB3' ' A' ' 25' ' ' ALA . 13.1 m-85 -61.94 -69.31 0.26 Allowed 'General case' 0 N--CA 1.49 1.554 0 CA-C-O 114.05 -2.881 . . . . 0.0 110.722 155.224 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . 0.304 1.9 ttt85 -23.22 -49.21 0.02 OUTLIER 'General case' 0 CA--C 1.598 2.8 0 CA-C-N 125.363 3.711 . . . . 0.0 116.53 163.406 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . 0.268 . . -58.13 -77.43 0.03 OUTLIER 'General case' 0 CA--C 1.59 2.502 0 N-CA-C 117.301 2.334 . . . . 0.0 117.301 158.482 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 87.9 mt-10 -61.01 -45.74 93.58 Favored 'General case' 0 N--CA 1.503 2.193 0 N-CA-C 118.774 2.879 . . . . 0.0 118.774 178.606 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.42 ' HB3' ' O ' ' A' ' 21' ' ' PHE . . . -40.87 -50.96 3.22 Favored 'General case' 0 CA--C 1.587 2.377 0 N-CA-C 116.429 2.011 . . . . 0.0 116.429 160.04 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 88.4 m-20 -84.02 -43.44 15.14 Favored 'General case' 0 N--CA 1.5 2.039 0 N-CA-C 116.63 2.085 . . . . 0.0 116.63 177.46 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 108.67 32.44 3.14 Favored Glycine 0 CA--C 1.56 2.864 0 N-CA-C 117.738 1.855 . . . . 0.0 117.738 -153.568 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 12.0 mtt85 -116.66 158.77 23.24 Favored 'General case' 0 CA--C 1.57 1.746 0 N-CA-C 106.03 -1.841 . . . . 0.0 106.03 166.243 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . 0.491 ' H ' ' HB3' ' A' ' 32' ' ' SER . 41.3 t -119.71 115.14 23.32 Favored 'General case' 0 N--CA 1.503 2.184 0 O-C-N 118.377 -2.702 . . . . 0.0 105.096 -178.948 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' MET . . . . . 0.453 ' SD ' ' HB2' ' A' ' 20' ' ' LYS . 8.3 mtp -43.22 -36.71 1.86 Allowed 'General case' 0 N--CA 1.502 2.145 0 N-CA-C 121.405 3.854 . . . . 0.0 121.405 -148.282 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . 0.421 ' O ' ' HB2' ' A' ' 35' ' ' LEU . 11.5 t-20 -48.71 -46.36 40.63 Favored 'General case' 0 CA--C 1.592 2.586 0 O-C-N 118.572 -2.58 . . . . 0.0 114.457 162.0 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . 0.491 ' HB3' ' H ' ' A' ' 29' ' ' SER 0.287 46.6 t -51.78 -66.41 0.39 Allowed 'General case' 0 N--CA 1.499 2.004 0 N-CA-C 119.908 3.299 . . . . 0.0 119.908 146.918 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 -64.49 -59.92 3.76 Favored 'General case' 0 N--CA 1.515 2.801 0 CA-C-N 123.895 3.043 . . . . 0.0 114.774 -176.042 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.589 HD22 ' CD2' ' A' ' 19' ' ' LEU 0.477 0.3 OUTLIER -51.17 -41.36 60.11 Favored 'General case' 0 CA--C 1.56 1.365 0 CA-C-O 113.55 -3.119 . . . . 0.0 106.692 174.912 . . . . . . . . 4 4 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.451 HD23 ' HA ' ' A' ' 35' ' ' LEU . 12.9 mt -62.99 -55.36 26.39 Favored 'General case' 0 N--CA 1.495 1.813 1 CA-C-N 127.281 4.582 . . . . 0.0 115.403 169.59 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . 0.276 1.0 OUTLIER -55.75 -49.81 72.1 Favored 'General case' 0 CA--C 1.566 1.561 0 CA-C-O 116.25 -1.833 . . . . 0.0 113.764 179.559 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 1.6 tt -60.11 -39.48 80.59 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.843 0 CA-C-N 122.619 2.463 . . . . 0.0 115.124 165.421 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.45 ' CG1' HD22 ' B' ' 19' ' ' LEU . 2.4 t -70.1 -49.97 51.36 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.994 0 CA-C-N 123.418 2.826 . . . . 0.0 112.696 -178.015 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 24.8 mt-30 -43.46 -46.7 6.91 Favored 'General case' 0 N--CA 1.489 1.522 0 C-N-CA 124.781 1.233 . . . . 0.0 113.724 152.995 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . 0.372 28.7 m-20 -58.46 -42.59 87.78 Favored 'General case' 0 CA--C 1.558 1.285 0 N-CA-C 117.356 2.354 . . . . 0.0 117.356 163.928 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . 0.265 . . -79.48 -41.76 26.78 Favored 'General case' 0 CA--C 1.553 1.095 0 N-CA-C 115.955 1.835 . . . . 0.0 115.955 -159.589 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.407 HD13 ' HB3' ' B' ' 18' ' ' LYS . 1.4 pp -101.31 -24.71 14.17 Favored 'General case' 0 CA--C 1.567 1.625 0 N-CA-C 117.418 2.377 . . . . 0.0 117.418 160.777 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 1.4 m -95.47 -12.37 25.99 Favored 'General case' 0 N--CA 1.498 1.971 0 CA-C-N 122.699 2.5 . . . . 0.0 116.167 -177.213 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . 0.374 1.3 mmmt 67.33 -168.25 0.01 OUTLIER Pre-proline 0 CA--C 1.588 2.423 0 CA-C-N 123.329 2.786 . . . . 0.0 113.894 169.879 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 22.8 Cg_exo -56.21 172.98 4.81 Favored 'Cis proline' 0 C--N 1.375 1.932 0 CA-C-N 125.854 3.127 . . . . 0.0 116.391 -7.993 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . 0.438 ' O ' HG13 ' A' ' 48' ' ' VAL . 69.6 m -89.07 108.95 27.21 Favored Pre-proline 0 CA--C 1.568 1.637 0 O-C-N 120.522 -1.361 . . . . 0.0 107.692 133.333 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 5.0 Cg_exo -73.16 98.65 1.03 Allowed 'Trans proline' 0 CA--C 1.566 2.117 0 CA-C-N 124.091 2.497 . . . . 0.0 109.708 172.048 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . 0.438 HG13 ' O ' ' A' ' 46' ' ' SER . 19.4 m -83.54 67.79 0.54 Allowed 'Isoleucine or valine' 0 N--CA 1.509 2.496 0 N-CA-C 115.203 1.556 . . . . 0.0 115.203 -150.435 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 24.5 p -101.0 62.52 0.98 Allowed 'General case' 0 N--CA 1.494 1.761 0 O-C-N 120.08 -1.637 . . . . 0.0 111.898 -163.893 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 60.26 41.1 98.18 Favored Glycine 0 N--CA 1.496 2.645 0 N-CA-C 121.082 3.193 . . . . 0.0 121.082 174.138 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -136.48 12.73 3.23 Favored 'General case' 0 N--CA 1.504 2.268 0 N-CA-C 120.421 3.489 . . . . 0.0 120.421 -166.621 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . 0.251 98.9 mtt180 67.95 108.62 0.05 OUTLIER 'General case' 0 CA--C 1.583 2.226 0 N-CA-C 114.815 1.413 . . . . 0.0 114.815 -170.067 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . 0.458 0.9 OUTLIER -134.59 63.15 1.63 Allowed 'General case' 0 N--CA 1.507 2.399 0 C-N-CA 125.45 1.5 . . . . 0.0 111.801 179.236 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . 0.488 ' CA ' ' HB2' ' A' ' 57' ' ' ARG . 39.1 m-20 -80.81 65.91 6.13 Favored 'General case' 0 CA--C 1.573 1.852 1 CA-C-O 128.849 4.166 . . . . 0.0 114.507 146.626 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . 0.474 ' H ' ' HB2' ' A' ' 56' ' ' GLU 0.437 . . -110.07 -66.98 1.02 Allowed 'General case' 0 CA--C 1.563 1.465 0 CA-C-N 108.984 -3.735 . . . . 0.0 113.891 -166.455 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.474 ' HB2' ' H ' ' A' ' 55' ' ' ALA . 47.1 mt-10 6.49 -25.31 0.0 OUTLIER 'General case' 0 N--CA 1.503 2.176 1 N-CA-C 126.926 5.899 . . . . 0.0 126.926 100.041 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.488 ' HB2' ' CA ' ' A' ' 54' ' ' ASP . 0.1 OUTLIER -110.34 -38.65 5.19 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-O 114.969 -2.444 . . . . 0.0 116.19 171.347 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.493 HD22 ' H ' ' A' ' 59' ' ' ALA 0.588 0.0 OUTLIER -48.83 -47.7 42.3 Favored 'General case' 0 N--CA 1.521 3.092 0 CA-C-N 124.423 3.283 . . . . 0.0 116.352 160.092 . . . . . . . . 4 4 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . 0.493 ' H ' HD22 ' A' ' 58' ' ' LEU 0.437 . . -17.42 -86.76 0.0 OUTLIER 'General case' 0 CA--C 1.564 1.482 1 N-CA-C 124.187 4.884 . . . . 0.0 124.187 132.634 . . . . . . . . 4 3 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 1.7 t70 -55.75 -45.03 78.11 Favored 'General case' 0 N--CA 1.479 0.977 0 N-CA-C 119.627 3.195 . . . . 0.0 119.627 -179.342 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . 0.634 0.1 OUTLIER -77.78 -17.49 57.44 Favored 'General case' 0 N--CA 1.499 2.01 0 CA-C-N 122.471 2.396 . . . . 0.0 113.056 178.593 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . 0.464 HE21 ' N ' ' A' ' 63' ' ' SER 0.306 0.0 OUTLIER -73.22 -68.05 0.53 Allowed 'General case' 0 C--N 1.376 1.74 0 CA-C-N 123.774 2.988 . . . . 0.0 104.342 156.751 . . . . . . . . 4 4 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . 0.464 ' N ' HE21 ' A' ' 62' ' ' GLN 0.704 3.4 p -65.49 -27.66 68.65 Favored 'General case' 0 N--CA 1.486 1.374 1 N-CA-C 122.472 4.249 . . . . 0.0 122.472 -167.164 . . . . . . . . 4 3 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 1.7 tp10 -85.84 0.12 53.86 Favored 'General case' 0 CA--C 1.574 1.872 0 N-CA-C 116.783 2.142 . . . . 0.0 116.783 155.504 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . 0.271 4.8 mp -116.6 44.24 2.06 Favored 'General case' 0 N--CA 1.514 2.746 0 CA-C-N 125.088 3.585 . . . . 0.0 114.362 156.867 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . 0.296 0.9 OUTLIER . . . . . 0 N--CA 1.5 2.047 0 CA-C-N 112.868 -1.969 . . . . 0.0 111.417 -165.776 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.562 1.412 0 N-CA-C 113.496 0.924 . . . . 0.0 113.496 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 2' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -84.49 77.45 10.02 Favored 'General case' 0 N--CA 1.494 1.748 0 CA-C-O 122.699 1.237 . . . . 0.0 113.89 -178.381 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -123.48 42.2 3.28 Favored 'General case' 0 CA--C 1.569 1.696 0 C-N-CA 124.321 1.049 . . . . 0.0 112.103 170.412 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 4' ' ' ASP . . . . . . . . . . . . . 7.1 p-10 -150.91 69.66 8.47 Favored Pre-proline 0 CA--C 1.571 1.763 0 N-CA-C 113.71 1.004 . . . . 0.0 113.71 157.076 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 95.2 Cg_endo -63.12 173.56 3.92 Favored 'Trans proline' 0 CA--C 1.567 2.169 0 C-N-CA 122.787 2.325 . . . . 0.0 116.128 156.473 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 6' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -154.15 148.1 25.59 Favored 'General case' 0 CA--C 1.548 0.873 0 CA-C-N 112.745 -2.025 . . . . 0.0 114.663 -153.175 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 7' ' ' PHE . . . . . 0.552 ' CZ ' HD23 ' A' ' 34' ' ' LEU . 17.3 p90 -122.53 170.36 10.08 Favored 'General case' 0 CA--C 1.561 1.371 0 CA-C-O 122.978 1.371 . . . . 0.0 109.961 153.18 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 8' ' ' ASN . . . . . . . . . . . . . 20.7 m-80 -85.18 92.52 8.42 Favored 'General case' 0 N--CA 1.485 1.291 0 O-C-N 119.894 -1.754 . . . . 0.0 108.06 160.616 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 9' ' ' PHE . . . . . . . . . . . . . 16.0 t80 -69.55 159.04 34.09 Favored 'General case' 0 CA--C 1.561 1.39 0 CA-C-O 125.296 2.474 . . . . 0.0 110.809 162.002 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 10' ' ' ARG . . . . . . . . . . . . . 2.3 tmm_? -176.35 107.76 0.08 Allowed 'General case' 0 C--N 1.304 -1.386 0 N-CA-C 103.399 -2.815 . . . . 0.0 103.399 -122.643 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 11' ' ' MET . . . . . 0.556 ' SD ' HD23 ' B' ' 19' ' ' LEU . 13.4 mtm -134.43 119.59 14.28 Favored Pre-proline 0 N--CA 1.484 1.235 0 CA-C-O 117.218 -1.373 . . . . 0.0 112.216 -161.428 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 12' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_exo -40.61 141.11 0.9 Allowed 'Trans proline' 0 C--N 1.372 1.8 0 C-N-CA 122.962 2.442 . . . . 0.0 116.192 160.991 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 13' ' ' MET . . . . . . . . . . . . . 27.2 tpp -58.98 -26.13 64.21 Favored 'General case' 0 N--CA 1.495 1.822 0 N-CA-C 118.378 2.733 . . . . 0.0 118.378 -157.754 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 14' ' ' GLU . . . . . . . . . . . . 0.252 6.4 pt-20 -64.4 -49.14 72.74 Favored 'General case' 0 CA--C 1.572 1.803 0 N-CA-C 116.213 1.931 . . . . 0.0 116.213 161.477 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -58.22 -47.0 88.56 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.301 0 CA-C-N 122.568 2.44 . . . . 0.0 113.309 173.646 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 2.7 ttt180 -75.06 -32.57 61.54 Favored 'General case' 0 CA--C 1.543 0.684 0 CA-C-O 116.305 -1.807 . . . . 0.0 115.763 175.652 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 17' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -61.39 -44.83 96.47 Favored 'General case' 0 N--CA 1.492 1.647 0 CA-C-N 123.23 2.741 . . . . 0.0 113.242 159.916 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 18' ' ' LYS . . . . . 0.407 ' HB3' HD13 ' A' ' 42' ' ' LEU 0.262 53.2 mtmt -58.74 -52.68 64.65 Favored 'General case' 0 CA--C 1.562 1.421 0 CA-C-N 121.173 1.806 . . . . 0.0 115.345 171.215 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 19' ' ' LEU . . . . . 0.556 HD23 ' SD ' ' B' ' 11' ' ' MET 0.26 12.5 tp -71.12 -36.35 72.1 Favored 'General case' 0 CA--C 1.563 1.444 0 N-CA-C 115.442 1.645 . . . . 0.0 115.442 178.41 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 20' ' ' LYS . . . . . 0.469 ' HB2' ' SD ' ' B' ' 30' ' ' MET . 18.3 ttpt -83.66 -20.81 32.92 Favored 'General case' 0 CA--C 1.584 2.262 0 N-CA-C 114.132 1.16 . . . . 0.0 114.132 172.756 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 21' ' ' PHE . . . . . 0.493 ' O ' ' HB3' ' B' ' 25' ' ' ALA . 9.4 m-30 -73.34 -65.88 0.76 Allowed 'General case' 0 N--CA 1.497 1.875 0 CA-C-N 122.547 2.43 . . . . 0.0 110.847 162.866 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . 0.311 0.2 OUTLIER -17.23 -52.57 0.01 OUTLIER 'General case' 0 CA--C 1.597 2.76 0 CA-C-N 124.79 3.45 . . . . 0.0 114.757 153.614 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 23' ' ' ALA . . . . . 0.479 ' HB2' ' CB ' ' B' ' 33' ' ' GLU . . . -58.27 -77.06 0.03 OUTLIER 'General case' 0 CA--C 1.575 1.905 0 N-CA-C 118.272 2.693 . . . . 0.0 118.272 158.975 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 58.0 mm-40 -75.5 -33.65 60.79 Favored 'General case' 0 CA--C 1.576 1.98 0 N-CA-C 118.303 2.705 . . . . 0.0 118.303 -174.996 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 25' ' ' ALA . . . . . 0.493 ' HB3' ' O ' ' B' ' 21' ' ' PHE . . . -45.61 -51.66 11.79 Favored 'General case' 0 CA--C 1.585 2.293 0 N-CA-C 116.009 1.855 . . . . 0.0 116.009 154.162 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 26' ' ' ASN . . . . . . . . . . . . . 90.8 m-20 -78.68 -53.02 7.59 Favored 'General case' 0 N--CA 1.499 1.989 0 N-CA-C 115.145 1.535 . . . . 0.0 115.145 174.867 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 27' ' ' GLY . . . . . . . . . . . . . . . 120.36 24.69 2.6 Favored Glycine 0 CA--C 1.562 2.99 0 N-CA-C 118.403 2.121 . . . . 0.0 118.403 -154.277 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 28' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -104.88 178.96 4.41 Favored 'General case' 0 CA--C 1.574 1.87 0 CA-C-N 120.211 2.005 . . . . 0.0 107.798 157.546 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 29' ' ' SER . . . . . 0.472 ' H ' ' HB2' ' B' ' 32' ' ' SER . 6.8 t -135.24 115.95 13.88 Favored 'General case' 0 N--CA 1.5 2.052 0 O-C-N 118.73 -2.481 . . . . 0.0 106.92 171.385 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 30' ' ' MET . . . . . 0.469 ' SD ' ' HB2' ' B' ' 20' ' ' LYS 0.355 2.7 ptm -48.84 -17.2 0.16 Allowed 'General case' 0 N--CA 1.506 2.341 1 N-CA-C 123.761 4.726 . . . . 0.0 123.761 -146.323 . . . . . . . . 4 3 . 1 . 010 nuclear nobuild full ' B' B ' 31' ' ' ASN . . . . . . . . . . . . . 15.6 t-20 -56.29 -52.85 62.98 Favored 'General case' 0 CA--C 1.587 2.37 0 O-C-N 117.513 -3.242 . . . . 0.0 113.452 151.498 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 32' ' ' SER . . . . . 0.472 ' HB2' ' H ' ' B' ' 29' ' ' SER 0.299 71.0 m -49.37 -64.74 0.72 Allowed 'General case' 0 N--CA 1.496 1.849 0 N-CA-C 118.09 2.626 . . . . 0.0 118.09 150.329 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 33' ' ' GLU . . . . . 0.479 ' CB ' ' HB2' ' B' ' 23' ' ' ALA 0.27 4.9 tp10 -62.67 -60.15 3.91 Favored 'General case' 0 N--CA 1.513 2.676 0 CA-C-N 124.064 3.12 . . . . 0.0 114.449 -178.195 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 34' ' ' LEU . . . . . 0.541 HD22 HD21 ' B' ' 19' ' ' LEU 0.63 0.1 OUTLIER -53.57 -36.11 61.54 Favored 'General case' 0 CA--C 1.562 1.409 0 CA-C-O 114.607 -2.616 . . . . 0.0 106.548 -177.855 . . . . . . . . 4 4 . 1 . 010 nuclear nobuild full ' B' B ' 35' ' ' LEU . . . . . 0.457 ' HG ' ' CE1' ' A' ' 9' ' ' PHE . 19.6 mt -66.16 -48.95 69.05 Favored 'General case' 0 C--N 1.37 1.484 0 CA-C-N 125.365 3.711 . . . . 0.0 115.926 167.361 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 36' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.14 -45.72 86.87 Favored 'General case' 0 N--CA 1.487 1.382 0 N-CA-C 114.671 1.36 . . . . 0.0 114.671 177.097 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 37' ' ' ILE . . . . . 0.42 ' HA ' ' HB3' ' B' ' 40' ' ' ASP . 3.0 tp -71.09 -28.46 33.06 Favored 'Isoleucine or valine' 0 CA--C 1.579 2.068 0 N-CA-C 116.851 2.167 . . . . 0.0 116.851 164.914 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 38' ' ' VAL . . . . . 0.433 HG21 HD12 ' B' ' 34' ' ' LEU . 2.8 t -83.75 -47.04 18.16 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.312 0 CA-C-N 124.265 3.211 . . . . 0.0 110.708 -177.923 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 26.1 mt-30 -54.53 -40.87 69.07 Favored 'General case' 0 CA--C 1.566 1.572 0 CA-C-O 118.093 -0.956 . . . . 0.0 112.268 158.038 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 40' ' ' ASP . . . . . 0.42 ' HB3' ' HA ' ' B' ' 37' ' ' ILE 0.315 24.9 t0 -46.75 -57.32 4.97 Favored 'General case' 0 N--CA 1.493 1.692 0 N-CA-C 115.881 1.808 . . . . 0.0 115.881 153.06 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 41' ' ' ALA . . . . . . . . . . . . 0.31 . . -78.83 -31.96 45.98 Favored 'General case' 0 N--CA 1.474 0.737 0 N-CA-C 119.12 3.007 . . . . 0.0 119.12 -155.18 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 42' ' ' LEU . . . . . 0.405 HD13 ' HB3' ' A' ' 18' ' ' LYS . 2.1 pp -107.1 -1.6 21.85 Favored 'General case' 0 CA--C 1.563 1.474 0 N-CA-C 117.261 2.319 . . . . 0.0 117.261 159.216 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 43' ' ' SER . . . . . . . . . . . . . 87.0 p -145.75 23.57 1.4 Allowed 'General case' 0 N--CA 1.494 1.755 0 N-CA-C 118.317 2.71 . . . . 0.0 118.317 -178.382 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 44' ' ' LYS . . . . . . . . . . . . . 10.7 tmtt? -64.73 -44.69 74.15 Favored Pre-proline 0 N--CA 1.505 2.281 0 N-CA-C 119.622 3.193 . . . . 0.0 119.622 174.4 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -79.91 68.12 8.4 Favored 'Trans proline' 0 CA--C 1.57 2.287 0 CA-C-N 124.949 2.803 . . . . 0.0 119.113 -161.136 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 46' ' ' SER . . . . . . . . . . . . . 68.7 m -90.27 -54.92 0.29 Allowed Pre-proline 0 CA--C 1.574 1.868 0 CA-C-O 116.54 -1.695 . . . . 0.0 111.241 137.992 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 93.1 Cg_endo -68.11 72.62 0.8 Allowed 'Trans proline' 0 CA--C 1.573 2.472 0 CA-C-N 124.669 2.703 . . . . 0.0 113.678 153.185 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 48' ' ' VAL . . . . . . . . . . . . . 13.1 p -80.48 -56.44 6.57 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.843 0 CA-C-N 114.816 -1.083 . . . . 0.0 113.712 -171.515 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 49' ' ' THR . . . . . . . . . . . . 0.307 17.2 p 66.84 53.75 0.84 Allowed 'General case' 0 N--CA 1.5 2.062 0 CA-C-O 122.667 1.222 . . . . 0.0 113.757 169.522 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 50' ' ' GLY . . . . . . . . . . . . . . . 90.85 -51.97 3.25 Favored Glycine 0 N--CA 1.493 2.496 0 N-CA-C 117.642 1.817 . . . . 0.0 117.642 -163.413 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 51' ' ' TYR . . . . . 0.43 ' CD2' ' HB3' ' A' ' 57' ' ' ARG 0.256 16.9 p90 -84.11 80.87 9.04 Favored 'General case' 0 CA--C 1.568 1.646 0 N-CA-C 117.903 2.557 . . . . 0.0 117.903 -159.055 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 52' ' ' ARG . . . . . . . . . . . . . 9.6 mpt_? -79.38 58.9 2.73 Favored 'General case' 0 N--CA 1.504 2.275 0 O-C-N 119.59 -1.944 . . . . 0.0 112.773 172.833 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 53' ' ' ASN . . . . . 0.452 ' HA ' ' HB2' ' B' ' 55' ' ' ALA . 7.4 m120 -141.88 -135.76 0.1 Allowed 'General case' 0 CA--C 1.601 2.942 0 O-C-N 120.261 -1.524 . . . . 0.0 108.861 -159.059 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 54' ' ' ASP . . . . . 0.499 ' C ' ' H ' ' B' ' 58' ' ' LEU 0.51 3.5 m-20 -6.31 91.02 0.01 OUTLIER 'General case' 0 N--CA 1.52 3.046 1 O-C-N 116.214 -4.053 . . . . 0.0 113.039 -97.5 . . . . . . . . 4 3 . 1 . 010 nuclear nobuild full ' B' B ' 55' ' ' ALA . . . . . 0.789 ' HB3' ' H ' ' B' ' 57' ' ' ARG 0.561 . . -92.37 -131.47 0.12 Allowed 'General case' 0 N--CA 1.412 -2.331 0 CA-C-O 126.659 3.123 . . . . 0.0 109.951 -130.383 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 56' ' ' GLU . . . . . 0.441 ' HB2' ' CB ' ' B' ' 55' ' ' ALA . 0.9 OUTLIER -2.15 -38.95 0.0 OUTLIER 'General case' 0 CA--C 1.596 2.736 1 N-CA-C 123.289 4.552 . . . . 0.0 123.289 92.157 . . . . . . . . 4 4 . 1 . 010 nuclear nobuild full ' B' B ' 57' ' ' ARG . . . . . 0.789 ' H ' ' HB3' ' B' ' 55' ' ' ALA . 3.7 tmt_? -75.36 -54.9 6.29 Favored 'General case' 0 CA--C 1.556 1.209 0 CA-C-O 115.299 -2.286 . . . . 0.0 116.391 161.164 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 58' ' ' LEU . . . . . 0.499 ' H ' ' C ' ' B' ' 54' ' ' ASP 0.307 11.6 mt -71.82 -20.77 61.79 Favored 'General case' 0 N--CA 1.507 2.375 0 CA-C-N 125.12 3.6 . . . . 0.0 115.009 172.135 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 59' ' ' ALA . . . . . . . . . . . . . . . -46.39 -56.5 5.79 Favored 'General case' 0 N--CA 1.477 0.877 0 N-CA-C 117.075 2.25 . . . . 0.0 117.075 142.817 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 60' ' ' ASP . . . . . 0.466 ' C ' ' H ' ' B' ' 64' ' ' GLU . 5.4 t70 -82.03 -3.03 53.67 Favored 'General case' 0 N--CA 1.483 1.211 0 N-CA-C 119.575 3.176 . . . . 0.0 119.575 -179.656 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 61' ' ' GLU . . . . . . . . . . . . 0.262 3.5 mm-40 -95.97 -50.74 4.74 Favored 'General case' 0 C--N 1.31 -1.145 0 CA-C-O 117.856 -1.069 . . . . 0.0 109.747 172.384 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 62' ' ' GLN . . . . . . . . . . . . 0.283 0.6 OUTLIER -61.13 -49.63 76.47 Favored 'General case' 0 CA--C 1.551 1.013 0 CA-C-N 122.355 2.343 . . . . 0.0 111.269 166.587 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 63' ' ' SER . . . . . 0.482 ' HA ' HG22 ' B' ' 66' ' ' VAL 0.354 28.6 t -123.76 34.64 5.03 Favored 'General case' 0 CA--C 1.556 1.185 0 N-CA-C 117.496 2.406 . . . . 0.0 117.496 -175.664 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 64' ' ' GLU . . . . . 0.466 ' H ' ' C ' ' B' ' 60' ' ' ASP 1.968 39.3 mt-10 -41.28 -67.52 0.25 Allowed 'General case' 0 N--CA 1.488 1.473 0 N-CA-C 119.811 3.263 . . . . 0.0 119.811 94.579 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 65' ' ' LEU . . . . . . . . . . . . 0.279 9.4 mp -77.41 -45.6 25.33 Favored 'General case' 0 CA--C 1.548 0.893 0 N-CA-C 117.752 2.501 . . . . 0.0 117.752 -145.315 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 66' ' ' VAL . . . . . 0.482 HG22 ' HA ' ' B' ' 63' ' ' SER . 8.1 m . . . . . 0 N--CA 1.516 2.871 1 N-CA-C 122.406 4.224 . . . . 0.0 122.406 146.539 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.562 1.435 0 N-CA-C 113.449 0.907 . . . . 0.0 113.449 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 29.7 mmt180 -89.02 75.3 7.99 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 120.953 -1.092 . . . . 0.0 113.364 -178.322 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . 0.252 28.7 t70 -152.58 -80.19 0.1 Allowed 'General case' 0 N--CA 1.488 1.426 0 C-N-CA 124.111 0.965 . . . . 0.0 110.492 170.232 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . 0.3 2.5 p30 -138.05 76.39 39.35 Favored Pre-proline 0 CA--C 1.567 1.614 0 O-C-N 121.176 -0.953 . . . . 0.0 113.361 170.243 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 47.8 Cg_endo -81.9 168.26 15.75 Favored 'Trans proline' 0 CA--C 1.567 2.159 0 C-N-CA 123.557 2.838 . . . . 0.0 115.983 176.492 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 65.0 m80 -108.75 144.93 35.91 Favored 'General case' 0 CA--C 1.567 1.607 0 CA-C-N 113.068 -1.878 . . . . 0.0 112.35 -165.438 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . 0.809 ' CZ ' HD12 ' B' ' 34' ' ' LEU . 20.2 p90 -138.46 150.08 46.1 Favored 'General case' 0 CA--C 1.564 1.51 0 O-C-N 120.062 -1.649 . . . . 0.0 111.397 142.63 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 11.7 m120 -71.98 83.48 0.96 Allowed 'General case' 0 N--CA 1.491 1.612 0 O-C-N 120.089 -1.632 . . . . 0.0 111.689 170.083 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . 0.683 ' CD2' HD13 ' B' ' 34' ' ' LEU . 6.1 t80 -64.09 147.19 52.76 Favored 'General case' 0 CA--C 1.55 0.943 0 CA-C-O 125.313 2.482 . . . . 0.0 112.026 167.717 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 2.7 tmm_? -144.27 110.06 5.31 Favored 'General case' 0 C--N 1.304 -1.379 0 CA-C-N 111.166 -2.743 . . . . 0.0 104.974 -152.369 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 1.2 mpp? -116.12 116.2 40.11 Favored Pre-proline 0 CA--C 1.562 1.437 0 CA-C-O 117.64 -1.172 . . . . 0.0 111.764 -170.536 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_exo -41.55 140.35 1.74 Allowed 'Trans proline' 0 CA--C 1.559 1.768 0 C-N-CA 122.958 2.439 . . . . 0.0 115.575 156.411 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . 0.497 ' SD ' ' HG2' ' A' ' 17' ' ' GLU . 25.0 tpp -57.85 -29.04 64.66 Favored 'General case' 0 N--CA 1.496 1.858 0 N-CA-C 118.173 2.657 . . . . 0.0 118.173 -158.87 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -57.43 -52.21 66.29 Favored 'General case' 0 CA--C 1.566 1.594 0 N-CA-C 117.696 2.48 . . . . 0.0 117.696 160.343 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -58.79 -49.45 82.82 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.249 0 CA-C-N 122.087 2.221 . . . . 0.0 112.507 172.207 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . 0.262 1.1 ttt180 -72.39 -37.54 68.7 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-O 115.405 -2.236 . . . . 0.0 115.191 176.959 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.497 ' HG2' ' SD ' ' A' ' 13' ' ' MET . 41.8 mm-40 -62.42 -38.56 90.16 Favored 'General case' 0 CA--C 1.559 1.313 0 CA-C-N 124.485 3.311 . . . . 0.0 113.659 164.899 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . 0.576 26.5 pttt -74.72 -36.56 62.67 Favored 'General case' 0 CA--C 1.565 1.543 0 N-CA-C 117.777 2.51 . . . . 0.0 117.777 174.53 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.537 HD21 HD22 ' A' ' 34' ' ' LEU 0.253 11.2 tp -74.41 -34.91 63.38 Favored 'General case' 0 CA--C 1.574 1.891 0 N-CA-C 114.868 1.433 . . . . 0.0 114.868 167.978 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.408 ' HB2' ' SD ' ' A' ' 30' ' ' MET . 2.2 ttpt -91.09 -31.27 16.32 Favored 'General case' 0 CA--C 1.57 1.715 0 O-C-N 120.124 -1.61 . . . . 0.0 113.631 179.908 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . 0.44 ' O ' ' HB3' ' A' ' 25' ' ' ALA . 22.7 m-85 -57.41 -68.58 0.22 Allowed 'General case' 0 N--CA 1.496 1.828 0 CA-C-O 113.649 -3.072 . . . . 0.0 110.416 153.977 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.417 ' O ' ' HB3' ' A' ' 26' ' ' ASN 0.287 30.7 ttt85 -29.4 -43.38 0.03 OUTLIER 'General case' 0 CA--C 1.598 2.81 1 CA-C-N 126.017 4.008 . . . . 0.0 117.676 166.169 . . . . . . . . 4 3 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.477 ' HB2' ' CB ' ' A' ' 33' ' ' GLU 0.289 . . -60.05 -71.36 0.13 Allowed 'General case' 0 CA--C 1.589 2.476 0 O-C-N 118.484 -2.635 . . . . 0.0 116.93 159.508 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -63.39 -49.46 73.71 Favored 'General case' 0 N--CA 1.502 2.147 0 N-CA-C 118.477 2.769 . . . . 0.0 118.477 177.371 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.44 ' HB3' ' O ' ' A' ' 21' ' ' PHE . . . -40.19 -48.18 2.52 Favored 'General case' 0 CA--C 1.574 1.89 0 N-CA-C 118.409 2.744 . . . . 0.0 118.409 159.916 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . 0.417 ' HB3' ' O ' ' A' ' 22' ' ' ARG 0.296 0.8 OUTLIER -125.07 -9.26 7.12 Favored 'General case' 0 CA--C 1.58 2.111 0 N-CA-C 116.646 2.091 . . . . 0.0 116.646 -154.306 . . . . . . . . 4 4 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 115.59 29.64 2.41 Favored Glycine 0 N--CA 1.497 2.733 0 N-CA-C 119.21 2.444 . . . . 0.0 119.21 171.903 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.439 ' HE ' ' HG2' ' A' ' 33' ' ' GLU . 1.4 mpp_? -139.32 174.99 9.95 Favored 'General case' 0 CA--C 1.575 1.91 0 CA-C-N 119.201 1.5 . . . . 0.0 108.0 174.376 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . 0.401 ' H ' ' HB3' ' A' ' 32' ' ' SER . 35.0 t -132.86 112.08 11.62 Favored 'General case' 0 N--CA 1.501 2.104 0 O-C-N 118.602 -2.561 . . . . 0.0 106.921 179.88 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' MET . . . . . 0.408 ' SD ' ' HB2' ' A' ' 20' ' ' LYS . 26.5 mtp -46.12 -31.78 2.56 Favored 'General case' 0 N--CA 1.501 2.105 0 N-CA-C 121.552 3.908 . . . . 0.0 121.552 -138.947 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . 0.275 5.6 t-20 -51.12 -50.91 57.92 Favored 'General case' 0 CA--C 1.59 2.486 0 O-C-N 118.506 -2.622 . . . . 0.0 114.11 160.51 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . 0.401 ' HB3' ' H ' ' A' ' 29' ' ' SER 0.308 22.8 t -44.44 -68.08 0.23 Allowed 'General case' 0 N--CA 1.503 2.211 0 N-CA-C 117.055 2.243 . . . . 0.0 117.055 143.987 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . 0.477 ' CB ' ' HB2' ' A' ' 23' ' ' ALA . 4.9 tm-20 -70.28 -54.79 11.19 Favored 'General case' 0 N--CA 1.505 2.293 0 N-CA-C 118.606 2.817 . . . . 0.0 118.606 -168.157 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.537 HD22 HD21 ' A' ' 19' ' ' LEU 0.589 0.0 OUTLIER -52.2 -34.03 43.55 Favored 'General case' 0 CA--C 1.574 1.87 0 CA-C-O 114.192 -2.813 . . . . 0.0 107.618 168.549 . . . . . . . . 4 4 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 21.7 mt -65.7 -46.1 80.27 Favored 'General case' 0 N--CA 1.495 1.787 1 CA-C-N 126.835 4.379 . . . . 0.0 116.257 164.853 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -60.92 -45.1 96.03 Favored 'General case' 0 N--CA 1.488 1.455 0 N-CA-C 114.779 1.4 . . . . 0.0 114.779 178.606 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . 0.27 2.8 tt -60.56 -46.36 95.68 Favored 'Isoleucine or valine' 0 CA--C 1.566 1.573 0 CA-C-O 114.866 -2.492 . . . . 0.0 116.453 156.553 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.433 HG12 ' CG1' ' B' ' 15' ' ' VAL . 3.3 t -71.26 -44.75 72.89 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.215 0 CA-C-N 123.93 3.059 . . . . 0.0 111.676 -169.747 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 23.8 mt-30 -55.7 -45.61 77.83 Favored 'General case' 0 CA--C 1.565 1.551 0 C-N-CA 124.423 1.089 . . . . 0.0 112.776 158.503 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . 0.475 0.9 OUTLIER -49.52 -34.84 18.29 Favored 'General case' 0 N--CA 1.5 2.055 0 N-CA-C 118.648 2.832 . . . . 0.0 118.648 156.74 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -78.36 -70.2 0.51 Allowed 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 123.914 0.886 . . . . 0.0 111.113 -166.509 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 2.6 pp -86.03 17.3 3.61 Favored 'General case' 0 CA--C 1.569 1.69 0 N-CA-C 118.102 2.63 . . . . 0.0 118.102 171.46 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 5.1 t -114.21 -34.58 5.29 Favored 'General case' 0 N--CA 1.495 1.784 0 N-CA-C 117.435 2.383 . . . . 0.0 117.435 155.804 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . 0.283 47.3 tttt -96.21 -28.89 0.26 Allowed Pre-proline 0 N--CA 1.506 2.364 1 N-CA-C 122.667 4.321 . . . . 0.0 122.667 -150.238 . . . . . . . . 3 2 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 92.6 Cg_endo -82.55 119.23 2.97 Favored 'Trans proline' 0 CA--C 1.564 1.98 0 CA-C-N 126.878 3.492 . . . . 0.0 118.317 -168.032 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 75.7 m -74.65 153.94 87.41 Favored Pre-proline 0 CA--C 1.584 2.263 0 CA-C-N 114.867 -1.06 . . . . 0.0 112.722 130.624 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 95.0 Cg_endo -69.49 96.54 0.57 Allowed 'Trans proline' 0 CA--C 1.566 2.11 0 C-N-CA 122.497 2.131 . . . . 0.0 113.584 172.766 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . 0.531 HG13 HG22 ' A' ' 49' ' ' THR . 7.6 p -105.16 152.68 6.99 Favored 'Isoleucine or valine' 0 CA--C 1.567 1.628 0 CA-C-O 121.917 0.865 . . . . 0.0 111.9 -170.342 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . 0.531 HG22 HG13 ' A' ' 48' ' ' VAL 0.452 12.3 t 66.48 -163.89 0.23 Allowed 'General case' 0 N--CA 1.499 2.012 0 N-CA-C 116.627 2.084 . . . . 0.0 116.627 151.556 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -81.32 -48.69 5.85 Favored Glycine 0 N--CA 1.494 2.53 0 CA-C-N 113.331 -1.759 . . . . 0.0 117.398 -173.295 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . 0.487 ' OH ' ' HB2' ' B' ' 60' ' ' ASP 0.36 0.0 OUTLIER -71.95 30.19 0.05 Allowed 'General case' 0 CA--C 1.59 2.51 0 N-CA-C 118.624 2.824 . . . . 0.0 118.624 171.584 . . . . . . . . 4 4 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . 0.628 0.0 OUTLIER 104.66 -102.75 0.0 OUTLIER 'General case' 0 CA--C 1.587 2.372 1 N-CA-C 121.893 4.034 . . . . 0.0 121.893 158.243 . . . . . . . . 4 3 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . 0.548 ' HB2' ' H ' ' A' ' 56' ' ' GLU . 0.0 OUTLIER -109.67 -172.05 1.96 Allowed 'General case' 0 CA--C 1.582 2.192 2 O-C-N 110.624 -7.548 . . . . 0.0 115.984 33.146 . . . . . . . . 4 4 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . 0.702 ' H ' ' HA ' ' B' ' 53' ' ' ASN 1.131 1.3 p30 -114.66 19.41 16.04 Favored 'General case' 0 N--CA 1.499 1.98 1 N-CA-C 121.825 4.009 . . . . 0.0 121.825 140.334 . . . . . . . . 4 3 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . 0.482 ' HB2' ' CB ' ' B' ' 55' ' ' ALA 0.413 . . -94.33 -18.33 21.71 Favored 'General case' 0 CA--C 1.603 2.994 0 N-CA-C 118.111 2.634 . . . . 0.0 118.111 140.253 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.801 ' O ' ' HB3' ' A' ' 59' ' ' ALA . 10.9 tm-20 -51.82 -22.75 3.95 Favored 'General case' 0 CA--C 1.583 2.239 1 O-C-N 115.494 -4.504 . . . . 0.0 114.375 129.806 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.5 ' H ' ' HA ' ' A' ' 54' ' ' ASP 1.711 0.0 OUTLIER -77.42 -9.83 59.1 Favored 'General case' 0 CA--C 1.588 2.408 1 O-C-N 115.053 -4.779 . . . . 0.0 114.739 160.395 . . . . . . . . 5 4 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.464 ' H ' ' HA ' ' A' ' 55' ' ' ALA 2.16 1.8 pp -62.19 -24.97 67.52 Favored 'General case' 0 CA--C 1.609 3.232 0 O-C-N 116.871 -3.643 . . . . 0.0 113.039 150.122 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . 0.801 ' HB3' ' O ' ' A' ' 56' ' ' GLU . . . -54.65 -19.97 7.2 Favored 'General case' 0 N--CA 1.521 3.102 1 O-C-N 114.763 -4.961 . . . . 0.0 119.662 139.513 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.431 ' H ' ' C ' ' A' ' 57' ' ' ARG 0.539 0.0 OUTLIER -75.79 -1.35 24.65 Favored 'General case' 0 N--CA 1.522 3.133 1 N-CA-C 123.614 4.672 . . . . 0.0 123.614 141.834 . . . . . . . . 5 4 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . 0.466 0.0 OUTLIER -58.38 -25.18 61.76 Favored 'General case' 0 N--CA 1.519 3.019 0 O-C-N 119.469 -2.019 . . . . 0.0 116.018 129.989 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . 0.645 ' O ' HG13 ' A' ' 66' ' ' VAL 0.468 0.0 OUTLIER -69.15 -47.96 63.6 Favored 'General case' 0 N--CA 1.498 1.947 0 CA-C-O 116.42 -1.752 . . . . 0.0 112.866 161.931 . . . . . . . . 4 4 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . . . . . . . . 0.314 50.2 m -28.31 -51.56 0.08 Allowed 'General case' 0 N--CA 1.528 3.437 0 CA-C-N 122.543 2.429 . . . . 0.0 116.015 155.158 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . 0.321 2.4 tm-20 -83.66 -31.96 25.88 Favored 'General case' 0 CA--C 1.579 2.088 0 CA-C-N 112.94 -1.936 . . . . 0.0 115.397 -166.821 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 4.6 pp -58.34 -31.38 67.52 Favored 'General case' 0 N--CA 1.51 2.53 0 N-CA-C 117.57 2.433 . . . . 0.0 117.57 148.731 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.645 HG13 ' O ' ' A' ' 62' ' ' GLN 0.413 1.3 m . . . . . 0 CA--C 1.592 2.593 0 CA-C-N 120.725 1.602 . . . . 0.0 111.175 177.976 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.562 1.437 0 N-CA-C 113.374 0.879 . . . . 0.0 113.374 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 2' ' ' ARG . . . . . . . . . . . . . 84.2 mtt85 -86.88 82.49 7.79 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.232 -0.918 . . . . 0.0 111.64 177.858 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 26.0 m-20 -129.73 81.77 2.03 Favored 'General case' 0 N--CA 1.489 1.51 0 N-CA-C 107.586 -1.265 . . . . 0.0 107.586 -179.587 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 4' ' ' ASP . . . . . . . . . . . . . 3.4 p30 -154.91 92.93 2.81 Favored Pre-proline 0 CA--C 1.566 1.584 0 CA-C-O 117.926 -1.035 . . . . 0.0 111.016 -179.464 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -94.92 140.28 1.12 Allowed 'Trans proline' 0 C--N 1.364 1.369 0 CA-C-N 123.005 2.109 . . . . 0.0 113.991 -163.489 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 6' ' ' HIS . . . . . . . . . . . . . 75.0 m80 -82.04 115.24 21.09 Favored 'General case' 0 CA--C 1.567 1.601 0 CA-C-N 114.137 -1.392 . . . . 0.0 111.109 170.833 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 7' ' ' PHE . . . . . 0.489 ' CZ ' HD23 ' A' ' 34' ' ' LEU . 1.1 p90 -118.51 150.23 39.97 Favored 'General case' 0 N--CA 1.489 1.486 0 O-C-N 120.856 -1.153 . . . . 0.0 109.855 159.959 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 8' ' ' ASN . . . . . . . . . . . . . 18.2 m120 -68.94 91.02 0.45 Allowed 'General case' 0 N--CA 1.489 1.492 0 O-C-N 120.472 -1.392 . . . . 0.0 112.512 171.077 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 9' ' ' PHE . . . . . 0.544 ' HD2' HD11 ' B' ' 34' ' ' LEU . 4.4 t80 -77.8 146.42 35.8 Favored 'General case' 0 CA--C 1.564 1.486 0 CA-C-O 125.836 2.732 . . . . 0.0 109.592 153.725 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 177.78 102.75 0.02 OUTLIER 'General case' 0 N--CA 1.487 1.381 0 CA-C-N 112.59 -2.095 . . . . 0.0 106.699 -130.363 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 11' ' ' MET . . . . . 0.499 ' SD ' ' HG3' ' B' ' 16' ' ' ARG . 0.9 OUTLIER -132.73 136.53 27.96 Favored Pre-proline 0 N--CA 1.491 1.623 0 CA-C-O 117.549 -1.215 . . . . 0.0 113.677 -154.486 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 12' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -59.19 154.25 47.34 Favored 'Trans proline' 0 CA--C 1.565 2.041 0 CA-C-N 122.692 1.997 . . . . 0.0 114.087 168.517 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 13' ' ' MET . . . . . 0.431 ' SD ' ' HG3' ' B' ' 17' ' ' GLU . 4.7 tpp -61.77 -37.45 84.35 Favored 'General case' 0 N--CA 1.487 1.422 0 N-CA-C 118.365 2.728 . . . . 0.0 118.365 -146.66 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 -61.81 -40.92 96.93 Favored 'General case' 0 CA--C 1.566 1.566 0 N-CA-C 116.428 2.01 . . . . 0.0 116.428 167.139 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 15' ' ' VAL . . . . . 0.433 ' CG1' HG12 ' A' ' 38' ' ' VAL . 0.2 OUTLIER -63.09 -49.43 83.4 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.08 0 CA-C-N 123.293 2.769 . . . . 0.0 111.921 171.788 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 16' ' ' ARG . . . . . 0.499 ' HG3' ' SD ' ' B' ' 11' ' ' MET 0.296 6.0 ttt180 -70.45 -37.05 74.28 Favored 'General case' 0 N--CA 1.477 0.908 0 CA-C-N 121.729 2.059 . . . . 0.0 115.997 175.341 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 17' ' ' GLU . . . . . 0.431 ' HG3' ' SD ' ' B' ' 13' ' ' MET . 37.6 mt-10 -63.03 -39.44 94.74 Favored 'General case' 0 N--CA 1.491 1.609 0 CA-C-N 123.548 2.886 . . . . 0.0 114.234 163.473 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . 0.257 53.6 mtmt -65.0 -49.09 71.61 Favored 'General case' 0 CA--C 1.563 1.452 0 CA-C-N 121.921 2.146 . . . . 0.0 115.344 170.352 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 19' ' ' LEU . . . . . 0.505 HD21 ' CD2' ' B' ' 34' ' ' LEU 0.263 11.9 tp -65.75 -39.69 91.33 Favored 'General case' 0 CA--C 1.568 1.668 0 CA-C-N 120.759 1.618 . . . . 0.0 114.336 173.791 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 20' ' ' LYS . . . . . . . . . . . . . 12.1 ttpt -84.84 -31.31 23.88 Favored 'General case' 0 CA--C 1.557 1.238 0 C-N-CA 125.244 1.418 . . . . 0.0 114.36 179.621 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 20.0 m-85 -60.91 -74.1 0.08 Allowed 'General case' 0 N--CA 1.49 1.531 0 CA-C-O 112.282 -3.723 . . . . 0.0 110.583 154.711 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . 0.292 8.7 ttt180 -16.84 -57.96 0.01 OUTLIER 'General case' 0 CA--C 1.586 2.347 1 CA-C-N 126.487 4.221 . . . . 0.0 116.699 168.866 . . . . . . . . 3 2 . 1 . 011 nuclear nobuild full ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -53.41 -72.31 0.06 Allowed 'General case' 0 CA--C 1.583 2.242 1 N-CA-C 122.153 4.131 . . . . 0.0 122.153 156.896 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 49.3 mt-10 -66.92 -38.71 86.72 Favored 'General case' 0 N--CA 1.505 2.305 0 N-CA-C 118.138 2.644 . . . . 0.0 118.138 177.144 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 25' ' ' ALA . . . . . . . . . . . . . . . -38.5 -48.47 1.4 Allowed 'General case' 0 CA--C 1.585 2.325 0 N-CA-C 116.493 2.034 . . . . 0.0 116.493 155.883 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 26' ' ' ASN . . . . . 0.415 HD21 ' HB2' ' B' ' 28' ' ' ARG . 0.0 OUTLIER -101.27 -48.01 4.52 Favored 'General case' 0 CA--C 1.578 2.031 0 N-CA-C 116.626 2.084 . . . . 0.0 116.626 -173.748 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 27' ' ' GLY . . . . . . . . . . . . . . . 117.95 39.41 0.76 Allowed Glycine 0 CA--C 1.558 2.754 0 N-CA-C 117.774 1.87 . . . . 0.0 117.774 -157.75 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 28' ' ' ARG . . . . . 0.415 ' HB2' HD21 ' B' ' 26' ' ' ASN . 3.1 mtt85 -138.14 97.97 3.52 Favored 'General case' 0 N--CA 1.492 1.663 0 CA-C-N 119.936 1.868 . . . . 0.0 106.078 174.852 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 29' ' ' SER . . . . . . . . . . . . . 32.2 t -75.82 127.88 33.96 Favored 'General case' 0 N--CA 1.504 2.26 0 O-C-N 117.758 -3.089 . . . . 0.0 107.92 -162.301 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 30' ' ' MET . . . . . . . . . . . . . 25.4 mtp -44.93 -42.7 8.35 Favored 'General case' 0 N--CA 1.503 2.198 0 N-CA-C 118.663 2.838 . . . . 0.0 118.663 -144.973 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 31' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -46.26 -40.7 11.93 Favored 'General case' 0 CA--C 1.595 2.688 0 CA-C-N 125.245 3.657 . . . . 0.0 115.788 165.899 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 32' ' ' SER . . . . . . . . . . . . 0.28 40.4 t -56.4 -66.36 0.45 Allowed 'General case' 0 N--CA 1.498 1.963 0 N-CA-C 119.361 3.097 . . . . 0.0 119.361 148.133 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 8.1 tp10 -66.22 -56.27 12.12 Favored 'General case' 0 N--CA 1.515 2.807 0 CA-C-N 124.007 3.094 . . . . 0.0 114.739 -177.857 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 34' ' ' LEU . . . . . 0.809 HD12 ' CZ ' ' A' ' 7' ' ' PHE . 0.0 OUTLIER -37.64 -52.61 1.23 Allowed 'General case' 0 CA--C 1.546 0.81 0 CA-C-O 115.614 -2.136 . . . . 0.0 109.379 165.935 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 35' ' ' LEU . . . . . 0.417 HD23 ' HA ' ' B' ' 35' ' ' LEU . 9.5 mt -62.37 -53.13 59.42 Favored 'General case' 0 N--CA 1.485 1.321 0 CA-C-N 123.984 3.084 . . . . 0.0 115.306 175.148 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 36' ' ' GLN . . . . . . . . . . . . 0.271 0.5 OUTLIER -63.89 -33.12 74.99 Favored 'General case' 0 CA--C 1.58 2.109 0 N-CA-C 115.963 1.838 . . . . 0.0 115.963 179.644 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 37' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -71.71 -31.05 40.41 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.703 0 CA-C-N 121.058 1.754 . . . . 0.0 115.183 160.905 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 38' ' ' VAL . . . . . 0.429 ' CG1' HD22 ' A' ' 19' ' ' LEU . 2.4 t -80.15 -49.02 19.58 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.262 0 CA-C-N 122.682 2.492 . . . . 0.0 112.328 -179.033 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 32.4 mt-30 -47.01 -41.41 16.39 Favored 'General case' 0 CA--C 1.563 1.448 0 CA-C-O 116.72 -1.61 . . . . 0.0 113.856 149.447 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 40' ' ' ASP . . . . . . . . . . . . 0.447 8.1 t70 -51.32 -55.07 20.33 Favored 'General case' 0 N--CA 1.497 1.899 0 CA-C-N 121.766 2.075 . . . . 0.0 115.936 155.212 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -73.63 -33.31 64.49 Favored 'General case' 0 CA--C 1.552 1.023 0 N-CA-C 116.431 2.012 . . . . 0.0 116.431 -153.467 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -104.82 -10.01 17.66 Favored 'General case' 0 N--CA 1.488 1.444 0 N-CA-C 118.691 2.849 . . . . 0.0 118.691 156.273 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 43' ' ' SER . . . . . . . . . . . . . 60.0 p -140.32 6.34 2.12 Favored 'General case' 0 N--CA 1.496 1.873 0 N-CA-C 120.675 3.583 . . . . 0.0 120.675 -173.979 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 44' ' ' LYS . . . . . . . . . . . . 0.4 1.6 mtmt -65.36 139.87 97.54 Favored Pre-proline 0 N--CA 1.53 3.542 1 CA-C-N 126.103 4.047 . . . . 0.0 114.807 -174.377 . . . . . . . . 3 2 . 1 . 011 nuclear nobuild full ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 42.8 Cg_exo -48.31 131.09 22.18 Favored 'Trans proline' 0 C--N 1.379 2.14 0 N-CA-C 120.432 3.205 . . . . 0.0 120.432 -155.46 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 46' ' ' SER . . . . . 0.431 ' HA ' ' HA ' ' B' ' 47' ' ' PRO . 91.0 p -139.97 100.09 7.31 Favored Pre-proline 0 CA--C 1.57 1.745 0 CA-C-O 117.735 -1.126 . . . . 0.0 113.379 -159.801 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 47' ' ' PRO . . . . . 0.431 ' HA ' ' HA ' ' B' ' 46' ' ' SER . 81.7 Cg_endo -81.5 143.83 59.88 Favored 'Cis proline' 0 CA--C 1.571 2.328 0 CA-C-N 122.787 2.031 . . . . 0.0 116.101 -3.121 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 48' ' ' VAL . . . . . . . . . . . . . 96.1 t -75.51 -38.03 38.45 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.423 0 O-C-N 120.46 -1.4 . . . . 0.0 112.053 141.607 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 49' ' ' THR . . . . . 0.569 HG23 ' H ' ' B' ' 50' ' ' GLY 0.284 4.2 t -168.26 -75.86 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.714 0 CA-C-O 123.585 1.659 . . . . 0.0 108.681 -155.838 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 50' ' ' GLY . . . . . 0.569 ' H ' HG23 ' B' ' 49' ' ' THR . . . 166.29 87.13 0.06 OUTLIER Glycine 0 CA--C 1.549 2.214 0 CA-C-N 112.094 -2.321 . . . . 0.0 115.066 156.195 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 51' ' ' TYR . . . . . . . . . . . . 0.313 1.4 m-30 62.65 66.17 0.78 Allowed 'General case' 0 CA--C 1.577 2.0 2 O-C-N 113.646 -5.62 . . . . 0.0 117.268 -16.186 . . . . . . . . 3 2 . 1 . 011 nuclear nobuild full ' B' B ' 52' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -154.64 112.4 3.45 Favored 'General case' 0 N--CA 1.5 2.05 0 C-N-CA 124.307 1.043 . . . . 0.0 108.8 174.238 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 53' ' ' ASN . . . . . 0.702 ' HA ' ' H ' ' A' ' 54' ' ' ASP 0.762 0.2 OUTLIER -70.49 119.23 14.35 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 118.669 -2.52 . . . . 0.0 111.595 -171.886 . . . . . . . . 4 4 . 1 . 011 nuclear nobuild full ' B' B ' 54' ' ' ASP . . . . . 0.671 ' C ' ' H ' ' B' ' 57' ' ' ARG 2.402 0.0 OUTLIER 59.94 5.11 0.69 Allowed 'General case' 0 N--CA 1.521 3.091 1 O-C-N 115.315 -4.616 . . . . 0.0 115.807 12.37 . . . . . . . . 5 4 . 1 . 011 nuclear nobuild full ' B' B ' 55' ' ' ALA . . . . . 0.616 ' N ' ' H ' ' B' ' 57' ' ' ARG 1.849 . . -124.57 -43.25 2.04 Favored 'General case' 0 CA--C 1.57 1.713 0 O-C-N 118.216 -2.803 . . . . 0.0 112.725 -179.907 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 56' ' ' GLU . . . . . 0.844 ' O ' ' HB3' ' B' ' 59' ' ' ALA 0.279 6.7 tp10 -2.96 -36.8 0.0 OUTLIER 'General case' 0 CA--C 1.618 3.562 1 N-CA-C 124.172 4.879 . . . . 0.0 124.172 94.517 . . . . . . . . 4 3 . 1 . 011 nuclear nobuild full ' B' B ' 57' ' ' ARG . . . . . 0.671 ' H ' ' C ' ' B' ' 54' ' ' ASP 0.289 45.6 ttt-85 -65.05 -48.72 72.8 Favored 'General case' 0 N--CA 1.501 2.123 1 O-C-N 116.174 -4.078 . . . . 0.0 111.562 152.274 . . . . . . . . 4 3 . 1 . 011 nuclear nobuild full ' B' B ' 58' ' ' LEU . . . . . . . . . . . . 0.264 5.2 mt -58.36 -24.83 61.03 Favored 'General case' 0 N--CA 1.507 2.419 0 N-CA-C 114.146 1.165 . . . . 0.0 114.146 170.828 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 59' ' ' ALA . . . . . 0.844 ' HB3' ' O ' ' B' ' 56' ' ' GLU . . . -44.22 -88.31 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.564 0 CA-C-O 116.021 -1.943 . . . . 0.0 114.721 137.1 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 60' ' ' ASP . . . . . 0.487 ' HB2' ' OH ' ' A' ' 51' ' ' TYR . 4.1 m-20 -69.32 -6.41 29.48 Favored 'General case' 0 N--CA 1.497 1.876 0 N-CA-C 119.72 3.23 . . . . 0.0 119.72 -161.499 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 13.2 mm-40 -83.2 -51.54 7.39 Favored 'General case' 0 N--CA 1.483 1.199 0 CA-C-O 117.245 -1.36 . . . . 0.0 114.201 157.663 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -77.43 -69.6 0.52 Allowed 'General case' 0 C--N 1.358 0.953 0 CA-C-N 123.107 2.685 . . . . 0.0 108.674 175.358 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 63' ' ' SER . . . . . 0.792 ' HA ' HG11 ' B' ' 66' ' ' VAL 0.322 4.0 t -67.01 43.39 0.03 OUTLIER 'General case' 0 CA--C 1.577 1.994 0 N-CA-C 119.158 3.021 . . . . 0.0 119.158 159.293 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 64' ' ' GLU . . . . . . . . . . . . . 5.8 tt0 -142.42 16.49 2.03 Favored 'General case' 0 CA--C 1.582 2.21 0 O-C-N 119.258 -2.151 . . . . 0.0 116.754 121.479 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 45.6 mt -106.33 -35.86 7.02 Favored 'General case' 0 N--CA 1.512 2.637 0 CA-C-N 122.048 2.203 . . . . 0.0 114.767 165.844 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 66' ' ' VAL . . . . . 0.792 HG11 ' HA ' ' B' ' 63' ' ' SER . 7.6 p . . . . . 0 N--CA 1.499 2.014 1 N-CA-C 124.06 4.837 . . . . 0.0 124.06 143.68 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.563 1.457 0 N-CA-C 113.477 0.917 . . . . 0.0 113.477 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 -81.51 74.09 8.52 Favored 'General case' 0 N--CA 1.498 1.95 0 O-C-N 121.021 -1.049 . . . . 0.0 112.763 -178.876 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -123.44 76.31 1.39 Allowed 'General case' 0 N--CA 1.491 1.608 0 N-CA-C 107.559 -1.274 . . . . 0.0 107.559 -179.812 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 12.1 p-10 -154.66 81.56 4.34 Favored Pre-proline 0 CA--C 1.57 1.714 0 O-C-N 121.499 -0.751 . . . . 0.0 110.485 177.48 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_exo -98.21 145.95 0.64 Allowed 'Trans proline' 0 C--N 1.364 1.39 0 CA-C-N 123.059 2.128 . . . . 0.0 114.537 -153.793 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 81.0 m80 -75.46 132.85 41.1 Favored 'General case' 0 CA--C 1.563 1.475 0 CA-C-N 113.999 -1.455 . . . . 0.0 112.603 174.569 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . 0.645 ' CZ ' HD23 ' B' ' 34' ' ' LEU . 5.1 p90 -133.28 154.21 50.89 Favored 'General case' 0 CA--C 1.563 1.444 0 O-C-N 120.815 -1.178 . . . . 0.0 110.412 146.843 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 4.2 p-10 -59.77 86.44 0.01 OUTLIER 'General case' 0 CA--C 1.566 1.568 0 N-CA-C 115.744 1.757 . . . . 0.0 115.744 168.193 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . 0.424 ' HD2' HD21 ' A' ' 34' ' ' LEU 0.26 2.6 t80 -82.26 141.51 32.88 Favored 'General case' 0 CA--C 1.564 1.511 0 CA-C-O 126.375 2.988 . . . . 0.0 110.273 162.019 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 23.2 ttt85 -166.56 121.43 1.13 Allowed 'General case' 0 C--N 1.309 -1.174 0 CA-C-N 111.466 -2.607 . . . . 0.0 107.911 -146.482 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 2.3 mpt? -133.63 119.49 15.09 Favored Pre-proline 0 CA--C 1.56 1.336 0 CA-C-O 117.73 -1.129 . . . . 0.0 111.314 -148.498 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_exo -46.59 146.27 5.47 Favored 'Trans proline' 0 CA--C 1.561 1.841 0 C-N-CA 122.68 2.253 . . . . 0.0 114.931 161.61 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 10.4 tpp -64.83 -27.99 69.25 Favored 'General case' 0 CA--C 1.568 1.672 0 N-CA-C 118.386 2.736 . . . . 0.0 118.386 -151.188 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . 0.25 8.2 pt-20 -64.63 -43.71 92.83 Favored 'General case' 0 CA--C 1.566 1.593 0 N-CA-C 116.654 2.094 . . . . 0.0 116.654 160.609 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -59.7 -48.2 88.38 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.275 0 CA-C-N 123.269 2.759 . . . . 0.0 112.603 173.231 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 2.0 ttt180 -71.36 -40.28 70.76 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-O 116.265 -1.826 . . . . 0.0 115.611 174.486 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -60.85 -38.71 86.45 Favored 'General case' 0 CA--C 1.567 1.62 0 CA-C-N 123.349 2.795 . . . . 0.0 114.007 166.036 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 52.2 mtmt -66.9 -51.1 59.46 Favored 'General case' 0 CA--C 1.562 1.42 0 CA-C-N 121.362 1.892 . . . . 0.0 115.363 170.791 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.626 HD21 HD22 ' A' ' 34' ' ' LEU 0.281 14.1 tp -65.44 -39.76 92.46 Favored 'General case' 0 CA--C 1.566 1.564 0 N-CA-C 115.542 1.682 . . . . 0.0 115.542 173.863 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 18.9 ttpt -88.2 -25.97 22.63 Favored 'General case' 0 CA--C 1.567 1.629 0 C-N-CA 124.923 1.289 . . . . 0.0 113.922 -179.754 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . 0.456 ' O ' ' HB3' ' A' ' 25' ' ' ALA . 19.5 m-30 -67.47 -66.72 0.53 Allowed 'General case' 0 N--CA 1.493 1.693 0 CA-C-O 113.929 -2.938 . . . . 0.0 110.812 158.545 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . 0.336 1.6 tmt_? -27.04 -45.99 0.03 OUTLIER 'General case' 0 CA--C 1.602 2.944 0 CA-C-N 125.699 3.863 . . . . 0.0 114.614 164.528 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.498 ' HB2' ' HB3' ' A' ' 33' ' ' GLU . . . -59.73 -74.87 0.06 Allowed 'General case' 0 CA--C 1.585 2.29 0 N-CA-C 117.298 2.333 . . . . 0.0 117.298 159.314 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -68.97 -39.52 79.41 Favored 'General case' 0 N--CA 1.502 2.141 0 N-CA-C 118.72 2.859 . . . . 0.0 118.72 -179.023 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.456 ' HB3' ' O ' ' A' ' 21' ' ' PHE . . . -41.83 -51.38 4.27 Favored 'General case' 0 CA--C 1.587 2.397 0 N-CA-C 115.929 1.826 . . . . 0.0 115.929 157.084 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 84.8 m-20 -83.13 -48.21 10.8 Favored 'General case' 0 N--CA 1.5 2.041 0 N-CA-C 116.126 1.899 . . . . 0.0 116.126 177.22 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 119.45 26.87 2.3 Favored Glycine 0 CA--C 1.56 2.886 0 N-CA-C 118.651 2.22 . . . . 0.0 118.651 -157.775 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 24.5 mtm-85 -115.7 158.89 22.11 Favored 'General case' 0 N--CA 1.491 1.594 0 CA-C-N 119.696 1.748 . . . . 0.0 107.161 167.066 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 43.1 t -114.6 113.73 24.77 Favored 'General case' 0 N--CA 1.496 1.845 0 N-CA-C 104.35 -2.463 . . . . 0.0 104.35 -178.082 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 6.2 mtp -38.03 -40.32 0.47 Allowed 'General case' 0 N--CA 1.501 2.084 0 N-CA-C 121.01 3.708 . . . . 0.0 121.01 -152.111 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . 0.253 0.1 OUTLIER -47.87 -46.79 31.71 Favored 'General case' 0 CA--C 1.592 2.56 0 O-C-N 118.575 -2.578 . . . . 0.0 115.446 163.93 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . 0.354 38.4 t -47.4 -76.14 0.02 OUTLIER 'General case' 0 N--CA 1.5 2.064 0 N-CA-C 118.151 2.649 . . . . 0.0 118.151 142.444 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . 0.498 ' HB3' ' HB2' ' A' ' 23' ' ' ALA . 8.5 tp10 -62.87 -56.76 14.42 Favored 'General case' 0 N--CA 1.507 2.39 0 CA-C-N 123.185 2.72 . . . . 0.0 117.261 -170.057 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.734 HD23 ' CZ ' ' B' ' 7' ' ' PHE 0.458 0.4 OUTLIER -47.04 -42.01 17.74 Favored 'General case' 0 CA--C 1.563 1.445 0 CA-C-O 113.274 -3.251 . . . . 0.0 107.313 168.863 . . . . . . . . 4 4 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 12.8 mt -61.09 -48.09 83.32 Favored 'General case' 0 N--CA 1.499 1.996 1 CA-C-N 127.11 4.504 . . . . 0.0 116.529 166.201 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.28 -43.32 99.07 Favored 'General case' 0 N--CA 1.487 1.41 0 N-CA-C 115.544 1.683 . . . . 0.0 115.544 -179.145 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 5.4 tt -67.57 -35.44 73.09 Favored 'Isoleucine or valine' 0 C--O 1.199 -1.597 0 CA-C-O 114.29 -2.767 . . . . 0.0 115.781 160.508 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.417 HG21 HD12 ' A' ' 34' ' ' LEU . 2.1 t -75.04 -47.67 35.51 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.143 0 CA-C-N 124.398 3.272 . . . . 0.0 112.619 -174.527 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 32.9 mt-30 -50.52 -46.71 57.41 Favored 'General case' 0 N--CA 1.486 1.341 0 N-CA-C 113.116 0.784 . . . . 0.0 113.116 156.026 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . 0.807 0.0 OUTLIER -55.83 -34.24 65.2 Favored 'General case' 0 CA--C 1.576 1.972 0 N-CA-C 119.555 3.169 . . . . 0.0 119.555 159.971 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . . . . -77.46 -49.62 14.4 Favored 'General case' 0 N--CA 1.481 1.105 0 N-CA-C 115.142 1.534 . . . . 0.0 115.142 -166.307 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 2.5 pp -90.51 1.07 57.04 Favored 'General case' 0 CA--C 1.57 1.734 0 N-CA-C 117.746 2.499 . . . . 0.0 117.746 164.437 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 60.0 m -137.58 45.36 2.18 Favored 'General case' 0 N--CA 1.498 1.97 0 CA-C-N 122.443 2.383 . . . . 0.0 115.806 166.855 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . 0.286 6.9 tmtt? -64.73 -66.49 1.42 Allowed Pre-proline 0 N--CA 1.504 2.272 0 N-CA-C 119.076 2.991 . . . . 0.0 119.076 173.554 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -85.65 98.84 0.62 Allowed 'Trans proline' 0 CA--C 1.559 1.755 0 CA-C-N 124.025 2.473 . . . . 0.0 117.96 -139.392 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 74.4 m -109.68 -57.08 0.05 OUTLIER Pre-proline 0 CA--C 1.571 1.773 0 CA-C-O 115.862 -2.018 . . . . 0.0 113.121 128.935 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -86.6 57.88 3.82 Favored 'Trans proline' 0 C--N 1.375 1.958 0 CA-C-N 125.789 3.103 . . . . 0.0 117.01 -170.517 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 65.5 t -79.95 -59.5 2.89 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.516 0 O-C-N 121.764 -0.585 . . . . 0.0 112.535 179.281 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . 0.331 11.5 t 37.28 54.66 1.33 Allowed 'General case' 0 N--CA 1.509 2.481 0 N-CA-C 120.982 3.697 . . . . 0.0 120.982 158.566 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 132.07 -44.72 1.18 Allowed Glycine 0 N--CA 1.496 2.675 0 N-CA-C 116.194 1.238 . . . . 0.0 116.194 -165.315 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . 0.446 ' CG ' ' HB2' ' B' ' 57' ' ' ARG . 45.7 m-85 -69.33 101.42 1.52 Allowed 'General case' 0 CA--C 1.566 1.586 0 CA-C-N 118.591 1.195 . . . . 0.0 113.252 178.033 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 99.9 mtt180 -68.74 35.2 0.03 OUTLIER 'General case' 0 CA--C 1.592 2.593 0 N-CA-C 117.125 2.269 . . . . 0.0 117.125 165.642 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . 0.596 ' HA ' ' HB2' ' A' ' 55' ' ' ALA . 3.2 m-80 -157.97 166.88 31.46 Favored 'General case' 0 CA--C 1.578 2.043 0 C-N-CA 126.842 2.057 . . . . 0.0 110.747 167.067 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -78.05 92.85 4.41 Favored 'General case' 0 CA--C 1.555 1.163 2 O-C-N 112.534 -6.354 . . . . 0.0 109.823 3.658 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . 0.596 ' HB2' ' HA ' ' A' ' 53' ' ' ASN . . . -94.17 -95.1 0.16 Allowed 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 111.97 -2.377 . . . . 0.0 108.678 -158.943 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.546 ' O ' ' HB3' ' A' ' 59' ' ' ALA . 62.9 mm-40 -2.33 -61.3 0.0 OUTLIER 'General case' 0 CA--C 1.564 1.488 1 N-CA-C 124.388 4.958 . . . . 0.0 124.388 107.246 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.422 ' HD3' ' OD1' ' A' ' 53' ' ' ASN 0.364 2.0 mpt_? -71.35 -37.07 71.7 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 118.146 -2.846 . . . . 0.0 114.995 178.306 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.533 ' HA ' ' H ' ' A' ' 61' ' ' GLU 0.645 58.0 mt -93.55 2.71 56.31 Favored 'General case' 0 CA--C 1.599 2.859 0 O-C-N 119.491 -2.006 . . . . 0.0 114.138 165.429 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . 0.546 ' HB3' ' O ' ' A' ' 56' ' ' GLU . . . -63.17 -30.53 71.66 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 117.358 -3.339 . . . . 0.0 116.856 138.607 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -66.39 -29.62 69.82 Favored 'General case' 0 N--CA 1.487 1.383 0 O-C-N 120.135 -1.603 . . . . 0.0 115.2 155.811 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.533 ' H ' ' HA ' ' A' ' 58' ' ' LEU . 2.1 tt0 -50.97 -48.54 61.14 Favored 'General case' 0 N--CA 1.503 2.187 0 CA-C-O 117.491 -1.242 . . . . 0.0 112.19 157.708 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -52.51 -54.33 34.07 Favored 'General case' 0 CA--C 1.558 1.288 0 CA-C-O 114.616 -2.611 . . . . 0.0 112.125 165.164 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . 0.581 ' HA ' HG11 ' A' ' 66' ' ' VAL 0.314 4.9 m -40.91 -30.31 0.13 Allowed 'General case' 0 N--CA 1.515 2.801 0 N-CA-C 120.815 3.635 . . . . 0.0 120.815 161.981 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . 0.337 0.7 OUTLIER -91.6 -4.21 55.54 Favored 'General case' 0 CA--C 1.597 2.784 0 N-CA-C 116.049 1.87 . . . . 0.0 116.049 170.795 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -142.14 44.97 1.67 Allowed 'General case' 0 CA--C 1.599 2.862 0 C-N-CA 127.705 2.402 . . . . 0.0 112.886 173.911 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.581 HG11 ' HA ' ' A' ' 63' ' ' SER 0.259 2.7 p . . . . . 0 N--CA 1.513 2.722 0 C-N-CA 126.538 1.935 . . . . 0.0 112.919 -168.252 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.565 1.556 0 N-CA-C 115.502 1.667 . . . . 0.0 115.502 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 2' ' ' ARG . . . . . . . . . . . . 0.294 53.6 ptt85 37.15 46.27 0.55 Allowed 'General case' 0 N--CA 1.505 2.307 0 N-CA-C 121.62 3.933 . . . . 0.0 121.62 174.349 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -138.19 75.45 1.52 Allowed 'General case' 0 CA--C 1.564 1.487 0 CA-C-O 122.328 1.061 . . . . 0.0 111.19 -176.153 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 4' ' ' ASP . . . . . . . . . . . . . 1.4 p30 -130.64 73.01 81.6 Favored Pre-proline 0 CA--C 1.565 1.53 0 N-CA-C 113.089 0.774 . . . . 0.0 113.089 153.437 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 62.7 Cg_endo -62.11 173.69 3.03 Favored 'Trans proline' 0 CA--C 1.566 2.107 0 C-N-CA 122.632 2.221 . . . . 0.0 116.127 153.485 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 6' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -153.68 159.95 42.2 Favored 'General case' 0 CA--C 1.552 1.028 0 CA-C-N 113.797 -1.547 . . . . 0.0 114.88 -149.802 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 7' ' ' PHE . . . . . 0.734 ' CZ ' HD23 ' A' ' 34' ' ' LEU . 36.9 p90 -142.29 156.58 45.28 Favored 'General case' 0 CA--C 1.56 1.328 0 CA-C-O 122.499 1.142 . . . . 0.0 109.145 161.01 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 8' ' ' ASN . . . . . . . . . . . . . 91.6 m-20 -76.0 87.27 2.93 Favored 'General case' 0 CA--C 1.566 1.581 0 O-C-N 119.922 -1.736 . . . . 0.0 110.716 172.128 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 9' ' ' PHE . . . . . . . . . . . . . 4.8 t80 -62.7 142.3 58.18 Favored 'General case' 0 CA--C 1.56 1.35 0 CA-C-O 125.323 2.487 . . . . 0.0 111.245 171.001 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -148.05 96.78 2.69 Favored 'General case' 0 N--CA 1.486 1.358 0 CA-C-N 111.657 -2.52 . . . . 0.0 107.986 -147.015 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 11' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -114.23 118.26 42.26 Favored Pre-proline 0 CA--C 1.567 1.607 0 CA-C-O 117.135 -1.412 . . . . 0.0 112.012 -156.053 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 12' ' ' PRO . . . . . . . . . . . . . 80.3 Cg_exo -42.57 140.57 2.67 Favored 'Trans proline' 0 C--N 1.373 1.848 0 C-N-CA 123.389 2.726 . . . . 0.0 116.252 164.544 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 13' ' ' MET . . . . . . . . . . . . . 25.9 tpp -58.71 -26.53 64.0 Favored 'General case' 0 N--CA 1.498 1.931 0 N-CA-C 119.003 2.964 . . . . 0.0 119.003 -157.818 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 14' ' ' GLU . . . . . . . . . . . . 0.297 7.0 pt-20 -61.28 -50.96 70.92 Favored 'General case' 0 CA--C 1.566 1.588 0 N-CA-C 115.905 1.817 . . . . 0.0 115.905 160.161 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -58.8 -52.88 54.87 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.794 0 CA-C-N 122.092 2.224 . . . . 0.0 112.109 174.013 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 16' ' ' ARG . . . . . . . . . . . . 0.261 1.8 ttt180 -69.01 -33.21 73.27 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-N 122.255 2.298 . . . . 0.0 115.857 177.889 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 17' ' ' GLU . . . . . . . . . . . . . 5.4 pt-20 -65.3 -44.73 86.98 Favored 'General case' 0 N--CA 1.487 1.385 0 CA-C-N 123.326 2.784 . . . . 0.0 113.948 164.988 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . 0.296 52.5 mtmt -53.12 -55.86 20.8 Favored 'General case' 0 N--CA 1.487 1.412 0 N-CA-C 115.765 1.765 . . . . 0.0 115.765 166.006 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 19' ' ' LEU . . . . . 0.702 HD13 HD22 ' B' ' 34' ' ' LEU . 0.3 OUTLIER -71.87 -32.91 67.94 Favored 'General case' 0 CA--C 1.566 1.558 0 N-CA-C 116.321 1.971 . . . . 0.0 116.321 -179.984 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 20' ' ' LYS . . . . . 0.409 ' HA ' ' HB3' ' B' ' 23' ' ' ALA . 7.6 ttpt -87.29 -21.62 25.65 Favored 'General case' 0 CA--C 1.57 1.72 0 C-N-CA 124.78 1.232 . . . . 0.0 113.78 173.413 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 21' ' ' PHE . . . . . 0.444 ' O ' ' HB3' ' B' ' 25' ' ' ALA . 10.5 m-85 -66.25 -66.7 0.52 Allowed 'General case' 0 N--CA 1.49 1.53 0 CA-C-N 122.132 2.242 . . . . 0.0 110.635 155.195 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 22' ' ' ARG . . . . . 0.571 ' HE ' HG13 ' B' ' 37' ' ' ILE 0.274 1.8 tpt180 -21.48 -53.27 0.02 OUTLIER 'General case' 0 CA--C 1.596 2.742 0 CA-C-N 124.459 3.299 . . . . 0.0 115.259 160.052 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 23' ' ' ALA . . . . . 0.41 ' HB2' ' HB3' ' B' ' 33' ' ' GLU 0.318 . . -54.18 -77.0 0.03 OUTLIER 'General case' 0 CA--C 1.577 2.0 0 N-CA-C 120.546 3.536 . . . . 0.0 120.546 154.066 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 50.6 mm-40 -74.19 -34.38 63.73 Favored 'General case' 0 CA--C 1.576 1.968 0 N-CA-C 118.766 2.876 . . . . 0.0 118.766 -175.836 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 25' ' ' ALA . . . . . 0.444 ' HB3' ' O ' ' B' ' 21' ' ' PHE . . . -46.2 -52.41 12.45 Favored 'General case' 0 CA--C 1.579 2.083 0 N-CA-C 116.015 1.857 . . . . 0.0 116.015 154.562 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 26' ' ' ASN . . . . . . . . . . . . . 72.0 m-20 -82.5 -56.8 3.66 Favored 'General case' 0 CA--C 1.575 1.935 0 N-CA-C 114.536 1.31 . . . . 0.0 114.536 179.236 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 27' ' ' GLY . . . . . . . . . . . . . . . 128.17 28.28 0.86 Allowed Glycine 0 CA--C 1.561 2.952 0 N-CA-C 119.037 2.375 . . . . 0.0 119.037 -166.703 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 28' ' ' ARG . . . . . . . . . . . . 0.254 8.3 mtm-85 -118.13 166.13 12.94 Favored 'General case' 0 N--CA 1.497 1.92 0 N-CA-C 105.682 -1.97 . . . . 0.0 105.682 159.929 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 29' ' ' SER . . . . . 0.465 ' H ' ' HB3' ' B' ' 32' ' ' SER . 87.4 p -115.85 113.24 23.09 Favored 'General case' 0 N--CA 1.498 1.935 0 O-C-N 118.836 -2.415 . . . . 0.0 105.244 -173.098 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 30' ' ' MET . . . . . 0.475 ' CE ' ' HB3' ' B' ' 19' ' ' LEU . 13.3 mtp -36.76 -39.5 0.22 Allowed 'General case' 0 N--CA 1.502 2.174 0 N-CA-C 121.397 3.851 . . . . 0.0 121.397 -147.87 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 31' ' ' ASN . . . . . . . . . . . . 0.3 0.5 OUTLIER -48.56 -50.47 32.06 Favored 'General case' 0 CA--C 1.587 2.368 0 O-C-N 118.857 -2.402 . . . . 0.0 114.662 162.945 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 32' ' ' SER . . . . . 0.465 ' HB3' ' H ' ' B' ' 29' ' ' SER 0.361 35.4 t -47.6 -69.95 0.11 Allowed 'General case' 0 N--CA 1.497 1.923 0 N-CA-C 118.392 2.738 . . . . 0.0 118.392 144.449 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 33' ' ' GLU . . . . . 0.41 ' HB3' ' HB2' ' B' ' 23' ' ' ALA . 6.6 tm-20 -76.15 -50.06 15.61 Favored 'General case' 0 N--CA 1.51 2.569 0 CA-C-N 123.978 3.081 . . . . 0.0 119.022 -169.496 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 34' ' ' LEU . . . . . 0.702 HD22 HD13 ' B' ' 19' ' ' LEU 0.47 0.3 OUTLIER -47.06 -39.12 12.34 Favored 'General case' 0 CA--C 1.579 2.09 0 CA-C-O 113.679 -3.057 . . . . 0.0 107.226 161.82 . . . . . . . . 4 4 . 1 . 012 nuclear nobuild full ' B' B ' 35' ' ' LEU . . . . . 0.414 ' HG ' ' CE1' ' A' ' 9' ' ' PHE . 16.1 mt -65.19 -53.15 49.19 Favored 'General case' 0 N--CA 1.499 1.975 1 CA-C-N 127.692 4.769 . . . . 0.0 114.795 166.341 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 36' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -60.96 -33.79 73.76 Favored 'General case' 0 N--CA 1.493 1.688 0 N-CA-C 115.911 1.819 . . . . 0.0 115.911 -178.034 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 37' ' ' ILE . . . . . 0.571 HG13 ' HE ' ' B' ' 22' ' ' ARG . 0.4 OUTLIER -72.35 -42.2 65.25 Favored 'Isoleucine or valine' 0 C--O 1.2 -1.516 0 CA-C-O 115.115 -2.374 . . . . 0.0 115.383 159.409 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 38' ' ' VAL . . . . . 0.406 ' CG1' HD22 ' A' ' 19' ' ' LEU . 3.0 t -71.79 -48.71 49.9 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.408 0 CA-C-N 124.532 3.333 . . . . 0.0 113.111 -177.18 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 24.3 mt-30 -47.72 -51.1 23.27 Favored 'General case' 0 N--CA 1.476 0.856 0 CA-C-O 115.518 -2.182 . . . . 0.0 111.336 155.216 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 40' ' ' ASP . . . . . . . . . . . . 0.69 0.0 OUTLIER -44.1 -51.99 7.55 Favored 'General case' 0 N--CA 1.493 1.71 0 N-CA-C 117.274 2.324 . . . . 0.0 117.274 161.873 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 41' ' ' ALA . . . . . . . . . . . . 0.305 . . -80.18 -27.68 38.87 Favored 'General case' 0 CA--C 1.562 1.426 0 N-CA-C 116.507 2.04 . . . . 0.0 116.507 -159.812 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 1.1 pp -122.73 30.69 6.35 Favored 'General case' 0 N--CA 1.489 1.523 0 N-CA-C 118.217 2.673 . . . . 0.0 118.217 158.112 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 43' ' ' SER . . . . . . . . . . . . . 20.2 m 152.68 65.15 0.0 OUTLIER 'General case' 0 N--CA 1.505 2.276 0 O-C-N 119.279 -2.138 . . . . 0.0 110.861 107.56 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 44' ' ' LYS . . . . . . . . . . . . 0.367 7.1 ttpm? -90.72 118.88 68.97 Favored Pre-proline 0 N--CA 1.531 3.578 0 N-CA-C 116.23 1.937 . . . . 0.0 116.23 -169.288 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 84.6 Cg_endo -77.85 131.09 10.92 Favored 'Trans proline' 0 CA--C 1.567 2.162 0 C-N-CA 122.728 2.286 . . . . 0.0 115.508 161.08 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 46' ' ' SER . . . . . . . . . . . . 0.319 69.4 m -106.64 -110.58 0.0 OUTLIER Pre-proline 0 CA--C 1.581 2.15 0 CA-C-O 114.241 -2.79 . . . . 0.0 110.708 171.927 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 25.3 Cg_endo -88.22 58.45 2.8 Favored 'Trans proline' 0 CA--C 1.567 2.153 1 CA-C-N 128.779 4.171 . . . . 0.0 116.137 -179.54 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 48' ' ' VAL . . . . . . . . . . . . . 20.5 t -37.13 118.0 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.508 2.466 0 N-CA-C 116.742 2.127 . . . . 0.0 116.742 -173.333 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 49' ' ' THR . . . . . . . . . . . . 0.671 0.5 OUTLIER 75.94 15.5 2.47 Favored 'General case' 0 N--CA 1.508 2.431 3 O-C-N 112.226 -6.546 . . . . 0.0 123.121 -13.352 . . . . . . . . 4 3 . 1 . 012 nuclear nobuild full ' B' B ' 50' ' ' GLY . . . . . . . . . . . . . . . 72.81 31.71 62.05 Favored Glycine 0 N--CA 1.502 3.044 0 N-CA-C 121.475 3.35 . . . . 0.0 121.475 165.645 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 51' ' ' TYR . . . . . . . . . . . . . 20.4 m-85 -77.02 89.43 3.56 Favored 'General case' 0 CA--C 1.576 1.968 0 CA-C-N 118.974 1.387 . . . . 0.0 113.668 -178.277 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 52' ' ' ARG . . . . . . . . . . . . . 69.1 ttt-85 -153.9 68.86 0.77 Allowed 'General case' 0 N--CA 1.5 2.062 0 N-CA-C 114.648 1.351 . . . . 0.0 114.648 176.42 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 53' ' ' ASN . . . . . 0.49 ' HB3' ' HB2' ' A' ' 53' ' ' ASN . 0.1 OUTLIER -171.96 166.74 6.27 Favored 'General case' 0 N--CA 1.503 2.223 0 N-CA-C 116.411 2.004 . . . . 0.0 116.411 167.025 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 54' ' ' ASP . . . . . 0.433 ' H ' HD22 ' B' ' 53' ' ' ASN 1.036 0.0 OUTLIER 47.91 13.5 0.04 OUTLIER 'General case' 0 N--CA 1.522 3.133 1 N-CA-C 125.738 5.459 . . . . 0.0 125.738 148.145 . . . . . . . . 5 4 . 1 . 012 nuclear nobuild full ' B' B ' 55' ' ' ALA . . . . . . . . . . . . 0.34 . . 0.16 -79.02 0.0 OUTLIER 'General case' 0 CA--C 1.595 2.676 2 O-C-N 114.344 -5.222 . . . . 0.0 122.481 83.467 . . . . . . . . 3 2 . 1 . 012 nuclear nobuild full ' B' B ' 56' ' ' GLU . . . . . 0.431 ' C ' ' HB3' ' B' ' 59' ' ' ALA . 23.9 mp0 -39.46 -4.76 0.0 OUTLIER 'General case' 0 CA--C 1.592 2.591 1 N-CA-C 122.599 4.296 . . . . 0.0 122.599 148.522 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 57' ' ' ARG . . . . . 0.446 ' HB2' ' CG ' ' A' ' 51' ' ' TYR . 0.2 OUTLIER -103.35 -35.17 8.5 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 119.751 -1.843 . . . . 0.0 114.286 167.264 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 58' ' ' LEU . . . . . . . . . . . . . 93.9 mt -62.73 -45.61 91.93 Favored 'General case' 0 N--CA 1.501 2.094 0 CA-C-N 120.61 1.55 . . . . 0.0 113.931 164.814 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 59' ' ' ALA . . . . . 0.431 ' HB3' ' C ' ' B' ' 56' ' ' GLU . . . -24.25 -76.36 0.02 OUTLIER 'General case' 0 N--CA 1.486 1.369 0 N-CA-C 119.825 3.268 . . . . 0.0 119.825 141.243 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -86.32 3.64 42.55 Favored 'General case' 0 CA--C 1.551 1.007 0 N-CA-C 115.726 1.75 . . . . 0.0 115.726 -168.36 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 61' ' ' GLU . . . . . . . . . . . . 0.257 19.7 tt0 -65.7 -62.97 1.21 Allowed 'General case' 0 N--CA 1.482 1.17 0 CA-C-O 115.427 -2.225 . . . . 0.0 112.439 145.501 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 62' ' ' GLN . . . . . 0.699 ' O ' HG13 ' B' ' 66' ' ' VAL 0.506 1.0 OUTLIER -74.02 -66.69 0.68 Allowed 'General case' 0 C--N 1.367 1.348 0 CA-C-N 123.148 2.704 . . . . 0.0 112.42 -176.322 . . . . . . . . 4 4 . 1 . 012 nuclear nobuild full ' B' B ' 63' ' ' SER . . . . . . . . . . . . 0.321 46.2 t -72.96 46.44 0.17 Allowed 'General case' 0 CA--C 1.575 1.931 0 N-CA-C 118.082 2.623 . . . . 0.0 118.082 164.078 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 64' ' ' GLU . . . . . . . . . . . . . 11.5 tt0 -125.28 -32.24 2.97 Favored 'General case' 0 CA--C 1.573 1.856 0 O-C-N 120.083 -1.636 . . . . 0.0 114.21 125.794 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 39.9 mt -78.03 -22.32 49.39 Favored 'General case' 0 N--CA 1.505 2.318 0 CA-C-N 122.021 2.191 . . . . 0.0 116.477 -179.32 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 66' ' ' VAL . . . . . 0.699 HG13 ' O ' ' B' ' 62' ' ' GLN . 19.4 m . . . . . 0 N--CA 1.507 2.386 0 N-CA-C 119.576 3.176 . . . . 0.0 119.576 170.707 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.567 1.633 0 N-CA-C 117.244 2.313 . . . . 0.0 117.244 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . 0.367 55.1 ptt85 45.7 51.24 10.33 Favored 'General case' 0 N--CA 1.501 2.106 0 N-CA-C 119.053 2.983 . . . . 0.0 119.053 -174.493 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -164.49 -44.09 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.495 0 O-C-N 120.783 -1.198 . . . . 0.0 113.008 169.438 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 47.8 t0 -145.55 90.2 6.05 Favored Pre-proline 0 CA--C 1.571 1.757 0 N-CA-C 108.549 -0.908 . . . . 0.0 108.549 157.388 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 2.8 Cg_endo -106.07 149.68 0.12 Allowed 'Trans proline' 0 C--N 1.371 1.722 0 C-N-CA 122.461 2.107 . . . . 0.0 114.643 -164.723 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 74.5 m80 -89.89 138.52 31.42 Favored 'General case' 0 N--CA 1.489 1.485 0 N-CA-C 113.605 0.965 . . . . 0.0 113.605 -178.744 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . 0.781 ' CZ ' HD12 ' B' ' 34' ' ' LEU . 15.8 p90 -128.26 157.35 41.15 Favored 'General case' 0 CA--C 1.566 1.583 0 O-C-N 120.193 -1.567 . . . . 0.0 110.726 144.654 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 85.5 m-20 -71.4 88.02 0.88 Allowed 'General case' 0 N--CA 1.491 1.598 0 O-C-N 119.938 -1.726 . . . . 0.0 111.666 169.956 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . 0.604 ' CD2' HD13 ' B' ' 34' ' ' LEU . 2.2 t80 -66.45 151.33 47.42 Favored 'General case' 0 CA--C 1.556 1.185 0 CA-C-O 125.319 2.485 . . . . 0.0 111.014 157.728 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -166.97 99.87 0.54 Allowed 'General case' 0 N--CA 1.488 1.428 0 CA-C-N 111.666 -2.516 . . . . 0.0 108.074 -142.545 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 1.3 mpt? -125.43 117.4 25.0 Favored Pre-proline 0 CA--C 1.561 1.392 0 CA-C-O 116.727 -1.606 . . . . 0.0 112.831 -151.213 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 82.7 Cg_exo -42.66 145.98 0.9 Allowed 'Trans proline' 0 CA--C 1.561 1.869 0 C-N-CA 123.062 2.508 . . . . 0.0 116.679 166.13 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -52.61 -38.45 60.2 Favored 'General case' 0 N--CA 1.498 1.932 0 N-CA-C 117.43 2.382 . . . . 0.0 117.43 -160.713 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . 0.26 9.9 pt-20 -64.59 -42.54 95.52 Favored 'General case' 0 CA--C 1.563 1.476 0 N-CA-C 116.719 2.118 . . . . 0.0 116.719 167.239 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -60.55 -50.31 80.89 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.191 0 CA-C-N 123.977 3.08 . . . . 0.0 113.005 173.795 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 1.2 ttt180 -68.65 -40.95 80.01 Favored 'General case' 0 C--O 1.215 -0.722 0 CA-C-O 115.983 -1.961 . . . . 0.0 115.467 173.191 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -58.5 -41.41 85.3 Favored 'General case' 0 CA--C 1.565 1.521 0 CA-C-N 123.858 3.026 . . . . 0.0 114.427 164.033 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . 0.277 48.8 mtmt -63.07 -54.67 34.4 Favored 'General case' 0 CA--C 1.562 1.418 0 CA-C-N 121.337 1.88 . . . . 0.0 115.046 169.94 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.728 HD13 HD22 ' A' ' 34' ' ' LEU . 9.0 mt -62.53 -38.16 88.88 Favored 'General case' 0 CA--C 1.57 1.747 0 N-CA-C 116.532 2.049 . . . . 0.0 116.532 172.832 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 14.3 ttpt -89.32 -24.94 21.88 Favored 'General case' 0 CA--C 1.57 1.718 0 C-N-CA 125.202 1.401 . . . . 0.0 113.19 -177.733 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . 0.471 ' O ' ' HB3' ' A' ' 25' ' ' ALA . 13.3 m-30 -65.23 -65.29 0.69 Allowed 'General case' 0 N--CA 1.49 1.571 0 CA-C-O 115.374 -2.25 . . . . 0.0 111.051 154.363 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . 0.273 7.3 ttm180 -20.71 -54.59 0.02 OUTLIER 'General case' 0 CA--C 1.587 2.401 0 CA-C-N 124.416 3.28 . . . . 0.0 115.922 158.146 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.437 ' HB2' ' HB3' ' A' ' 33' ' ' GLU 0.287 . . -57.87 -74.33 0.06 Allowed 'General case' 0 CA--C 1.585 2.319 0 N-CA-C 118.512 2.782 . . . . 0.0 118.512 158.919 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 15.6 mm-40 -74.13 -36.84 64.21 Favored 'General case' 0 N--CA 1.499 1.976 0 N-CA-C 118.814 2.894 . . . . 0.0 118.814 -175.621 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.471 ' HB3' ' O ' ' A' ' 21' ' ' PHE . . . -46.34 -50.07 16.85 Favored 'General case' 0 CA--C 1.584 2.282 0 N-CA-C 116.091 1.886 . . . . 0.0 116.091 155.187 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 52.2 m-20 -88.44 -43.97 11.08 Favored 'General case' 0 N--CA 1.497 1.916 0 N-CA-C 116.475 2.028 . . . . 0.0 116.475 -175.835 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 116.43 24.37 3.8 Favored Glycine 0 CA--C 1.561 2.908 0 N-CA-C 119.266 2.467 . . . . 0.0 119.266 -163.68 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.502 HH11 ' HG3' ' A' ' 28' ' ' ARG 0.305 2.7 mtm-85 -116.79 167.41 11.13 Favored 'General case' 0 CA--C 1.576 1.958 0 N-CA-C 105.541 -2.022 . . . . 0.0 105.541 163.466 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . 0.4 ' H ' ' HB3' ' A' ' 32' ' ' SER . 28.4 t -126.69 112.7 15.75 Favored 'General case' 0 N--CA 1.506 2.346 0 O-C-N 117.359 -3.338 . . . . 0.0 106.59 -173.793 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' MET . . . . . 0.498 ' CE ' ' HB3' ' A' ' 19' ' ' LEU . 14.2 mtp -38.2 -39.03 0.38 Allowed 'General case' 0 N--CA 1.501 2.096 1 N-CA-C 121.854 4.02 . . . . 0.0 121.854 -144.676 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . 0.425 ' O ' ' HB2' ' A' ' 35' ' ' LEU . 11.6 t-20 -47.15 -53.38 13.14 Favored 'General case' 0 CA--C 1.588 2.413 0 O-C-N 118.713 -2.492 . . . . 0.0 114.186 159.985 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . 0.4 ' HB3' ' H ' ' A' ' 29' ' ' SER 0.308 30.2 t -49.17 -61.43 2.08 Favored 'General case' 0 N--CA 1.501 2.076 0 N-CA-C 120.219 3.415 . . . . 0.0 120.219 148.41 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . 0.437 ' HB3' ' HB2' ' A' ' 23' ' ' ALA . 0.0 OUTLIER -84.14 -47.83 10.48 Favored 'General case' 0 N--CA 1.517 2.918 0 CA-C-N 124.0 3.091 . . . . 0.0 117.829 -174.036 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.728 HD22 HD13 ' A' ' 19' ' ' LEU 0.489 0.3 OUTLIER -50.12 -39.27 42.49 Favored 'General case' 0 CA--C 1.584 2.288 0 CA-C-O 113.744 -3.027 . . . . 0.0 106.326 163.0 . . . . . . . . 4 4 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.425 ' HB2' ' O ' ' A' ' 31' ' ' ASN . 13.8 mt -66.26 -57.15 8.16 Favored 'General case' 0 N--CA 1.499 2.014 1 CA-C-N 127.437 4.653 . . . . 0.0 115.014 169.272 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -56.36 -40.52 74.65 Favored 'General case' 0 CA--C 1.557 1.25 0 CA-C-O 115.54 -2.172 . . . . 0.0 113.719 -179.813 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -70.49 -31.04 45.2 Favored 'Isoleucine or valine' 0 C--O 1.201 -1.481 0 CA-C-N 123.156 2.707 . . . . 0.0 116.254 165.144 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.473 HG11 HD11 ' B' ' 19' ' ' LEU . 2.4 t -75.94 -49.83 24.78 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.136 0 CA-C-N 124.084 3.129 . . . . 0.0 112.077 177.076 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 27.1 mt-30 -46.25 -47.21 18.11 Favored 'General case' 0 N--CA 1.486 1.33 0 CA-C-O 116.662 -1.637 . . . . 0.0 113.214 154.09 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . 0.417 24.7 m-20 -47.33 -67.18 0.3 Allowed 'General case' 0 N--CA 1.491 1.593 0 CA-C-N 120.82 1.646 . . . . 0.0 110.509 158.307 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . . . . . . . . 0.348 . . -66.06 -33.56 76.07 Favored 'General case' 0 CA--C 1.558 1.252 0 N-CA-C 116.975 2.213 . . . . 0.0 116.975 -152.693 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 2.4 pp -105.43 6.06 32.18 Favored 'General case' 0 N--CA 1.492 1.662 0 N-CA-C 120.818 3.636 . . . . 0.0 120.818 159.754 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 74.2 m -143.14 -42.11 0.3 Allowed 'General case' 0 N--CA 1.5 2.06 0 N-CA-C 120.355 3.465 . . . . 0.0 120.355 174.17 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . 0.446 1.1 tmtp? -60.44 -61.42 7.98 Favored Pre-proline 0 N--CA 1.528 3.451 0 N-CA-C 121.432 3.864 . . . . 0.0 121.432 -121.889 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_exo -67.26 102.96 0.72 Allowed 'Trans proline' 0 CA--C 1.57 2.292 0 CA-C-N 125.016 2.827 . . . . 0.0 117.568 -168.025 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 26.3 t -59.51 -49.71 90.83 Favored Pre-proline 0 CA--C 1.575 1.931 0 N-CA-C 119.897 3.295 . . . . 0.0 119.897 -171.753 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 97.2 Cg_endo -72.7 -9.77 24.28 Favored 'Trans proline' 0 N--CA 1.502 1.985 0 N-CA-C 120.947 3.403 . . . . 0.0 120.947 176.617 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . 0.387 84.8 t 70.65 -73.85 0.1 Allowed 'Isoleucine or valine' 0 N--CA 1.5 2.07 0 C-N-CA 125.978 1.711 . . . . 0.0 113.48 165.824 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . 0.362 8.0 t 50.49 53.99 11.95 Favored 'General case' 0 N--CA 1.501 2.097 0 N-CA-C 118.546 2.795 . . . . 0.0 118.546 162.128 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 117.47 -56.32 0.55 Allowed Glycine 0 N--CA 1.496 2.636 0 N-CA-C 118.986 2.354 . . . . 0.0 118.986 175.813 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . 0.535 ' CE1' ' HG2' ' B' ' 56' ' ' GLU 0.499 0.0 OUTLIER -79.48 69.82 5.81 Favored 'General case' 0 CA--C 1.611 3.292 0 N-CA-C 118.376 2.732 . . . . 0.0 118.376 -156.389 . . . . . . . . 4 4 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . 0.507 ' O ' ' HA ' ' B' ' 53' ' ' ASN 0.386 3.5 tpm_? 41.22 166.84 0.0 OUTLIER 'General case' 1 N--CA 1.547 4.395 1 N-CA-C 123.506 4.632 . . . . 0.0 123.506 158.331 . . . . . . . . 5 3 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . 0.466 ' C ' ' HB2' ' B' ' 53' ' ' ASN 2.109 0.1 OUTLIER -114.26 13.61 17.93 Favored 'General case' 2 CA--C 1.664 5.343 2 N-CA-C 134.661 8.763 . . . . 0.0 134.661 -151.491 . . . . . . . . 6 4 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . 0.688 ' HA ' ' HB2' ' B' ' 53' ' ' ASN 1.66 0.0 OUTLIER 57.18 -57.09 0.03 OUTLIER 'General case' 1 N--CA 1.566 5.327 2 O-C-N 108.027 -9.171 . . . . 0.0 121.389 115.108 . . . . . . . . 6 4 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . 0.344 . . -62.97 -48.28 79.53 Favored 'General case' 0 C--N 1.286 -2.162 0 N-CA-C 115.728 1.751 . . . . 0.0 115.728 166.081 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -56.7 -10.46 1.02 Allowed 'General case' 0 CA--C 1.584 2.272 0 N-CA-C 118.831 2.9 . . . . 0.0 118.831 150.411 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.476 ' HB3' ' HB2' ' A' ' 54' ' ' ASP . 37.5 ttt85 -96.47 -38.59 9.95 Favored 'General case' 0 N--CA 1.503 2.218 0 N-CA-C 116.623 2.083 . . . . 0.0 116.623 173.967 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.627 ' O ' ' HB3' ' A' ' 61' ' ' GLU 0.304 22.2 mt -64.61 -19.09 65.47 Favored 'General case' 0 CA--C 1.573 1.856 0 CA-C-O 113.492 -3.147 . . . . 0.0 115.092 160.08 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . 0.587 ' HA ' ' HB3' ' A' ' 61' ' ' GLU . . . -65.52 -36.38 83.65 Favored 'General case' 0 N--CA 1.516 2.837 0 N-CA-C 120.791 3.626 . . . . 0.0 120.791 148.05 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -68.82 17.43 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.597 0 O-C-N 118.319 -2.738 . . . . 0.0 116.803 144.149 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.671 ' HA ' ' H ' ' A' ' 63' ' ' SER 2.142 0.0 OUTLIER 89.85 151.21 0.04 OUTLIER 'General case' 0 CA--C 1.557 1.224 0 N-CA-C 103.729 -2.693 . . . . 0.0 103.729 91.193 . . . . . . . . 4 4 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . 0.51 ' HB3' ' HG3' ' A' ' 61' ' ' GLU . 0.1 OUTLIER -28.95 -50.35 0.08 Allowed 'General case' 0 CA--C 1.581 2.141 1 CA-C-N 101.422 -7.172 . . . . 0.0 118.401 102.32 . . . . . . . . 4 4 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . 0.671 ' H ' ' HA ' ' A' ' 61' ' ' GLU 0.41 36.4 t -109.87 43.52 1.33 Allowed 'General case' 0 CA--C 1.56 1.36 0 N-CA-C 116.418 2.007 . . . . 0.0 116.418 -172.319 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 37.3 tt0 -96.26 -25.73 15.68 Favored 'General case' 0 CA--C 1.57 1.723 0 N-CA-C 116.23 1.937 . . . . 0.0 116.23 106.021 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -68.54 -78.79 0.06 Allowed 'General case' 0 CA--C 1.585 2.314 0 CA-C-N 124.442 3.292 . . . . 0.0 113.26 -177.094 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.407 HG13 ' O ' ' A' ' 62' ' ' GLN 0.501 2.7 m . . . . . 0 N--CA 1.518 2.936 1 N-CA-C 122.431 4.234 . . . . 0.0 122.431 157.625 . . . . . . . . 3 2 . 1 . 013 nuclear nobuild full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.564 1.488 0 N-CA-C 113.802 1.038 . . . . 0.0 113.802 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 2' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -83.0 76.02 9.86 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.013 -1.054 . . . . 0.0 112.609 177.365 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -119.53 70.36 0.85 Allowed 'General case' 0 N--CA 1.49 1.53 0 N-CA-C 108.05 -1.092 . . . . 0.0 108.05 173.601 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 4' ' ' ASP . . . . . . . . . . . . . 8.6 p-10 -152.63 87.39 4.12 Favored Pre-proline 0 CA--C 1.571 1.767 0 O-C-N 121.439 -0.788 . . . . 0.0 110.552 -178.037 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 7.7 Cg_exo -94.45 144.93 1.7 Allowed 'Trans proline' 0 C--N 1.367 1.523 0 CA-C-N 122.937 2.085 . . . . 0.0 114.75 -156.633 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 6' ' ' HIS . . . . . . . . . . . . . 74.2 m80 -79.44 126.74 31.23 Favored 'General case' 0 CA--C 1.565 1.522 0 CA-C-N 113.931 -1.486 . . . . 0.0 111.612 177.107 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 7' ' ' PHE . . . . . 0.52 ' CZ ' HD23 ' A' ' 34' ' ' LEU 0.255 2.3 p90 -131.8 153.44 50.13 Favored 'General case' 0 CA--C 1.561 1.372 0 O-C-N 120.239 -1.538 . . . . 0.0 110.419 146.81 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 8' ' ' ASN . . . . . . . . . . . . . 43.4 p-10 -70.48 77.12 0.57 Allowed 'General case' 0 CA--C 1.569 1.683 0 O-C-N 120.989 -1.069 . . . . 0.0 113.842 172.238 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 9' ' ' PHE . . . . . 0.474 ' HD2' HD11 ' B' ' 34' ' ' LEU . 12.2 t80 -73.52 145.7 45.4 Favored 'General case' 0 CA--C 1.558 1.268 0 CA-C-O 126.666 3.126 . . . . 0.0 110.207 168.262 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 10' ' ' ARG . . . . . . . . . . . . . 1.6 ttp180 -173.74 127.77 0.4 Allowed 'General case' 0 C--N 1.298 -1.652 0 CA-C-N 111.235 -2.711 . . . . 0.0 104.818 -135.847 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 11' ' ' MET . . . . . 0.428 ' HB3' ' HB ' ' B' ' 15' ' ' VAL . 1.3 mpt? -143.04 129.71 10.61 Favored Pre-proline 0 CA--C 1.559 1.307 0 CA-C-O 117.271 -1.347 . . . . 0.0 113.836 -159.896 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 12' ' ' PRO . . . . . . . . . . . . . 85.0 Cg_exo -43.06 146.27 0.98 Allowed 'Trans proline' 0 C--N 1.376 1.987 0 C-N-CA 123.201 2.601 . . . . 0.0 116.005 164.167 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 13' ' ' MET . . . . . . . . . . . . . 1.7 tpt -51.34 -36.41 42.83 Favored 'General case' 0 CA--C 1.57 1.749 0 N-CA-C 117.177 2.288 . . . . 0.0 117.177 -159.868 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 14' ' ' GLU . . . . . . . . . . . . 0.252 7.5 pt-20 -64.04 -51.02 66.13 Favored 'General case' 0 CA--C 1.572 1.799 0 N-CA-C 116.36 1.985 . . . . 0.0 116.36 170.407 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 15' ' ' VAL . . . . . 0.428 ' HB ' ' HB3' ' B' ' 11' ' ' MET . 0.0 OUTLIER -56.03 -49.9 72.87 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.393 0 CA-C-N 123.364 2.802 . . . . 0.0 111.972 171.797 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.4 -24.89 63.02 Favored 'General case' 0 N--CA 1.474 0.758 0 N-CA-C 117.304 2.335 . . . . 0.0 117.304 174.484 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 17' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -68.96 -40.41 78.9 Favored 'General case' 0 N--CA 1.492 1.655 0 CA-C-N 123.273 2.76 . . . . 0.0 113.986 154.632 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . 0.263 53.8 mtmt -71.85 -47.79 50.57 Favored 'General case' 0 CA--C 1.563 1.46 0 CA-C-N 121.534 1.97 . . . . 0.0 115.732 179.157 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 19' ' ' LEU . . . . . 0.547 ' HB3' ' CE ' ' B' ' 30' ' ' MET . 12.6 mt -56.02 -54.55 43.49 Favored 'General case' 0 CA--C 1.566 1.593 0 CA-C-N 120.225 1.375 . . . . 0.0 114.238 158.989 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 20' ' ' LYS . . . . . . . . . . . . . 15.1 ttpt -78.67 -20.84 49.31 Favored 'General case' 0 CA--C 1.572 1.809 0 O-C-N 119.453 -2.029 . . . . 0.0 114.371 -173.191 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 21' ' ' PHE . . . . . 0.465 ' O ' ' HB3' ' B' ' 25' ' ' ALA . 14.2 m-85 -68.62 -68.74 0.37 Allowed 'General case' 0 N--CA 1.489 1.516 0 CA-C-O 113.696 -3.05 . . . . 0.0 111.194 156.218 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . 0.276 13.5 tpp180 -22.97 -49.71 0.02 OUTLIER 'General case' 0 CA--C 1.599 2.86 1 CA-C-N 126.231 4.105 . . . . 0.0 115.554 162.7 . . . . . . . . 3 2 . 1 . 013 nuclear nobuild full ' B' B ' 23' ' ' ALA . . . . . 0.433 ' HB2' ' CB ' ' B' ' 33' ' ' GLU 0.265 . . -60.09 -76.08 0.05 Allowed 'General case' 0 CA--C 1.582 2.176 0 N-CA-C 116.815 2.154 . . . . 0.0 116.815 160.884 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 57.7 mm-40 -71.43 -35.03 70.82 Favored 'General case' 0 N--CA 1.5 2.057 0 N-CA-C 118.921 2.934 . . . . 0.0 118.921 -177.516 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 25' ' ' ALA . . . . . 0.465 ' HB3' ' O ' ' B' ' 21' ' ' PHE . . . -44.69 -50.27 10.02 Favored 'General case' 0 CA--C 1.585 2.32 0 N-CA-C 115.89 1.811 . . . . 0.0 115.89 155.705 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 26' ' ' ASN . . . . . 0.638 HD22 ' HE ' ' B' ' 28' ' ' ARG . 88.4 m-20 -82.74 -43.37 16.88 Favored 'General case' 0 N--CA 1.501 2.124 0 N-CA-C 116.823 2.157 . . . . 0.0 116.823 176.3 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 27' ' ' GLY . . . . . . . . . . . . . . . 106.51 30.29 4.42 Favored Glycine 0 CA--C 1.561 2.936 0 N-CA-C 118.001 1.96 . . . . 0.0 118.001 -152.875 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 28' ' ' ARG . . . . . 0.638 ' HE ' HD22 ' B' ' 26' ' ' ASN . 48.4 mtm180 -114.62 145.39 42.06 Favored 'General case' 0 CA--C 1.57 1.742 0 N-CA-C 104.179 -2.526 . . . . 0.0 104.179 171.852 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 29' ' ' SER . . . . . . . . . . . . . 81.0 p -113.05 115.15 27.91 Favored 'General case' 0 N--CA 1.507 2.419 0 O-C-N 117.964 -2.96 . . . . 0.0 105.896 -170.271 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 30' ' ' MET . . . . . 0.547 ' CE ' ' HB3' ' B' ' 19' ' ' LEU . 32.6 mtp -46.62 -42.18 15.8 Favored 'General case' 0 N--CA 1.498 1.943 0 N-CA-C 118.833 2.901 . . . . 0.0 118.833 -141.566 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 31' ' ' ASN . . . . . . . . . . . . . 6.0 t-20 -45.1 -45.52 11.2 Favored 'General case' 0 CA--C 1.594 2.652 0 CA-C-N 125.974 3.988 . . . . 0.0 115.835 163.225 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 32' ' ' SER . . . . . . . . . . . . 0.274 51.7 m -55.34 -62.73 1.48 Allowed 'General case' 0 N--CA 1.502 2.156 0 N-CA-C 120.47 3.507 . . . . 0.0 120.47 151.963 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 33' ' ' GLU . . . . . 0.433 ' CB ' ' HB2' ' B' ' 23' ' ' ALA . 6.2 tm-20 -58.54 -62.58 1.75 Allowed 'General case' 0 N--CA 1.507 2.42 0 CA-C-N 123.076 2.671 . . . . 0.0 115.675 175.343 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 34' ' ' LEU . . . . . 0.781 HD12 ' CZ ' ' A' ' 7' ' ' PHE . 0.0 OUTLIER -44.23 -52.07 7.74 Favored 'General case' 0 C--O 1.212 -0.894 0 CA-C-O 115.653 -2.118 . . . . 0.0 105.948 178.254 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 35' ' ' LEU . . . . . 0.41 ' HG ' ' CE1' ' A' ' 9' ' ' PHE . 8.3 mt -63.17 -56.12 19.39 Favored 'General case' 0 C--N 1.364 1.237 0 CA-C-N 123.319 2.782 . . . . 0.0 116.839 179.98 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 36' ' ' GLN . . . . . . . . . . . . 0.287 0.7 OUTLIER -59.11 -35.85 74.14 Favored 'General case' 0 CA--C 1.568 1.663 0 CA-C-O 117.599 -1.191 . . . . 0.0 113.875 176.122 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 37' ' ' ILE . . . . . 0.566 HD13 HH22 ' B' ' 28' ' ' ARG . 1.3 tp -73.54 -26.08 21.65 Favored 'Isoleucine or valine' 0 CA--C 1.568 1.672 0 N-CA-C 117.831 2.53 . . . . 0.0 117.831 164.015 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 38' ' ' VAL . . . . . 0.496 ' HA ' ' HB3' ' B' ' 41' ' ' ALA . 2.4 t -80.97 -46.26 20.82 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.091 0 C-N-CA 127.887 2.475 . . . . 0.0 112.285 179.807 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 33.5 mt-30 -46.26 -46.92 18.12 Favored 'General case' 0 CA--C 1.576 1.968 0 C-N-CA 124.094 0.958 . . . . 0.0 113.53 150.023 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 40' ' ' ASP . . . . . . . . . . . . 0.289 1.2 t70 -58.56 -32.36 68.84 Favored 'General case' 0 CA--C 1.575 1.918 0 N-CA-C 118.151 2.648 . . . . 0.0 118.151 159.534 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 41' ' ' ALA . . . . . 0.496 ' HB3' ' HA ' ' B' ' 38' ' ' VAL . . . -78.34 -50.92 10.9 Favored 'General case' 0 N--CA 1.48 1.072 0 N-CA-C 115.811 1.782 . . . . 0.0 115.811 -167.715 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 2.6 pp -89.01 -21.33 23.54 Favored 'General case' 0 CA--C 1.566 1.564 0 N-CA-C 117.281 2.326 . . . . 0.0 117.281 164.812 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 43' ' ' SER . . . . . . . . . . . . . 41.8 t -126.39 45.91 2.56 Favored 'General case' 0 CA--C 1.568 1.654 0 CA-C-N 121.568 1.985 . . . . 0.0 114.294 177.322 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 44' ' ' LYS . . . . . . . . . . . . . 2.4 tmtm? -47.4 -61.84 2.57 Favored Pre-proline 0 CA--C 1.588 2.412 0 N-CA-C 121.281 3.808 . . . . 0.0 121.281 172.03 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 61.9 Cg_endo -86.65 139.53 5.73 Favored 'Trans proline' 0 CA--C 1.562 1.884 0 N-CA-C 119.614 2.89 . . . . 0.0 119.614 -141.126 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 46' ' ' SER . . . . . . . . . . . . 0.27 44.0 m -140.39 -88.88 0.0 OUTLIER Pre-proline 0 CA--C 1.574 1.892 0 CA-C-O 115.01 -2.424 . . . . 0.0 109.952 141.713 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_endo -82.04 71.81 6.49 Favored 'Trans proline' 0 CA--C 1.567 2.129 0 CA-C-N 127.022 3.543 . . . . 0.0 113.883 174.568 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 48' ' ' VAL . . . . . . . . . . . . . 13.0 p -157.07 115.96 0.26 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.927 0 CA-C-O 123.082 1.42 . . . . 0.0 111.216 -173.656 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 49' ' ' THR . . . . . . . . . . . . . 4.0 t -163.66 57.18 0.17 Allowed 'General case' 0 N--CA 1.5 2.057 0 O-C-N 120.617 -1.302 . . . . 0.0 113.87 -132.136 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 50' ' ' GLY . . . . . . . . . . . . . . . 73.7 81.94 0.39 Allowed Glycine 0 N--CA 1.496 2.656 0 O-C-N 121.057 -1.027 . . . . 0.0 113.752 -170.52 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 51' ' ' TYR . . . . . . . . . . . . . 2.8 p90 -55.86 134.66 52.05 Favored 'General case' 0 CA--C 1.576 1.972 2 O-C-N 114.585 -5.067 . . . . 0.0 120.75 22.028 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 52' ' ' ARG . . . . . . . . . . . . . 53.9 ttp85 -156.5 94.52 1.49 Allowed 'General case' 0 CA--C 1.566 1.569 0 N-CA-C 107.037 -1.468 . . . . 0.0 107.037 168.609 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 53' ' ' ASN . . . . . 0.688 ' HB2' ' HA ' ' A' ' 54' ' ' ASP 0.321 0.2 OUTLIER -87.62 -4.31 58.95 Favored 'General case' 0 N--CA 1.506 2.34 0 C-N-CA 129.781 3.232 . . . . 0.0 110.341 169.899 . . . . . . . . 4 4 . 1 . 013 nuclear nobuild full ' B' B ' 54' ' ' ASP . . . . . 0.477 ' HA ' ' HB2' ' B' ' 57' ' ' ARG 0.535 1.1 p30 -72.01 57.03 0.32 Allowed 'General case' 0 CA--C 1.573 1.831 0 CA-C-N 123.986 3.085 . . . . 0.0 112.513 167.895 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 55' ' ' ALA . . . . . 0.554 ' H ' ' N ' ' B' ' 57' ' ' ARG . . . -156.0 -76.21 0.1 Allowed 'General case' 0 C--N 1.316 -0.877 0 N-CA-C 103.282 -2.858 . . . . 0.0 103.282 -127.329 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 56' ' ' GLU . . . . . 0.535 ' HG2' ' CE1' ' A' ' 51' ' ' TYR . 39.2 mt-10 -42.94 -57.15 2.96 Favored 'General case' 0 N--CA 1.48 1.036 0 N-CA-C 118.789 2.885 . . . . 0.0 118.789 123.32 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 57' ' ' ARG . . . . . 0.554 ' N ' ' H ' ' B' ' 55' ' ' ALA . 1.4 mpt_? -75.41 -37.62 60.35 Favored 'General case' 0 C--N 1.319 -0.717 0 N-CA-C 114.759 1.392 . . . . 0.0 114.759 -163.119 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 58' ' ' LEU . . . . . 0.468 ' H ' ' C ' ' B' ' 54' ' ' ASP 0.488 31.0 mt -109.19 2.33 20.89 Favored 'General case' 0 CA--C 1.588 2.41 0 CA-C-N 120.312 1.414 . . . . 0.0 113.097 171.263 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 59' ' ' ALA . . . . . 0.553 ' HB2' ' O ' ' B' ' 55' ' ' ALA . . . -52.62 -29.93 28.66 Favored 'General case' 0 N--CA 1.498 1.946 0 O-C-N 118.034 -2.916 . . . . 0.0 117.461 127.321 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . 0.332 19.8 t0 -100.68 -8.75 22.53 Favored 'General case' 0 CA--C 1.56 1.345 0 N-CA-C 115.907 1.817 . . . . 0.0 115.907 -175.321 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -51.31 -59.56 4.09 Favored 'General case' 0 CA--C 1.564 1.513 0 CA-C-O 116.459 -1.734 . . . . 0.0 112.548 129.483 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 62' ' ' GLN . . . . . 0.74 ' O ' HG13 ' B' ' 66' ' ' VAL 0.331 0.2 OUTLIER -47.83 -54.34 12.76 Favored 'General case' 0 CA--C 1.566 1.596 0 CA-C-N 123.303 2.774 . . . . 0.0 116.269 171.292 . . . . . . . . 4 4 . 1 . 013 nuclear nobuild full ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 61.1 m -30.41 -49.28 0.11 Allowed 'General case' 0 N--CA 1.516 2.858 0 N-CA-C 118.913 2.931 . . . . 0.0 118.913 164.579 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 64' ' ' GLU . . . . . . . . . . . . 0.548 0.4 OUTLIER -99.83 -8.28 24.32 Favored 'General case' 0 CA--C 1.597 2.776 0 CA-C-N 112.875 -1.966 . . . . 0.0 111.188 -167.51 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 65' ' ' LEU . . . . . . . . . . . . 0.297 0.3 OUTLIER -77.51 -47.02 20.63 Favored 'General case' 0 CA--C 1.583 2.221 0 O-C-N 118.571 -2.581 . . . . 0.0 116.64 147.623 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 66' ' ' VAL . . . . . 0.74 HG13 ' O ' ' B' ' 62' ' ' GLN . 31.5 m . . . . . 0 N--CA 1.515 2.788 0 N-CA-C 119.257 3.058 . . . . 0.0 119.257 -160.628 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.56 1.362 0 N-CA-C 113.592 0.96 . . . . 0.0 113.592 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 57.9 mtp180 -86.14 88.76 7.65 Favored 'General case' 0 CA--C 1.568 1.671 0 CA-C-O 121.962 0.887 . . . . 0.0 111.752 173.753 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 4.3 p-10 -82.68 55.39 2.98 Favored 'General case' 0 CA--C 1.571 1.786 0 O-C-N 120.884 -1.135 . . . . 0.0 112.47 163.411 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 8.8 p-10 -149.38 69.53 9.61 Favored Pre-proline 0 CA--C 1.567 1.617 0 O-C-N 120.835 -1.166 . . . . 0.0 112.049 -175.352 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 64.1 Cg_endo -64.37 148.39 90.86 Favored 'Trans proline' 0 CA--C 1.559 1.752 0 C-N-CA 123.698 2.932 . . . . 0.0 116.486 175.847 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 73.2 m80 -92.44 133.01 36.31 Favored 'General case' 0 CA--C 1.566 1.57 0 CA-C-N 113.301 -1.772 . . . . 0.0 110.956 178.977 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . 0.564 ' CZ ' HD23 ' B' ' 34' ' ' LEU . 2.8 p90 -125.82 151.23 47.07 Favored 'General case' 0 CA--C 1.563 1.479 0 O-C-N 120.423 -1.423 . . . . 0.0 110.28 154.285 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 14.3 m120 -69.25 90.67 0.5 Allowed 'General case' 0 N--CA 1.488 1.445 0 O-C-N 120.434 -1.416 . . . . 0.0 111.465 167.517 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . 0.53 ' HD2' HD11 ' A' ' 34' ' ' LEU . 4.5 t80 -72.57 159.7 33.48 Favored 'General case' 0 CA--C 1.565 1.54 0 CA-C-O 125.207 2.432 . . . . 0.0 109.824 153.723 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 3.1 tmm_? -176.5 114.93 0.11 Allowed 'General case' 0 C--N 1.308 -1.232 0 N-CA-C 104.499 -2.408 . . . . 0.0 104.499 -141.493 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . 0.489 ' SD ' ' CD2' ' A' ' 9' ' ' PHE . 0.1 OUTLIER -127.18 116.28 21.74 Favored Pre-proline 0 CA--C 1.559 1.311 0 CA-C-O 116.957 -1.497 . . . . 0.0 110.934 -162.488 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 81.5 Cg_exo -40.04 138.13 1.18 Allowed 'Trans proline' 0 CA--C 1.562 1.914 0 CA-C-N 123.798 2.392 . . . . 0.0 116.074 160.488 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . 0.442 ' SD ' ' HG3' ' A' ' 17' ' ' GLU . 15.5 tpp -54.84 -25.83 31.18 Favored 'General case' 0 N--CA 1.496 1.836 0 N-CA-C 119.496 3.147 . . . . 0.0 119.496 -160.323 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -58.31 -57.55 12.41 Favored 'General case' 0 CA--C 1.568 1.655 0 N-CA-C 117.353 2.353 . . . . 0.0 117.353 156.976 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -55.42 -45.88 78.38 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.433 0 CA-C-N 121.887 2.13 . . . . 0.0 113.454 173.731 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -77.42 -27.89 52.42 Favored 'General case' 0 N--CA 1.474 0.75 0 CA-C-O 115.792 -2.052 . . . . 0.0 116.137 175.176 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.442 ' HG3' ' SD ' ' A' ' 13' ' ' MET . 38.4 mt-10 -65.0 -41.27 95.53 Favored 'General case' 0 N--CA 1.485 1.29 0 CA-C-N 124.252 3.205 . . . . 0.0 113.345 158.684 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . 0.542 32.5 pttt -77.44 -39.41 46.88 Favored 'General case' 0 CA--C 1.563 1.449 0 N-CA-C 116.989 2.218 . . . . 0.0 116.989 179.768 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.566 HD21 ' HG ' ' A' ' 34' ' ' LEU . 12.9 tp -66.27 -36.99 84.41 Favored 'General case' 0 CA--C 1.569 1.674 0 CA-C-N 120.595 1.543 . . . . 0.0 114.885 163.632 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.412 ' HA ' ' HB3' ' A' ' 23' ' ' ALA . 13.3 ttpt -90.26 -25.22 20.67 Favored 'General case' 0 CA--C 1.574 1.873 0 N-CA-C 114.821 1.415 . . . . 0.0 114.821 -179.825 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . 0.437 ' O ' ' HB3' ' A' ' 25' ' ' ALA . 24.1 m-85 -64.98 -69.58 0.28 Allowed 'General case' 0 N--CA 1.494 1.751 0 CA-C-O 113.581 -3.104 . . . . 0.0 110.501 155.974 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . 0.35 2.5 tmt_? -28.84 -44.0 0.03 OUTLIER 'General case' 0 CA--C 1.605 3.074 0 CA-C-N 125.747 3.885 . . . . 0.0 115.272 166.58 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.507 ' HB2' ' CB ' ' A' ' 33' ' ' GLU . . . -57.85 -76.28 0.04 OUTLIER 'General case' 0 CA--C 1.582 2.203 0 N-CA-C 117.445 2.387 . . . . 0.0 117.445 157.727 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 37.6 mt-10 -58.99 -46.61 87.7 Favored 'General case' 0 N--CA 1.505 2.276 0 N-CA-C 118.092 2.627 . . . . 0.0 118.092 178.026 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.437 ' HB3' ' O ' ' A' ' 21' ' ' PHE . . . -41.03 -46.52 2.9 Favored 'General case' 0 CA--C 1.585 2.323 0 N-CA-C 116.606 2.076 . . . . 0.0 116.606 160.866 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 81.5 m-20 -78.68 -42.66 27.94 Favored 'General case' 0 N--CA 1.501 2.105 0 N-CA-C 117.554 2.428 . . . . 0.0 117.554 167.711 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 100.38 25.62 8.68 Favored Glycine 0 CA--C 1.559 2.832 0 N-CA-C 118.312 2.085 . . . . 0.0 118.312 -151.422 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 44.4 mtt85 -102.86 155.06 18.6 Favored 'General case' 0 CA--C 1.568 1.654 0 CA-C-N 119.39 1.595 . . . . 0.0 106.762 164.129 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 39.2 t -114.14 118.96 35.5 Favored 'General case' 0 N--CA 1.5 2.064 0 N-CA-C 105.194 -2.15 . . . . 0.0 105.194 -178.893 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 15.1 mtp -47.61 -36.95 11.62 Favored 'General case' 0 N--CA 1.5 2.061 0 N-CA-C 119.25 3.056 . . . . 0.0 119.25 -146.599 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . 0.461 HD22 ' HD1' ' B' ' 9' ' ' PHE . 15.8 t-20 -45.53 -45.65 13.49 Favored 'General case' 0 CA--C 1.598 2.827 0 CA-C-N 125.622 3.828 . . . . 0.0 115.715 161.881 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . 0.35 12.8 t -49.12 -73.73 0.04 OUTLIER 'General case' 0 N--CA 1.499 1.982 0 N-CA-C 117.877 2.547 . . . . 0.0 117.877 145.574 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . 0.507 ' CB ' ' HB2' ' A' ' 23' ' ' ALA . 10.1 tp10 -57.92 -57.35 13.18 Favored 'General case' 0 N--CA 1.516 2.834 0 CA-C-N 124.017 3.099 . . . . 0.0 116.523 -174.656 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.834 HD12 ' CZ ' ' B' ' 7' ' ' PHE . 0.1 OUTLIER -42.56 -53.2 4.49 Favored 'General case' 0 CA--C 1.555 1.145 0 CA-C-O 115.476 -2.202 . . . . 0.0 107.183 171.164 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.414 ' HG ' ' CE1' ' B' ' 9' ' ' PHE . 16.0 mt -62.24 -43.85 97.9 Favored 'General case' 0 C--N 1.368 1.388 0 CA-C-N 124.077 3.126 . . . . 0.0 115.954 174.036 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.76 -44.23 93.95 Favored 'General case' 0 N--CA 1.49 1.553 0 N-CA-C 115.37 1.619 . . . . 0.0 115.37 175.106 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . 0.414 ' O ' ' HB2' ' A' ' 41' ' ' ALA . 3.4 tt -75.07 -20.79 16.46 Favored 'Isoleucine or valine' 0 CA--C 1.564 1.493 0 CA-C-O 114.667 -2.587 . . . . 0.0 116.056 165.537 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.518 HG21 HD22 ' A' ' 34' ' ' LEU . 4.1 t -89.91 -48.53 14.33 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.001 0 CA-C-N 123.222 2.737 . . . . 0.0 109.927 -174.915 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 26.6 mt-30 -55.32 -43.67 75.13 Favored 'General case' 0 CA--C 1.565 1.527 0 O-C-N 121.276 -0.89 . . . . 0.0 112.31 156.953 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . 0.672 0.4 OUTLIER -61.02 -28.02 68.75 Favored 'General case' 0 CA--C 1.571 1.78 0 N-CA-C 118.531 2.789 . . . . 0.0 118.531 157.572 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . 0.417 ' HB3' ' HA ' ' A' ' 38' ' ' VAL . . . -74.68 -47.52 31.29 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 119.431 -2.043 . . . . 0.0 114.238 -179.766 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.422 HD11 ' HB2' ' B' ' 19' ' ' LEU . 0.8 OUTLIER -77.48 -34.54 54.23 Favored 'General case' 0 CA--C 1.572 1.795 0 N-CA-C 114.059 1.133 . . . . 0.0 114.059 175.507 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 88.3 p -130.7 68.31 1.48 Allowed 'General case' 0 CA--C 1.571 1.765 0 N-CA-C 113.167 0.803 . . . . 0.0 113.167 173.069 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . 0.44 0.1 OUTLIER -54.91 -85.61 0.01 OUTLIER Pre-proline 0 CA--C 1.583 2.224 1 N-CA-C 122.787 4.366 . . . . 0.0 122.787 172.878 . . . . . . . . 4 3 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . 0.649 ' HA ' ' HE ' ' B' ' 57' ' ' ARG . 31.3 Cg_exo -81.93 148.12 15.31 Favored 'Trans proline' 0 CA--C 1.558 1.711 0 N-CA-C 119.585 2.879 . . . . 0.0 119.585 -122.733 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 74.3 m -85.85 95.99 0.44 Allowed Pre-proline 0 CA--C 1.58 2.119 0 CA-C-N 115.004 -0.998 . . . . 0.0 109.395 127.088 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -88.61 69.39 2.71 Favored 'Trans proline' 0 C--N 1.372 1.796 0 CA-C-N 123.188 2.174 . . . . 0.0 114.424 -166.832 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . 0.273 12.3 p -137.56 -62.41 0.37 Allowed 'Isoleucine or valine' 0 N--CA 1.505 2.295 0 N-CA-C 115.567 1.692 . . . . 0.0 115.567 -160.586 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . 0.251 5.6 t -94.98 80.97 3.68 Favored 'General case' 0 N--CA 1.493 1.682 0 CA-C-O 122.845 1.307 . . . . 0.0 112.614 -149.764 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 73.25 19.82 79.75 Favored Glycine 0 N--CA 1.497 2.725 0 N-CA-C 119.054 2.381 . . . . 0.0 119.054 -166.908 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 18.3 m-30 -101.55 76.75 1.7 Allowed 'General case' 0 CA--C 1.572 1.817 0 CA-C-N 118.924 1.362 . . . . 0.0 112.318 -164.089 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 78.4 ttt180 -93.04 94.53 8.93 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.109 -0.994 . . . . 0.0 110.825 172.786 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . 0.552 HD22 ' N ' ' A' ' 54' ' ' ASP 0.276 0.4 OUTLIER -161.0 -78.82 0.05 OUTLIER 'General case' 0 CA--C 1.592 2.583 0 N-CA-C 114.388 1.255 . . . . 0.0 114.388 -152.944 . . . . . . . . 4 4 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . 0.552 ' N ' HD22 ' A' ' 53' ' ' ASN 1.802 1.1 m-20 119.54 -40.21 0.01 OUTLIER 'General case' 0 N--CA 1.516 2.869 0 N-CA-C 121.194 3.776 . . . . 0.0 121.194 -133.635 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . 0.698 ' O ' ' HB2' ' A' ' 57' ' ' ARG 0.292 . . 40.66 112.5 0.0 OUTLIER 'General case' 0 C--O 1.187 -2.221 2 CA-C-O 102.999 -8.143 . . . . 0.0 123.135 -75.926 . . . . . . . . 4 3 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . 0.79 14.2 tt0 -39.28 55.69 0.0 OUTLIER 'General case' 0 N--CA 1.519 2.979 3 CA-C-N 134.192 7.724 . . . . 0.0 129.45 -166.886 . . . . . . . . 3 2 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 1.032 ' CA ' ' H ' ' A' ' 59' ' ' ALA 0.484 0.0 OUTLIER 165.15 -137.52 0.0 OUTLIER 'General case' 1 CA--C 1.646 4.659 2 O-C-N 114.204 -5.31 . . . . 0.0 99.378 -105.183 . . . . . . . . 6 4 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.489 HD11 HD11 ' B' ' 37' ' ' ILE 0.691 0.6 OUTLIER -25.32 53.69 0.0 OUTLIER 'General case' 0 CA--C 1.587 2.387 1 O-C-N 115.488 -4.507 . . . . 0.0 120.437 -58.173 . . . . . . . . 5 4 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . 1.032 ' H ' ' CA ' ' A' ' 57' ' ' ARG 2.674 . . 110.91 54.19 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.603 1 N-CA-C 123.176 4.51 . . . . 0.0 123.176 174.829 . . . . . . . . 4 3 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.435 ' HA ' ' OG ' ' A' ' 63' ' ' SER 2.253 7.0 t70 47.5 21.95 0.27 Allowed 'General case' 0 N--CA 1.488 1.427 0 CA-C-N 124.692 3.406 . . . . 0.0 116.55 -140.47 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 1.017 ' HA ' ' H ' ' A' ' 63' ' ' SER 2.214 2.5 mt-10 91.7 164.98 0.03 OUTLIER 'General case' 1 CA--C 1.64 4.437 1 CA-C-O 130.905 5.145 . . . . 0.0 114.587 -138.813 . . . . . . . . 5 3 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . 0.584 ' O ' HG13 ' A' ' 66' ' ' VAL . 0.0 OUTLIER 4.03 -26.27 0.0 OUTLIER 'General case' 0 C--N 1.279 -2.47 1 O-C-N 106.065 -10.397 . . . . 0.0 120.439 86.303 . . . . . . . . 4 4 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . 1.017 ' H ' ' HA ' ' A' ' 61' ' ' GLU 2.052 0.5 OUTLIER 117.81 174.84 0.0 OUTLIER 'General case' 0 N--CA 1.396 -3.17 0 N-CA-C 120.609 3.559 . . . . 0.0 120.609 152.439 . . . . . . . . 4 4 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . 0.513 ' C ' ' HB3' ' A' ' 63' ' ' SER 0.33 0.1 OUTLIER -3.42 -27.18 0.0 OUTLIER 'General case' 2 CA--C 1.699 6.679 1 N-CA-C 132.817 8.08 . . . . 0.0 132.817 44.05 . . . . . . . . 6 4 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.646 ' N ' ' HB3' ' A' ' 63' ' ' SER . 0.5 OUTLIER -64.24 -51.26 64.53 Favored 'General case' 0 C--N 1.424 3.837 2 CA-C-N 131.168 6.349 . . . . 0.0 112.394 165.206 . . . . . . . . 4 4 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.584 HG13 ' O ' ' A' ' 62' ' ' GLN 0.428 27.8 m . . . . . 0 N--CA 1.497 1.907 1 N-CA-C 122.052 4.093 . . . . 0.0 122.052 156.836 . . . . . . . . 3 2 . 1 . 014 nuclear nobuild full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.561 1.376 0 N-CA-C 113.43 0.9 . . . . 0.0 113.43 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 2' ' ' ARG . . . . . . . . . . . . . 16.4 mmm180 -81.28 79.19 7.97 Favored 'General case' 0 N--CA 1.494 1.732 0 CA-C-O 122.715 1.245 . . . . 0.0 113.467 -179.837 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . 0.252 5.8 p-10 -162.97 -49.44 0.04 OUTLIER 'General case' 0 N--CA 1.493 1.713 0 C-N-CA 124.666 1.186 . . . . 0.0 112.95 179.787 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 4' ' ' ASP . . . . . . . . . . . . . 6.6 p30 -144.91 85.72 8.14 Favored Pre-proline 0 CA--C 1.566 1.588 0 CA-C-O 118.331 -0.843 . . . . 0.0 111.357 157.766 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 3.3 Cg_exo -89.93 140.93 3.56 Favored 'Trans proline' 0 CA--C 1.552 1.408 0 CA-C-N 122.521 1.936 . . . . 0.0 113.683 -160.507 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 6' ' ' HIS . . . . . . . . . . . . . 78.5 m80 -83.22 128.95 34.94 Favored 'General case' 0 CA--C 1.562 1.44 0 CA-C-N 114.155 -1.384 . . . . 0.0 111.974 -178.171 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 7' ' ' PHE . . . . . 0.834 ' CZ ' HD12 ' A' ' 34' ' ' LEU . 4.2 p90 -129.45 146.53 51.28 Favored 'General case' 0 CA--C 1.562 1.406 0 O-C-N 120.599 -1.313 . . . . 0.0 110.754 154.577 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 8' ' ' ASN . . . . . . . . . . . . . 12.6 m120 -70.26 86.42 0.58 Allowed 'General case' 0 N--CA 1.489 1.509 0 O-C-N 120.552 -1.343 . . . . 0.0 111.261 170.369 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 9' ' ' PHE . . . . . 0.678 ' CD2' HD13 ' A' ' 34' ' ' LEU . 5.9 t80 -70.48 153.12 43.27 Favored 'General case' 0 CA--C 1.551 1.006 0 CA-C-O 124.91 2.29 . . . . 0.0 110.745 161.907 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -162.65 126.15 2.93 Favored 'General case' 0 N--CA 1.481 1.114 0 CA-C-N 112.433 -2.167 . . . . 0.0 108.504 -160.752 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 11' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -127.02 115.44 21.96 Favored Pre-proline 0 CA--C 1.562 1.435 0 CA-C-O 117.253 -1.356 . . . . 0.0 110.605 -156.689 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 12' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_exo -41.96 142.99 1.31 Allowed 'Trans proline' 0 C--N 1.374 1.883 0 C-N-CA 122.99 2.46 . . . . 0.0 115.69 160.371 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 13' ' ' MET . . . . . . . . . . . . . 20.2 tpp -61.74 -35.56 78.46 Favored 'General case' 0 N--CA 1.493 1.69 0 N-CA-C 117.403 2.371 . . . . 0.0 117.403 -149.14 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 8.0 pt-20 -59.07 -41.44 88.0 Favored 'General case' 0 CA--C 1.568 1.645 0 N-CA-C 116.649 2.092 . . . . 0.0 116.649 163.564 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 15' ' ' VAL . . . . . 0.414 ' CG1' HG12 ' A' ' 38' ' ' VAL . 0.4 OUTLIER -59.65 -48.85 85.93 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.146 0 CA-C-N 122.885 2.584 . . . . 0.0 112.594 171.101 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 16' ' ' ARG . . . . . . . . . . . . 0.259 2.8 ttt180 -72.15 -41.23 67.33 Favored 'General case' 0 C--O 1.216 -0.704 0 CA-C-N 120.69 1.586 . . . . 0.0 114.855 176.986 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 17' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -61.52 -34.82 76.18 Favored 'General case' 0 CA--C 1.571 1.781 0 CA-C-N 122.779 2.536 . . . . 0.0 115.043 166.41 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 55.7 mtmt -66.55 -55.61 14.63 Favored 'General case' 0 CA--C 1.563 1.452 0 CA-C-N 121.34 1.882 . . . . 0.0 114.666 165.31 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 19' ' ' LEU . . . . . 0.599 HD21 HD22 ' B' ' 34' ' ' LEU . 11.3 tp -64.71 -37.06 86.31 Favored 'General case' 0 CA--C 1.566 1.572 0 N-CA-C 116.353 1.982 . . . . 0.0 116.353 176.965 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 20' ' ' LYS . . . . . . . . . . . . . 3.8 ttpt -87.22 -25.02 24.21 Favored 'General case' 0 CA--C 1.568 1.655 0 CA-C-O 116.917 -1.516 . . . . 0.0 113.598 176.331 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 13.6 m-30 -65.27 -71.06 0.2 Allowed 'General case' 0 N--CA 1.496 1.85 0 CA-C-O 113.551 -3.118 . . . . 0.0 110.667 158.218 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . 0.273 1.5 tpp180 -13.69 -56.68 0.0 OUTLIER 'General case' 0 CA--C 1.595 2.707 0 CA-C-N 125.263 3.665 . . . . 0.0 115.988 158.273 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 23' ' ' ALA . . . . . 0.551 ' HB2' ' HB3' ' B' ' 33' ' ' GLU 0.261 . . -57.91 -77.65 0.03 OUTLIER 'General case' 0 CA--C 1.589 2.47 0 N-CA-C 117.653 2.464 . . . . 0.0 117.653 160.664 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 54.5 mt-10 -61.13 -42.83 99.26 Favored 'General case' 0 N--CA 1.503 2.216 0 N-CA-C 118.874 2.916 . . . . 0.0 118.874 179.251 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 25' ' ' ALA . . . . . . . . . . . . . . . -39.63 -50.26 2.25 Favored 'General case' 0 CA--C 1.585 2.322 0 N-CA-C 115.882 1.808 . . . . 0.0 115.882 158.45 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 26' ' ' ASN . . . . . . . . . . . . . 71.2 m-20 -82.11 -49.15 10.5 Favored 'General case' 0 N--CA 1.498 1.952 0 N-CA-C 116.293 1.96 . . . . 0.0 116.293 174.79 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 27' ' ' GLY . . . . . . . . . . . . . . . 109.49 15.06 12.86 Favored Glycine 0 CA--C 1.561 2.964 0 N-CA-C 118.756 2.262 . . . . 0.0 118.756 -148.25 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 28' ' ' ARG . . . . . . . . . . . . . 1.7 mtt85 -98.66 156.04 17.02 Favored 'General case' 0 CA--C 1.573 1.829 0 CA-C-N 120.358 2.079 . . . . 0.0 105.59 162.737 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 29' ' ' SER . . . . . 0.536 ' H ' ' HB3' ' B' ' 32' ' ' SER . 38.9 t -122.14 112.22 17.94 Favored 'General case' 0 N--CA 1.503 2.21 0 O-C-N 117.928 -2.983 . . . . 0.0 105.774 -172.228 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 30' ' ' MET . . . . . . . . . . . . . 20.4 mtp -42.88 -32.12 0.58 Allowed 'General case' 0 N--CA 1.505 2.305 0 N-CA-C 121.46 3.874 . . . . 0.0 121.46 -146.133 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 31' ' ' ASN . . . . . . . . . . . . 0.269 12.5 t-20 -50.46 -52.12 40.86 Favored 'General case' 0 CA--C 1.594 2.659 0 O-C-N 118.34 -2.725 . . . . 0.0 114.414 159.002 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 32' ' ' SER . . . . . 0.536 ' HB3' ' H ' ' B' ' 29' ' ' SER 0.321 30.5 t -45.2 -77.54 0.02 OUTLIER 'General case' 0 N--CA 1.501 2.088 0 N-CA-C 116.793 2.145 . . . . 0.0 116.793 145.223 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 33' ' ' GLU . . . . . 0.551 ' HB3' ' HB2' ' B' ' 23' ' ' ALA . 3.3 tp10 -67.83 -52.52 35.91 Favored 'General case' 0 N--CA 1.505 2.282 0 CA-C-N 123.728 2.967 . . . . 0.0 116.198 -168.095 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 34' ' ' LEU . . . . . 0.599 HD22 HD21 ' B' ' 19' ' ' LEU 0.595 0.1 OUTLIER -49.56 -36.76 24.83 Favored 'General case' 0 CA--C 1.569 1.683 0 CA-C-O 114.061 -2.876 . . . . 0.0 107.882 170.833 . . . . . . . . 4 4 . 1 . 014 nuclear nobuild full ' B' B ' 35' ' ' LEU . . . . . 0.413 ' HG ' ' CE1' ' A' ' 9' ' ' PHE . 19.2 mt -65.56 -51.23 61.36 Favored 'General case' 0 N--CA 1.494 1.757 1 CA-C-N 126.493 4.224 . . . . 0.0 115.317 165.829 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 36' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -62.7 -39.12 93.0 Favored 'General case' 0 N--CA 1.477 0.905 0 CA-C-O 116.569 -1.682 . . . . 0.0 114.892 -177.325 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 37' ' ' ILE . . . . . 0.489 HD11 HD11 ' A' ' 58' ' ' LEU . 0.9 OUTLIER -69.36 -33.16 56.3 Favored 'Isoleucine or valine' 0 CA--C 1.572 1.802 0 CA-C-O 114.064 -2.874 . . . . 0.0 116.935 158.231 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 38' ' ' VAL . . . . . 0.407 ' CG1' HD22 ' A' ' 19' ' ' LEU . 2.2 t -77.24 -50.68 20.08 Favored 'Isoleucine or valine' 0 N--CA 1.513 2.706 0 CA-C-N 125.453 3.751 . . . . 0.0 112.259 -178.09 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 23.6 mt-30 -47.38 -44.76 24.53 Favored 'General case' 0 CA--C 1.557 1.226 0 CA-C-O 116.935 -1.507 . . . . 0.0 112.072 153.534 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 40' ' ' ASP . . . . . 0.431 ' HA ' ' HB2' ' B' ' 44' ' ' LYS 0.671 0.0 OUTLIER -48.0 -57.31 5.93 Favored 'General case' 0 N--CA 1.494 1.73 0 N-CA-C 117.051 2.241 . . . . 0.0 117.051 156.03 . . . . . . . . 4 4 . 1 . 014 nuclear nobuild full ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -71.01 -44.64 65.48 Favored 'General case' 0 CA--C 1.543 0.684 0 N-CA-C 115.076 1.51 . . . . 0.0 115.076 -151.153 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . 0.312 0.7 OUTLIER -86.1 -27.09 24.89 Favored 'General case' 0 N--CA 1.49 1.56 0 N-CA-C 118.394 2.738 . . . . 0.0 118.394 157.372 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 43' ' ' SER . . . . . . . . . . . . . 30.5 t -142.9 38.06 1.45 Allowed 'General case' 0 N--CA 1.492 1.657 0 N-CA-C 117.866 2.543 . . . . 0.0 117.866 -166.744 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 44' ' ' LYS . . . . . 0.431 ' HB2' ' HA ' ' B' ' 40' ' ' ASP 0.345 50.5 mttp -104.42 84.81 0.98 Allowed Pre-proline 0 N--CA 1.522 3.153 0 CA-C-N 122.762 2.528 . . . . 0.0 117.416 163.326 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 38.7 Cg_exo -58.42 96.33 0.08 OUTLIER 'Trans proline' 0 CA--C 1.573 2.453 0 C-N-CA 123.541 2.827 . . . . 0.0 115.342 137.762 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 46' ' ' SER . . . . . . . . . . . . . 97.8 p -146.1 99.17 4.3 Favored Pre-proline 0 CA--C 1.577 1.99 0 CA-C-O 117.262 -1.352 . . . . 0.0 113.251 -165.392 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 34.0 Cg_endo -93.04 62.94 0.33 Allowed 'Cis proline' 0 CA--C 1.572 2.396 0 CA-C-N 124.112 2.504 . . . . 0.0 116.67 -7.996 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 48' ' ' VAL . . . . . . . . . . . . 0.279 2.8 t 61.09 47.68 0.26 Allowed 'Isoleucine or valine' 0 N--CA 1.511 2.597 0 N-CA-C 114.954 1.465 . . . . 0.0 114.954 174.389 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 49' ' ' THR . . . . . . . . . . . . . 29.2 p -100.85 59.73 0.94 Allowed 'General case' 0 N--CA 1.498 1.935 0 O-C-N 120.333 -1.48 . . . . 0.0 113.328 -166.383 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 50' ' ' GLY . . . . . . . . . . . . . . . 146.86 -88.69 0.15 Allowed Glycine 0 N--CA 1.491 2.325 0 CA-C-O 119.221 -0.766 . . . . 0.0 114.476 -175.589 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 51' ' ' TYR . . . . . . . . . . . . . 35.2 t80 -142.24 67.05 1.33 Allowed 'General case' 0 CA--C 1.58 2.101 2 O-C-N 114.871 -4.899 . . . . 0.0 109.479 0.076 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 52' ' ' ARG . . . . . . . . . . . . . 15.8 tpp85 -54.66 136.58 45.45 Favored 'General case' 0 N--CA 1.506 2.344 0 C-N-CA 124.737 1.215 . . . . 0.0 113.464 174.837 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 53' ' ' ASN . . . . . 0.512 ' HB2' ' HB3' ' B' ' 55' ' ' ALA 0.579 52.4 p30 -137.01 170.35 16.26 Favored 'General case' 0 N--CA 1.493 1.679 1 N-CA-C 122.957 4.429 . . . . 0.0 122.957 -155.745 . . . . . . . . 4 3 . 1 . 014 nuclear nobuild full ' B' B ' 54' ' ' ASP . . . . . 0.741 ' N ' ' HB3' ' B' ' 55' ' ' ALA 0.984 0.0 OUTLIER -134.06 10.21 3.86 Favored 'General case' 0 N--CA 1.499 1.999 1 N-CA-C 125.339 5.311 . . . . 0.0 125.339 -177.681 . . . . . . . . 5 4 . 1 . 014 nuclear nobuild full ' B' B ' 55' ' ' ALA . . . . . 0.741 ' HB3' ' N ' ' B' ' 54' ' ' ASP 0.277 . . 28.05 -85.1 0.0 OUTLIER 'General case' 0 CA--C 1.579 2.073 2 N-CA-C 123.13 4.492 . . . . 0.0 123.13 62.462 . . . . . . . . 4 3 . 1 . 014 nuclear nobuild full ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 10.3 tt0 -84.98 -7.0 59.33 Favored 'General case' 0 CA--C 1.589 2.464 0 N-CA-C 120.051 3.352 . . . . 0.0 120.051 165.727 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 57' ' ' ARG . . . . . 0.829 ' HA ' ' HB2' ' B' ' 59' ' ' ALA . 0.2 OUTLIER -67.76 -128.86 0.0 OUTLIER 'General case' 0 CA--C 1.553 1.074 0 O-C-N 117.066 -3.521 . . . . 0.0 106.507 111.811 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 58' ' ' LEU . . . . . . . . . . . . 2.386 0.2 OUTLIER 45.67 -55.18 0.0 OUTLIER 'General case' 0 N--CA 1.513 2.688 1 CA-C-N 129.763 5.71 . . . . 0.0 116.493 -143.838 . . . . . . . . 4 3 . 1 . 014 nuclear nobuild full ' B' B ' 59' ' ' ALA . . . . . 0.829 ' HB2' ' HA ' ' B' ' 57' ' ' ARG 1.993 . . 168.11 71.4 0.0 OUTLIER 'General case' 0 N--CA 1.501 2.115 0 O-C-N 118.771 -2.456 . . . . 0.0 111.121 123.815 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . 2.54 0.0 OUTLIER 93.38 -13.07 0.15 Allowed 'General case' 0 CA--C 1.593 2.606 0 N-CA-C 115.953 1.834 . . . . 0.0 115.953 -143.593 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 61' ' ' GLU . . . . . 0.45 ' O ' ' N ' ' B' ' 63' ' ' SER 0.389 48.9 mm-40 62.78 125.65 0.01 OUTLIER 'General case' 0 N--CA 1.5 2.032 0 O-C-N 117.356 -3.34 . . . . 0.0 110.461 -102.674 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 62' ' ' GLN . . . . . 0.531 ' O ' HG13 ' B' ' 66' ' ' VAL 0.496 0.0 OUTLIER -50.8 28.59 0.0 OUTLIER 'General case' 0 N--CA 1.504 2.261 2 CA-C-N 127.403 4.638 . . . . 0.0 123.421 -166.622 . . . . . . . . 5 4 . 1 . 014 nuclear nobuild full ' B' B ' 63' ' ' SER . . . . . 0.778 ' H ' ' H ' ' B' ' 65' ' ' LEU 0.485 3.6 t 161.86 -33.37 0.0 OUTLIER 'General case' 0 N--CA 1.508 2.443 1 N-CA-C 121.828 4.01 . . . . 0.0 121.828 -86.692 . . . . . . . . 4 3 . 1 . 014 nuclear nobuild full ' B' B ' 64' ' ' GLU . . . . . . . . . . . . . 15.4 tt0 -83.64 8.86 13.04 Favored 'General case' 0 CA--C 1.581 2.156 0 O-C-N 117.575 -3.203 . . . . 0.0 116.556 119.02 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 65' ' ' LEU . . . . . 0.778 ' H ' ' H ' ' B' ' 63' ' ' SER . 84.3 mt -92.2 -87.03 0.22 Allowed 'General case' 0 N--CA 1.5 2.053 0 O-C-N 119.459 -2.026 . . . . 0.0 114.427 146.695 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 66' ' ' VAL . . . . . 0.531 HG13 ' O ' ' B' ' 62' ' ' GLN 0.448 33.4 m . . . . . 0 N--CA 1.516 2.841 0 N-CA-C 119.965 3.32 . . . . 0.0 119.965 -172.507 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.558 1.288 0 N-CA-C 113.435 0.902 . . . . 0.0 113.435 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 56.8 mtt180 -79.33 87.39 5.0 Favored 'General case' 0 CA--C 1.571 1.785 0 O-C-N 121.153 -0.967 . . . . 0.0 112.118 175.347 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -159.41 -45.83 0.05 Allowed 'General case' 0 N--CA 1.493 1.706 0 O-C-N 120.821 -1.175 . . . . 0.0 113.705 170.532 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 52.8 p-10 -145.5 84.75 8.26 Favored Pre-proline 0 CA--C 1.57 1.714 0 O-C-N 120.878 -1.139 . . . . 0.0 110.685 158.677 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 5.9 Cg_exo -101.12 144.98 0.29 Allowed 'Trans proline' 0 CA--C 1.559 1.733 0 CA-C-N 122.293 1.855 . . . . 0.0 114.619 -156.717 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 75.2 m80 -85.78 129.73 34.75 Favored 'General case' 0 CA--C 1.577 1.985 0 CA-C-N 115.011 -0.995 . . . . 0.0 112.144 179.754 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . 0.791 ' CZ ' HD12 ' B' ' 34' ' ' LEU . 8.3 p90 -129.42 152.95 48.41 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 119.329 -2.107 . . . . 0.0 111.115 147.871 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 14.2 m120 -71.17 87.05 0.78 Allowed 'General case' 0 N--CA 1.491 1.602 0 O-C-N 120.059 -1.651 . . . . 0.0 112.614 172.49 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' PHE . . . . . 0.625 ' CD2' HD13 ' B' ' 34' ' ' LEU . 2.8 t80 -74.19 138.0 43.48 Favored 'General case' 0 CA--C 1.556 1.18 0 CA-C-O 125.573 2.606 . . . . 0.0 110.271 163.075 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -163.29 120.37 1.85 Allowed 'General case' 0 N--CA 1.487 1.422 0 CA-C-N 112.003 -2.362 . . . . 0.0 107.955 -153.002 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 2.5 mpt? -131.27 119.32 17.57 Favored Pre-proline 0 N--CA 1.485 1.278 0 CA-C-O 116.845 -1.55 . . . . 0.0 113.199 -142.162 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 75.5 Cg_exo -42.73 142.78 1.91 Allowed 'Trans proline' 0 C--N 1.372 1.807 0 C-N-CA 123.082 2.521 . . . . 0.0 115.529 165.003 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -57.19 -36.41 70.78 Favored 'General case' 0 N--CA 1.493 1.691 0 N-CA-C 117.227 2.306 . . . . 0.0 117.227 -152.405 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -62.28 -43.58 98.5 Favored 'General case' 0 CA--C 1.565 1.521 0 N-CA-C 116.969 2.211 . . . . 0.0 116.969 165.03 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.407 ' CG1' HG12 ' B' ' 38' ' ' VAL . 0.4 OUTLIER -58.76 -50.64 78.58 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.355 0 CA-C-N 124.087 3.131 . . . . 0.0 113.158 174.584 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -67.37 -41.99 84.14 Favored 'General case' 0 C--O 1.214 -0.767 0 CA-C-O 116.041 -1.933 . . . . 0.0 115.789 171.284 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 51.0 mt-10 -59.04 -36.06 74.36 Favored 'General case' 0 CA--C 1.573 1.831 0 CA-C-N 123.935 3.061 . . . . 0.0 114.132 165.889 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . 0.276 42.3 mtmt -69.86 -54.71 12.25 Favored 'General case' 0 CA--C 1.564 1.492 0 CA-C-N 121.705 2.048 . . . . 0.0 115.138 171.909 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.636 HD13 HD22 ' A' ' 34' ' ' LEU . 10.8 mt -57.99 -45.63 86.51 Favored 'General case' 0 CA--C 1.57 1.723 0 N-CA-C 117.248 2.314 . . . . 0.0 117.248 167.565 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.43 ' HA ' ' HB3' ' A' ' 23' ' ' ALA . 17.1 ttpt -85.91 -24.46 26.61 Favored 'General case' 0 CA--C 1.569 1.681 0 C-N-CA 124.941 1.296 . . . . 0.0 113.486 -176.281 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . 0.471 ' O ' ' HB3' ' A' ' 25' ' ' ALA . 16.9 m-30 -67.44 -64.35 0.87 Allowed 'General case' 0 N--CA 1.492 1.662 0 CA-C-O 114.54 -2.647 . . . . 0.0 110.739 159.138 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.411 ' O ' ' HB3' ' A' ' 26' ' ' ASN 0.305 12.1 tpp180 -25.22 -45.41 0.02 OUTLIER 'General case' 0 CA--C 1.614 3.406 0 CA-C-N 125.294 3.679 . . . . 0.0 116.089 159.086 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.496 ' HB2' ' CB ' ' A' ' 33' ' ' GLU 0.281 . . -64.45 -69.03 0.31 Allowed 'General case' 0 CA--C 1.59 2.492 0 O-C-N 117.618 -3.177 . . . . 0.0 116.265 163.442 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 39.8 mt-10 -75.49 -42.92 51.66 Favored 'General case' 0 N--CA 1.501 2.075 0 N-CA-C 118.458 2.762 . . . . 0.0 118.458 -179.427 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.471 ' HB3' ' O ' ' A' ' 21' ' ' PHE . . . -42.21 -48.99 4.97 Favored 'General case' 0 CA--C 1.579 2.064 0 N-CA-C 116.638 2.088 . . . . 0.0 116.638 157.869 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . 0.411 ' HB3' ' O ' ' A' ' 22' ' ' ARG 0.314 0.6 OUTLIER -121.97 -41.99 2.42 Favored 'General case' 0 CA--C 1.573 1.834 0 N-CA-C 114.676 1.361 . . . . 0.0 114.676 -150.659 . . . . . . . . 4 4 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 149.02 47.57 0.02 OUTLIER Glycine 0 N--CA 1.499 2.849 0 N-CA-C 118.128 2.011 . . . . 0.0 118.128 167.421 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.417 ' HE ' ' HG3' ' B' ' 62' ' ' GLN . 0.1 OUTLIER -150.27 172.39 15.43 Favored 'General case' 0 CA--C 1.573 1.837 0 CA-C-O 122.622 1.201 . . . . 0.0 108.608 -179.789 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . 0.408 ' H ' ' HB3' ' A' ' 32' ' ' SER . 37.5 t -125.61 116.88 22.42 Favored 'General case' 0 N--CA 1.499 2.018 0 O-C-N 119.413 -2.054 . . . . 0.0 105.91 173.174 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' MET . . . . . 0.484 ' CE ' ' HB3' ' A' ' 19' ' ' LEU . 15.2 mtp -46.3 -30.7 2.16 Favored 'General case' 0 N--CA 1.501 2.109 0 N-CA-C 121.705 3.965 . . . . 0.0 121.705 -146.1 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' ASN . . . . . . . . . . . . 0.251 4.0 t-20 -51.3 -49.68 60.83 Favored 'General case' 0 CA--C 1.584 2.281 0 O-C-N 118.512 -2.618 . . . . 0.0 114.164 160.538 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . 0.408 ' HB3' ' H ' ' A' ' 29' ' ' SER 0.328 29.6 t -45.63 -71.42 0.08 Allowed 'General case' 0 N--CA 1.499 1.985 0 N-CA-C 117.335 2.346 . . . . 0.0 117.335 145.405 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . 0.496 ' CB ' ' HB2' ' A' ' 23' ' ' ALA . 0.0 OUTLIER -66.3 -60.24 2.96 Favored 'General case' 0 N--CA 1.503 2.217 0 CA-C-N 122.977 2.626 . . . . 0.0 114.547 -168.541 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.636 HD22 HD13 ' A' ' 19' ' ' LEU 0.573 0.1 OUTLIER -50.46 -34.25 24.17 Favored 'General case' 0 CA--C 1.575 1.907 0 CA-C-O 113.67 -3.062 . . . . 0.0 106.33 175.059 . . . . . . . . 4 4 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 17.7 mt -66.4 -49.93 65.16 Favored 'General case' 0 C--N 1.378 1.812 1 CA-C-N 127.288 4.585 . . . . 0.0 116.8 164.227 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -58.43 -41.36 84.85 Favored 'General case' 0 N--CA 1.492 1.627 0 N-CA-C 114.983 1.475 . . . . 0.0 114.983 178.393 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . 0.544 HG12 HD22 ' B' ' 58' ' ' LEU . 2.6 tt -71.8 -31.07 40.03 Favored 'Isoleucine or valine' 0 CA--C 1.567 1.622 0 CA-C-O 114.066 -2.873 . . . . 0.0 116.972 161.398 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.458 ' HA ' ' HB3' ' A' ' 41' ' ' ALA . 3.3 t -77.9 -45.72 27.48 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.291 0 CA-C-N 124.717 3.417 . . . . 0.0 112.156 -179.979 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 23.8 mt-30 -52.74 -43.25 65.6 Favored 'General case' 0 CA--C 1.565 1.54 0 C-N-CA 124.362 1.065 . . . . 0.0 113.14 155.272 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' ASP . . . . . 0.445 ' HB2' ' HA ' ' A' ' 37' ' ' ILE 0.494 2.8 m-20 -57.65 -32.65 67.5 Favored 'General case' 0 N--CA 1.5 2.055 0 N-CA-C 118.938 2.94 . . . . 0.0 118.938 155.089 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' ALA . . . . . 0.458 ' HB3' ' HA ' ' A' ' 38' ' ' VAL . . . -76.87 -52.7 8.99 Favored 'General case' 0 CA--C 1.551 1.001 0 O-C-N 119.635 -1.916 . . . . 0.0 112.803 -167.372 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . 0.26 3.2 pp -87.53 -8.08 56.8 Favored 'General case' 0 N--CA 1.496 1.853 0 N-CA-C 118.772 2.879 . . . . 0.0 118.772 163.48 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 34.3 t -146.15 43.88 1.23 Allowed 'General case' 0 CA--C 1.576 1.976 0 CA-C-N 121.972 2.169 . . . . 0.0 116.224 177.332 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . 0.292 8.1 ptmt -50.74 -47.96 84.31 Favored Pre-proline 0 N--CA 1.507 2.398 1 N-CA-C 124.369 4.951 . . . . 0.0 124.369 172.024 . . . . . . . . 3 2 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 14.0 Cg_exo -80.16 120.69 4.19 Favored 'Trans proline' 0 CA--C 1.562 1.917 0 CA-C-N 125.88 3.136 . . . . 0.0 118.014 -148.76 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 22.2 t -75.33 143.86 77.19 Favored Pre-proline 0 CA--C 1.585 2.308 0 CA-C-O 117.886 -1.055 . . . . 0.0 111.096 134.204 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 79.9 Cg_endo -72.54 82.62 1.4 Allowed 'Trans proline' 0 CA--C 1.57 2.32 0 C-N-CA 122.664 2.242 . . . . 0.0 115.152 -175.984 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 9.9 p -141.23 -18.49 0.31 Allowed 'Isoleucine or valine' 0 N--CA 1.51 2.575 0 N-CA-C 116.385 1.994 . . . . 0.0 116.385 -171.113 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . 0.286 1.3 t -107.92 99.87 9.28 Favored 'General case' 0 CA--C 1.571 1.759 0 O-C-N 119.664 -1.897 . . . . 0.0 113.645 -127.487 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -152.48 95.71 0.16 Allowed Glycine 0 N--CA 1.491 2.308 0 CA-C-O 117.668 -1.629 . . . . 0.0 113.348 178.372 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . 0.443 ' CD2' ' HB3' ' B' ' 56' ' ' GLU 0.322 0.0 OUTLIER -0.66 122.87 0.0 OUTLIER 'General case' 0 CA--C 1.586 2.339 3 CA-C-N 129.859 6.829 . . . . 0.0 123.776 -1.688 . . . . . . . . 5 4 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . 0.275 25.8 tpt180 -129.52 107.8 9.75 Favored 'General case' 0 N--CA 1.512 2.669 0 CA-C-N 122.159 2.254 . . . . 0.0 115.789 -175.332 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' ASN . . . . . 0.485 ' HB2' ' CA ' ' B' ' 54' ' ' ASP . 0.0 OUTLIER -131.32 172.95 11.56 Favored 'General case' 0 CA--C 1.608 3.203 0 C-N-CA 128.436 2.694 . . . . 0.0 107.063 156.674 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . 0.338 0.0 OUTLIER -82.56 84.91 7.08 Favored 'General case' 0 CA--C 1.553 1.071 2 O-C-N 111.419 -7.05 . . . . 0.0 108.259 -2.087 . . . . . . . . 4 3 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -97.96 -89.8 0.29 Allowed 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 113.802 -1.545 . . . . 0.0 110.528 -156.644 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.429 ' HG2' ' HD2' ' A' ' 57' ' ' ARG . 29.0 tt0 -14.55 -55.25 0.0 OUTLIER 'General case' 0 CA--C 1.574 1.879 1 N-CA-C 122.013 4.079 . . . . 0.0 122.013 121.186 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.5 ' C ' ' H ' ' A' ' 60' ' ' ASP 1.317 0.6 OUTLIER -41.45 -58.01 2.02 Favored 'General case' 0 CA--C 1.551 0.987 1 N-CA-C 124.82 5.118 . . . . 0.0 124.82 166.283 . . . . . . . . 5 4 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.631 ' HA ' ' H ' ' A' ' 61' ' ' GLU 0.561 96.0 mt -110.98 -2.08 16.1 Favored 'General case' 0 CA--C 1.588 2.408 0 O-C-N 120.524 -1.36 . . . . 0.0 113.195 177.155 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -54.23 -6.43 0.1 Allowed 'General case' 0 N--CA 1.488 1.439 0 O-C-N 116.36 -3.962 . . . . 0.0 120.08 117.48 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.539 ' CA ' ' H ' ' A' ' 63' ' ' SER 1.364 11.0 t70 -98.15 -12.98 21.17 Favored 'General case' 0 CA--C 1.586 2.363 0 CA-C-O 127.303 3.43 . . . . 0.0 116.943 163.358 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.631 ' H ' ' HA ' ' A' ' 58' ' ' LEU . 3.7 tt0 -56.86 -24.49 51.91 Favored 'General case' 0 CA--C 1.59 2.489 0 CA-C-N 112.151 -2.295 . . . . 0.0 114.846 133.717 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . 0.552 ' O ' HG13 ' A' ' 66' ' ' VAL 0.529 0.0 OUTLIER -71.99 -19.51 61.86 Favored 'General case' 0 CA--C 1.58 2.105 0 CA-C-O 113.458 -3.163 . . . . 0.0 118.198 145.312 . . . . . . . . 4 4 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . 0.539 ' H ' ' CA ' ' A' ' 60' ' ' ASP 0.399 0.5 OUTLIER -42.47 -69.59 0.13 Allowed 'General case' 0 N--CA 1.537 3.893 1 CA-C-N 127.314 4.597 . . . . 0.0 113.208 157.025 . . . . . . . . 5 4 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . 0.387 9.4 tp10 -24.74 -21.11 0.0 OUTLIER 'General case' 0 CA--C 1.583 2.216 1 N-CA-C 123.878 4.77 . . . . 0.0 123.878 143.5 . . . . . . . . 3 2 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.418 ' HG ' ' HA ' ' A' ' 62' ' ' GLN . 0.9 OUTLIER -129.36 32.66 4.64 Favored 'General case' 0 CA--C 1.603 2.998 0 N-CA-C 118.301 2.704 . . . . 0.0 118.301 148.375 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.552 HG13 ' O ' ' A' ' 62' ' ' GLN . 33.4 m . . . . . 0 N--CA 1.516 2.842 0 O-C-N 118.356 -2.715 . . . . 0.0 113.098 178.032 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.563 1.456 0 N-CA-C 113.476 0.917 . . . . 0.0 113.476 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 2' ' ' ARG . . . . . . . . . . . . . 34.3 mmt180 -76.01 81.99 2.88 Favored 'General case' 0 N--CA 1.495 1.806 0 CA-C-O 123.166 1.46 . . . . 0.0 113.772 -178.325 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -92.67 0.34 57.41 Favored 'General case' 0 CA--C 1.563 1.448 0 N-CA-C 116.39 1.996 . . . . 0.0 116.39 -178.701 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 4' ' ' ASP . . . . . . . . . . . . 0.32 14.6 p-10 -131.0 72.69 81.71 Favored Pre-proline 0 N--CA 1.492 1.669 0 CA-C-N 121.572 1.987 . . . . 0.0 115.833 178.527 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -60.97 158.81 32.19 Favored 'Trans proline' 0 CA--C 1.569 2.23 0 C-N-CA 123.071 2.514 . . . . 0.0 117.207 163.595 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 6' ' ' HIS . . . . . . . . . . . . . 70.5 m80 -106.6 143.52 34.59 Favored 'General case' 0 CA--C 1.56 1.341 0 CA-C-N 113.555 -1.657 . . . . 0.0 112.402 -167.004 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 7' ' ' PHE . . . . . 0.497 ' CZ ' HD23 ' A' ' 34' ' ' LEU . 8.9 p90 -140.63 155.71 46.46 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 120.411 -1.43 . . . . 0.0 111.1 149.166 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 8' ' ' ASN . . . . . . . . . . . . . 14.7 m120 -71.04 90.04 0.83 Allowed 'General case' 0 N--CA 1.489 1.494 0 O-C-N 120.218 -1.551 . . . . 0.0 111.659 168.537 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 9' ' ' PHE . . . . . . . . . . . . . 6.8 t80 -73.31 149.24 42.81 Favored 'General case' 0 CA--C 1.561 1.397 0 CA-C-O 125.121 2.391 . . . . 0.0 110.428 156.822 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 10' ' ' ARG . . . . . . . . . . . . . 34.0 tpt85 -179.78 93.3 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.651 0 O-C-N 119.718 -1.863 . . . . 0.0 107.869 -123.991 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 11' ' ' MET . . . . . 0.444 ' SD ' ' HG3' ' B' ' 16' ' ' ARG . 1.2 mpt? -130.09 129.88 23.01 Favored Pre-proline 0 CA--C 1.567 1.625 0 CA-C-O 117.302 -1.332 . . . . 0.0 112.805 -153.68 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 12' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_exo -44.89 146.14 2.57 Favored 'Trans proline' 0 CA--C 1.564 2.012 0 C-N-CA 123.082 2.521 . . . . 0.0 116.976 166.867 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 13' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -48.87 -37.53 19.87 Favored 'General case' 0 N--CA 1.496 1.827 0 N-CA-C 118.348 2.721 . . . . 0.0 118.348 -165.554 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 14' ' ' GLU . . . . . . . . . . . . 0.262 8.6 pt-20 -64.29 -48.08 77.05 Favored 'General case' 0 CA--C 1.566 1.572 0 N-CA-C 115.64 1.719 . . . . 0.0 115.64 170.028 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 15' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -59.6 -46.97 92.65 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.067 0 CA-C-N 123.408 2.822 . . . . 0.0 112.385 172.052 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 16' ' ' ARG . . . . . 0.444 ' HG3' ' SD ' ' B' ' 11' ' ' MET . 0.0 OUTLIER -74.25 -33.86 63.45 Favored 'General case' 0 N--CA 1.475 0.781 0 N-CA-C 116.455 2.02 . . . . 0.0 116.455 177.184 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 17' ' ' GLU . . . . . . . . . . . . . 74.5 mm-40 -65.32 -41.89 93.54 Favored 'General case' 0 N--CA 1.491 1.623 0 CA-C-N 123.611 2.914 . . . . 0.0 113.896 159.742 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . 0.289 50.9 mtmt -62.56 -45.79 91.3 Favored 'General case' 0 CA--C 1.566 1.561 0 CA-C-N 121.912 2.142 . . . . 0.0 115.361 172.241 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 19' ' ' LEU . . . . . 0.511 HD21 ' CD2' ' B' ' 34' ' ' LEU . 13.9 tp -72.65 -34.94 67.61 Favored 'General case' 0 CA--C 1.569 1.696 0 CA-C-N 120.739 1.608 . . . . 0.0 114.399 176.585 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 20' ' ' LYS . . . . . 0.447 ' HB2' ' SD ' ' B' ' 30' ' ' MET . 8.5 ttpt -88.21 -30.3 19.83 Favored 'General case' 0 CA--C 1.564 1.488 0 C-N-CA 125.635 1.574 . . . . 0.0 114.388 178.468 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 15.1 m-85 -56.82 -73.59 0.06 Allowed 'General case' 0 N--CA 1.491 1.599 0 CA-C-O 113.581 -3.104 . . . . 0.0 110.46 148.915 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . 0.406 4.9 tmm_? -31.34 -41.68 0.04 OUTLIER 'General case' 0 CA--C 1.594 2.655 0 CA-C-N 125.829 3.922 . . . . 0.0 116.869 173.66 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 23' ' ' ALA . . . . . . . . . . . . . . . -57.46 -74.48 0.06 Allowed 'General case' 0 CA--C 1.585 2.316 0 N-CA-C 118.856 2.91 . . . . 0.0 118.856 154.357 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -59.92 -45.82 91.37 Favored 'General case' 0 N--CA 1.504 2.274 0 N-CA-C 118.826 2.899 . . . . 0.0 118.826 175.363 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 25' ' ' ALA . . . . . . . . . . . . . . . -38.98 -51.92 1.79 Allowed 'General case' 0 CA--C 1.587 2.378 0 N-CA-C 116.824 2.157 . . . . 0.0 116.824 159.42 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 26' ' ' ASN . . . . . . . . . . . . . 34.8 m-20 -87.53 -51.75 5.74 Favored 'General case' 0 CA--C 1.575 1.936 0 N-CA-C 115.236 1.569 . . . . 0.0 115.236 179.67 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 27' ' ' GLY . . . . . . . . . . . . . . . 128.61 19.76 1.62 Allowed Glycine 0 CA--C 1.56 2.875 0 N-CA-C 119.275 2.47 . . . . 0.0 119.275 -161.054 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 28' ' ' ARG . . . . . . . . . . . . . 80.0 mtt-85 -116.22 166.49 11.97 Favored 'General case' 0 N--CA 1.495 1.778 0 CA-C-N 121.049 2.425 . . . . 0.0 106.957 167.535 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 29' ' ' SER . . . . . . . . . . . . . 91.1 p -121.14 112.55 18.82 Favored 'General case' 0 N--CA 1.5 2.049 0 O-C-N 118.742 -2.474 . . . . 0.0 105.491 -173.115 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 30' ' ' MET . . . . . 0.447 ' SD ' ' HB2' ' B' ' 20' ' ' LYS . 38.3 mtp -41.88 -46.14 3.91 Favored 'General case' 0 N--CA 1.499 2.002 0 N-CA-C 119.438 3.125 . . . . 0.0 119.438 -141.436 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 31' ' ' ASN . . . . . . . . . . . . . 25.2 t-20 -43.43 -44.52 5.83 Favored 'General case' 0 CA--C 1.598 2.796 0 CA-C-N 125.245 3.657 . . . . 0.0 115.712 164.179 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 32' ' ' SER . . . . . . . . . . . . 0.282 62.9 m -58.01 -58.23 9.33 Favored 'General case' 0 N--CA 1.498 1.96 0 N-CA-C 120.914 3.672 . . . . 0.0 120.914 149.688 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -64.9 -61.99 1.83 Allowed 'General case' 0 N--CA 1.515 2.795 0 CA-C-N 123.76 2.982 . . . . 0.0 114.835 177.637 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 34' ' ' LEU . . . . . 0.791 HD12 ' CZ ' ' A' ' 7' ' ' PHE . 0.0 OUTLIER -38.8 -53.96 1.64 Allowed 'General case' 0 CA--C 1.549 0.915 0 CA-C-O 115.004 -2.426 . . . . 0.0 107.934 170.726 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 35' ' ' LEU . . . . . 0.506 ' HG ' ' CE1' ' A' ' 9' ' ' PHE . 11.1 mt -65.09 -60.31 3.16 Favored 'General case' 0 N--CA 1.485 1.293 0 CA-C-N 124.448 3.295 . . . . 0.0 115.665 -178.156 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 36' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -53.0 -41.46 64.66 Favored 'General case' 0 CA--C 1.558 1.253 0 CA-C-O 117.213 -1.375 . . . . 0.0 113.932 175.073 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 37' ' ' ILE . . . . . 0.441 ' HA ' ' HB3' ' B' ' 40' ' ' ASP . 1.6 tp -75.08 -24.91 18.0 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.405 0 N-CA-C 116.37 1.989 . . . . 0.0 116.37 173.165 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 38' ' ' VAL . . . . . 0.521 HG11 HD11 ' A' ' 19' ' ' LEU . 2.2 t -81.15 -49.76 17.65 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.809 0 C-N-CA 127.487 2.315 . . . . 0.0 111.03 175.643 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 9.7 tt0 -44.27 -47.88 9.45 Favored 'General case' 0 CA--C 1.559 1.3 0 C-N-CA 124.771 1.229 . . . . 0.0 113.649 153.814 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 40' ' ' ASP . . . . . 0.441 ' HB3' ' HA ' ' B' ' 37' ' ' ILE 0.582 0.7 OUTLIER -53.09 -59.01 5.09 Favored 'General case' 0 CA--C 1.553 1.081 0 N-CA-C 116.092 1.886 . . . . 0.0 116.092 157.317 . . . . . . . . 4 4 . 1 . 015 nuclear nobuild full ' B' B ' 41' ' ' ALA . . . . . . . . . . . . . . . -67.4 -37.34 82.96 Favored 'General case' 0 CA--C 1.555 1.147 0 N-CA-C 116.591 2.071 . . . . 0.0 116.591 -159.465 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . 0.331 1.2 pp -89.05 -25.28 22.03 Favored 'General case' 0 N--CA 1.49 1.553 0 N-CA-C 119.321 3.082 . . . . 0.0 119.321 157.418 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 43' ' ' SER . . . . . . . . . . . . . 49.4 m -150.54 53.01 0.88 Allowed 'General case' 0 N--CA 1.496 1.828 0 CA-C-N 123.116 2.689 . . . . 0.0 116.831 -176.09 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 44' ' ' LYS . . . . . . . . . . . . 0.275 67.3 mttm -131.58 104.66 14.48 Favored Pre-proline 0 N--CA 1.518 2.939 0 N-CA-C 117.521 2.415 . . . . 0.0 117.521 158.229 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 45' ' ' PRO . . . . . . . . . . . . . 8.3 Cg_exo -66.64 163.35 33.25 Favored 'Trans proline' 0 CA--C 1.572 2.397 0 C-N-CA 122.453 2.102 . . . . 0.0 115.032 143.427 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 46' ' ' SER . . . . . . . . . . . . . 57.9 m -147.55 -77.16 0.01 OUTLIER Pre-proline 0 N--CA 1.497 1.882 0 CA-C-O 115.519 -2.182 . . . . 0.0 110.837 163.271 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 78.6 Cg_endo -74.98 77.51 3.1 Favored 'Trans proline' 0 CA--C 1.567 2.154 0 CA-C-N 125.978 3.171 . . . . 0.0 111.608 164.597 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 48' ' ' VAL . . . . . . . . . . . . 0.295 12.0 p -81.93 68.38 0.52 Allowed 'Isoleucine or valine' 0 N--CA 1.5 2.05 0 CA-C-O 123.924 1.821 . . . . 0.0 114.54 -166.163 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 49' ' ' THR . . . . . . . . . . . . . 44.0 p -121.33 71.52 0.96 Allowed 'General case' 0 N--CA 1.496 1.847 0 CA-C-N 114.051 -1.431 . . . . 0.0 109.68 -163.517 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 50' ' ' GLY . . . . . . . . . . . . . . . 78.36 45.87 9.51 Favored Glycine 0 N--CA 1.497 2.741 0 N-CA-C 116.65 1.42 . . . . 0.0 116.65 -164.81 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 51' ' ' TYR . . . . . . . . . . . . 0.375 0.0 OUTLIER -88.29 -28.99 20.71 Favored 'General case' 0 CA--C 1.593 2.613 0 N-CA-C 116.597 2.073 . . . . 0.0 116.597 -161.225 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 52' ' ' ARG . . . . . . . . . . . . 0.722 39.1 ttt180 127.01 -115.9 0.0 OUTLIER 'General case' 0 N--CA 1.523 3.225 0 N-CA-C 119.331 3.086 . . . . 0.0 119.331 149.919 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 53' ' ' ASN . . . . . . . . . . . . . 6.7 p-10 178.37 155.07 0.38 Allowed 'General case' 0 N--CA 1.501 2.079 2 O-C-N 110.968 -7.333 . . . . 0.0 120.564 16.8 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 54' ' ' ASP . . . . . 0.485 ' CA ' ' HB2' ' A' ' 53' ' ' ASN 1.848 0.0 OUTLIER -48.7 19.88 0.0 OUTLIER 'General case' 0 N--CA 1.498 1.974 1 N-CA-C 123.111 4.486 . . . . 0.0 123.111 165.879 . . . . . . . . 5 4 . 1 . 015 nuclear nobuild full ' B' B ' 55' ' ' ALA . . . . . . . . . . . . 0.309 . . -82.77 -7.84 59.63 Favored 'General case' 0 CA--C 1.574 1.872 0 O-C-N 118.705 -2.497 . . . . 0.0 115.222 142.441 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 56' ' ' GLU . . . . . 0.539 ' C ' ' HB3' ' B' ' 59' ' ' ALA . 3.9 mm-40 -45.88 -3.11 0.01 OUTLIER 'General case' 0 CA--C 1.592 2.588 1 N-CA-C 123.075 4.472 . . . . 0.0 123.075 120.563 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 57' ' ' ARG . . . . . 0.424 ' HB2' ' CB ' ' B' ' 54' ' ' ASP 0.266 16.9 ttt-85 -112.29 -50.43 2.9 Favored 'General case' 0 N--CA 1.501 2.088 0 O-C-N 119.105 -2.247 . . . . 0.0 111.455 -177.866 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 58' ' ' LEU . . . . . 0.544 HD22 HG12 ' A' ' 37' ' ' ILE 0.252 1.7 mt -49.89 -35.53 23.91 Favored 'General case' 0 CA--C 1.586 2.362 0 CA-C-N 114.936 -1.029 . . . . 0.0 112.513 155.701 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 59' ' ' ALA . . . . . 0.539 ' HB3' ' C ' ' B' ' 56' ' ' GLU . . . -44.78 -78.27 0.02 OUTLIER 'General case' 0 N--CA 1.488 1.441 0 N-CA-C 117.779 2.511 . . . . 0.0 117.779 143.938 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -87.68 4.13 45.2 Favored 'General case' 0 N--CA 1.489 1.496 0 N-CA-C 117.705 2.483 . . . . 0.0 117.705 -163.586 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 19.1 tt0 -91.9 -28.93 16.96 Favored 'General case' 0 CA--C 1.559 1.293 0 CA-C-O 116.165 -1.874 . . . . 0.0 112.609 150.831 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 62' ' ' GLN . . . . . 0.77 ' O ' HG13 ' B' ' 66' ' ' VAL 0.29 0.0 OUTLIER -78.69 -59.49 2.76 Favored 'General case' 0 C--N 1.37 1.469 0 CA-C-N 124.982 3.537 . . . . 0.0 109.086 176.551 . . . . . . . . 4 4 . 1 . 015 nuclear nobuild full ' B' B ' 63' ' ' SER . . . . . . . . . . . . . 48.3 t -107.58 71.79 0.83 Allowed 'General case' 0 CA--C 1.552 1.046 0 CA-C-O 122.838 1.304 . . . . 0.0 111.81 160.12 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 64' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -82.01 -58.39 2.99 Favored 'General case' 0 CA--C 1.563 1.459 0 O-C-N 118.524 -2.61 . . . . 0.0 116.925 77.254 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 18.2 mt -75.86 -4.96 43.69 Favored 'General case' 0 N--CA 1.506 2.328 0 N-CA-C 118.351 2.723 . . . . 0.0 118.351 -151.781 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 66' ' ' VAL . . . . . 0.77 HG13 ' O ' ' B' ' 62' ' ' GLN 0.271 32.5 m . . . . . 0 N--CA 1.508 2.444 0 N-CA-C 117.611 2.449 . . . . 0.0 117.611 167.293 . . . . . . . . 2 2 . 1 stop_ save_